data_2lzq_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 2lzq _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 6' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 . . . . . 0 N--CA 1.499 1.992 0 CA-C-O 120.711 0.291 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -59.67 -45.68 91.34 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.41 -0.806 . . . . 0.0 109.498 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -65.44 -41.82 93.05 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.567 -0.708 . . . . 0.0 109.192 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.12 -46.45 88.99 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.638 -0.664 . . . . 0.0 109.718 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -67.06 -46.05 75.51 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.607 -0.683 . . . . 0.0 109.618 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -54.61 -39.14 67.58 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.503 -0.748 . . . . 0.0 110.142 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -66.68 -38.59 87.13 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.573 -0.704 . . . . 0.0 110.466 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -44.78 96.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.344 -0.847 . . . . 0.0 109.698 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -72.95 -39.05 66.52 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.288 -0.883 . . . . 0.0 109.693 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.9 -46.89 71.55 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.525 -0.734 . . . . 0.0 109.659 179.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -67.09 -45.23 77.89 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.539 -0.726 . . . . 0.0 109.123 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -56.06 -48.45 76.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.726 -0.609 . . . . 0.0 109.488 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -66.18 -39.65 89.87 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.478 -0.764 . . . . 0.0 110.035 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.13 -44.01 67.4 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.455 -0.778 . . . . 0.0 110.786 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.8 m -87.36 -26.74 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 121.311 -0.868 . . . . 0.0 111.048 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.1 m -77.34 -35.48 54.64 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.105 -0.997 . . . . 0.0 110.426 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.3 mt . . . . . 0 N--CA 1.495 1.809 0 O-C-N 121.472 -0.768 . . . . 0.0 109.928 179.887 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.496 1.845 0 CA-C-O 120.722 0.296 . . . . 0.0 110.32 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -55.98 -45.34 79.01 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.474 -0.766 . . . . 0.0 109.676 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -37.02 62.96 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.669 -0.645 . . . . 0.0 109.518 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.8 mt -65.74 -43.85 87.73 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.422 -0.799 . . . . 0.0 109.942 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.404 ' CE3' ' HG2' ' A' ' 11' ' ' GLN . 15.4 t90 -69.06 -39.53 79.06 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.477 -0.764 . . . . 0.0 109.82 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.404 ' HG2' ' CE3' ' A' ' 10' ' ' TRP . 2.4 mm100 -58.15 -42.93 86.99 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.386 -0.821 . . . . 0.0 110.071 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.23 -22.04 16.47 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.438 -0.789 . . . . 0.0 110.971 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.535 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -86.73 -57.33 3.02 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.295 -0.878 . . . . 0.0 110.721 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -81.39 -43.74 18.55 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.502 -0.749 . . . . 0.0 111.971 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.06 -38.82 62.8 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.174 -0.954 . . . . 0.0 110.291 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.3 t90 -70.45 -49.54 47.55 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.483 -0.76 . . . . 0.0 109.206 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -57.77 -45.96 85.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.689 -0.632 . . . . 0.0 109.919 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.49 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 3.7 m95 -65.12 -37.12 86.45 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.431 -0.793 . . . . 0.0 110.187 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -42.56 94.58 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.233 -0.917 . . . . 0.0 110.637 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.5 m -87.23 -6.03 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.126 -0.984 . . . . 0.0 111.516 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.6 m -107.95 -38.6 5.77 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.931 -1.106 . . . . 0.0 110.829 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.483 HD13 ' HB3' ' A' ' 18' ' ' TRP . 16.9 mt . . . . . 0 N--CA 1.499 1.991 0 O-C-N 121.356 -0.84 . . . . 0.0 111.332 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 . . . . . 0 N--CA 1.496 1.861 0 N-CA-C 110.468 -0.197 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.5 p -57.21 -48.09 79.66 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.433 -0.792 . . . . 0.0 109.675 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -65.22 -39.49 92.83 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.675 -0.641 . . . . 0.0 109.341 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -65.38 -49.21 70.17 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.665 -0.647 . . . . 0.0 109.932 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.5 t90 -62.51 -45.7 91.78 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.703 -0.623 . . . . 0.0 110.132 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.36 -40.61 74.81 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.386 -0.821 . . . . 0.0 109.782 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -39.87 81.56 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.7 -0.625 . . . . 0.0 110.328 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.508 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -57.46 -60.08 4.19 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.728 -0.607 . . . . 0.0 110.417 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.413 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 13.1 mt-10 -71.73 -28.11 63.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.504 -0.747 . . . . 0.0 111.059 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -54.12 -50.71 66.26 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.347 -0.846 . . . . 0.0 109.53 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.3 t90 -68.81 -41.59 78.45 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.366 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.413 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 34.2 t80 -57.43 -55.38 35.6 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.63 -0.669 . . . . 0.0 109.761 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -64.64 -35.27 80.49 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.431 -0.793 . . . . 0.0 110.059 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -56.02 -48.44 75.96 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.36 -0.838 . . . . 0.0 110.717 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 30.6 m -87.06 -25.06 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 O-C-N 121.231 -0.918 . . . . 0.0 111.188 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.3 m -76.23 -39.67 53.96 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.2 -0.937 . . . . 0.0 110.334 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.4 mt . . . . . 0 N--CA 1.498 1.963 0 O-C-N 121.533 -0.73 . . . . 0.0 110.923 179.853 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 120.493 0.187 . . . . 0.0 110.828 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.5 p -52.6 -35.63 54.7 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.426 -0.796 . . . . 0.0 110.451 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -99.59 -32.36 11.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.558 -0.714 . . . . 0.0 109.862 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 13' ' ' TRP . 1.3 mm? -69.25 -35.89 76.59 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.428 -0.795 . . . . 0.0 110.743 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 22.8 t90 -57.66 -48.48 79.38 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.497 -0.752 . . . . 0.0 110.404 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -47.89 82.2 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.482 -0.761 . . . . 0.0 110.033 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -37.54 84.56 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.471 -0.768 . . . . 0.0 110.045 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.445 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -58.69 -57.24 13.88 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 121.572 0.701 . . . . 0.0 109.992 179.504 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -71.5 -30.32 65.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.843 -0.535 . . . . 0.0 110.873 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -53.35 -49.16 67.71 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.315 -0.866 . . . . 0.0 109.531 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.9 t90 -69.02 -43.87 73.87 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.553 -0.717 . . . . 0.0 109.202 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -57.6 -56.28 23.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.741 -0.599 . . . . 0.0 110.125 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -60.88 -34.77 75.13 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.469 -0.77 . . . . 0.0 110.049 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -60.71 -42.36 97.06 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.497 -0.752 . . . . 0.0 110.772 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.2 m -94.69 -10.04 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.321 -0.862 . . . . 0.0 111.341 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.9 m -95.99 -38.56 10.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.09 -1.006 . . . . 0.0 110.513 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.8 mt . . . . . 0 N--CA 1.499 1.983 0 O-C-N 121.469 -0.769 . . . . 0.0 111.084 -179.89 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.566 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 63.7 t30 . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 111.271 0.1 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -52.07 -51.29 58.58 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.179 -0.95 . . . . 0.0 109.961 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -73.68 -40.9 63.32 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.489 -0.757 . . . . 0.0 109.584 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 30.0 mt -59.06 -37.8 77.89 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.598 -0.689 . . . . 0.0 110.452 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -67.82 -48.99 64.67 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.498 -0.751 . . . . 0.0 110.16 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -64.11 -42.64 96.8 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.413 -0.804 . . . . 0.0 110.132 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -24.82 67.14 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.446 -0.784 . . . . 0.0 110.248 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.487 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -85.46 -54.5 4.53 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.437 -0.789 . . . . 0.0 110.146 179.826 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.58 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 8.1 mt-10 -69.83 -23.79 63.36 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.627 -0.671 . . . . 0.0 111.529 -179.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -52.26 -55.1 23.47 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.072 -1.018 . . . . 0.0 109.423 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -67.76 -41.28 83.55 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.566 -0.709 . . . . 0.0 109.461 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.58 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 29.9 t80 -56.21 -54.96 39.06 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.784 -0.573 . . . . 0.0 110.439 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.478 ' HB3' HD11 ' A' ' 22' ' ' LEU . 21.1 m95 -61.35 -41.06 96.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.372 -0.83 . . . . 0.0 110.478 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -53.92 -42.98 69.35 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.312 -0.868 . . . . 0.0 111.502 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.4 m -89.79 -22.13 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.136 -0.977 . . . . 0.0 111.018 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 64.5 m -82.08 -26.65 33.46 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.112 -0.992 . . . . 0.0 110.444 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.478 HD11 ' HB3' ' A' ' 18' ' ' TRP . 71.1 mt . . . . . 0 N--CA 1.498 1.953 0 O-C-N 121.359 -0.838 . . . . 0.0 110.844 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 . . . . . 0 N--CA 1.497 1.876 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 t -56.73 -52.75 63.77 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.299 -0.876 . . . . 0.0 109.268 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -60.77 -44.02 97.29 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.657 -0.652 . . . . 0.0 109.283 178.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.1 mt -59.03 -41.52 88.02 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.883 -0.511 . . . . 0.0 110.225 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 40.2 t90 -62.61 -48.43 79.44 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.479 -0.763 . . . . 0.0 110.226 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -58.16 -36.72 73.43 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.387 -0.821 . . . . 0.0 110.282 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -69.97 -37.94 75.94 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.424 -0.798 . . . . 0.0 110.123 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.488 ' CD1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -58.51 -41.72 86.07 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.546 -0.721 . . . . 0.0 109.326 179.577 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.488 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 45.5 mt-10 -67.24 -48.31 68.17 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.478 -0.764 . . . . 0.0 109.375 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -56.22 -49.21 74.76 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.816 -0.553 . . . . 0.0 109.612 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 8.8 t90 -62.37 -47.11 85.64 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.654 -0.654 . . . . 0.0 109.397 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -57.83 -51.39 69.8 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.7 -0.625 . . . . 0.0 109.827 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.5 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 3.7 m95 -63.52 -30.0 71.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.418 -0.801 . . . . 0.0 110.351 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -40.84 75.58 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.096 -1.003 . . . . 0.0 110.428 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 22.3 m -88.56 -26.97 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.229 -0.92 . . . . 0.0 110.773 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 90.5 m -84.31 -48.33 9.83 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.286 -0.884 . . . . 0.0 110.472 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 18' ' ' TRP . 50.3 mt . . . . . 0 N--CA 1.497 1.901 0 O-C-N 121.397 -0.814 . . . . 0.0 109.998 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.501 2.081 0 CA-C-O 120.604 0.24 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.1 t -58.62 -46.32 87.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.306 -0.871 . . . . 0.0 109.611 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.489 ' CZ ' ' HD2' ' A' ' 12' ' ' ARG . 21.7 t80 -67.5 -43.84 79.91 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.569 -0.707 . . . . 0.0 109.305 178.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.601 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 1.4 mm? -60.86 -44.84 96.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.67 -0.644 . . . . 0.0 110.241 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -61.17 -40.69 94.83 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.635 -0.666 . . . . 0.0 110.079 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -57.0 -45.4 83.03 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.438 -0.789 . . . . 0.0 110.155 179.799 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.601 ' HD3' ' HA ' ' A' ' 9' ' ' LEU . 29.5 mtp85 -54.37 -41.83 69.62 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.754 -0.591 . . . . 0.0 110.409 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.455 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -54.37 -60.05 3.86 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.392 0.615 . . . . 0.0 110.051 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -68.51 -31.39 70.61 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.593 -0.692 . . . . 0.0 110.544 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -52.83 -43.83 66.28 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.448 -0.783 . . . . 0.0 109.579 179.197 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.9 t90 -68.63 -47.09 67.51 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -57.28 -52.14 66.53 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.804 -0.56 . . . . 0.0 109.679 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.466 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 5.0 m95 -63.19 -33.3 75.18 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.33 -0.856 . . . . 0.0 110.151 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -64.12 -41.0 97.4 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.453 -0.78 . . . . 0.0 110.681 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.7 m -93.83 -18.84 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.224 -0.922 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.1 m -91.84 -53.35 4.32 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.002 -1.061 . . . . 0.0 109.925 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.3 mt . . . . . 0 N--CA 1.496 1.827 0 O-C-N 121.498 -0.751 . . . . 0.0 110.56 179.54 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 120.89 0.376 . . . . 0.0 110.047 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.3 m -57.6 -52.79 63.99 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.602 -0.686 . . . . 0.0 110.747 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.485 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -66.11 -27.86 68.37 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.377 -0.827 . . . . 0.0 110.149 179.632 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.485 HD11 ' CZ ' ' A' ' 8' ' ' TYR . 3.0 tp -70.55 -41.44 72.48 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.513 -0.742 . . . . 0.0 109.575 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.5 t90 -60.53 -47.38 86.41 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.506 -0.746 . . . . 0.0 109.371 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -60.05 -37.05 78.68 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.454 -0.779 . . . . 0.0 109.901 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.6 mtp85 -63.09 -39.15 93.87 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.501 -0.749 . . . . 0.0 110.159 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.452 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -63.2 -46.73 85.66 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.608 -0.682 . . . . 0.0 109.495 179.513 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -70.19 -36.63 74.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.408 -0.807 . . . . 0.0 109.699 179.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.415 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.3 OUTLIER -57.36 -48.96 77.67 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 178.628 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.5 t90 -69.76 -41.63 74.92 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.615 -0.678 . . . . 0.0 109.194 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.452 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 57.8 t80 -55.15 -58.93 5.68 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.704 -0.622 . . . . 0.0 109.416 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 23.7 m95 -61.4 -33.2 73.28 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.511 -0.743 . . . . 0.0 110.111 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 2.2 t30 -54.4 -37.51 65.12 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.487 -0.758 . . . . 0.0 110.463 179.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -102.91 -27.52 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.49 -0.756 . . . . 0.0 110.782 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 99.9 m -73.2 -39.12 65.82 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.251 -0.906 . . . . 0.0 110.862 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.7 mt . . . . . 0 N--CA 1.501 2.104 0 O-C-N 121.511 -0.743 . . . . 0.0 110.929 -179.728 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 . . . . . 0 N--CA 1.498 1.95 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.3 m -61.92 -44.41 96.83 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.319 -0.863 . . . . 0.0 109.728 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -60.79 -41.31 95.33 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.551 -0.718 . . . . 0.0 109.308 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.2 OUTLIER -71.36 -39.41 71.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.699 -0.625 . . . . 0.0 109.996 179.396 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -64.63 -47.47 78.43 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.637 -0.665 . . . . 0.0 110.097 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -54.84 -40.42 69.6 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.369 -0.832 . . . . 0.0 110.363 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -41.59 87.08 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.561 -0.712 . . . . 0.0 110.341 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.409 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -59.55 -46.87 87.61 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.343 -0.848 . . . . 0.0 109.557 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 2.8 mt-10 -70.88 -37.77 73.06 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.343 -0.848 . . . . 0.0 110.038 179.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -46.84 72.01 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.544 -0.723 . . . . 0.0 109.546 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -64.35 -45.95 85.58 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.524 -0.735 . . . . 0.0 109.335 178.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -52.46 -47.49 66.44 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.781 -0.575 . . . . 0.0 109.664 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 22.2 m95 -63.14 -38.05 89.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.579 -0.701 . . . . 0.0 110.147 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -54.79 -35.43 63.85 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.223 -0.923 . . . . 0.0 110.94 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.4 m -106.72 -2.78 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.075 -1.015 . . . . 0.0 111.617 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.2 m -113.37 -16.81 12.41 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.033 -1.042 . . . . 0.0 111.341 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.3 mt . . . . . 0 N--CA 1.501 2.117 0 O-C-N 121.2 -0.937 . . . . 0.0 110.645 -179.962 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 CA-C-O 120.631 0.253 . . . . 0.0 110.417 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.6 p -58.15 -53.15 61.47 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.452 -0.78 . . . . 0.0 109.421 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 32.1 t80 -65.39 -39.39 92.16 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.43 -34.82 74.51 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.712 -0.618 . . . . 0.0 109.851 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -73.55 -40.4 63.99 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.463 -0.773 . . . . 0.0 109.654 178.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.439 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.95 -36.21 78.77 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.556 -0.715 . . . . 0.0 109.945 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -55.29 -39.44 69.88 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.56 -0.713 . . . . 0.0 110.328 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.457 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -56.26 -61.03 2.67 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-O 121.387 0.613 . . . . 0.0 110.506 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.41 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 20.1 mt-10 -69.53 -30.44 68.27 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.578 -0.701 . . . . 0.0 110.823 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.439 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -52.38 -49.48 64.34 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.377 -0.827 . . . . 0.0 109.41 179.29 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 15.8 t90 -69.2 -43.61 73.81 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.548 -0.72 . . . . 0.0 109.461 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.41 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 34.5 t80 -55.92 -55.36 33.52 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.658 -0.651 . . . . 0.0 109.578 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 40.1 m95 -63.05 -33.22 74.98 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.478 -0.764 . . . . 0.0 110.112 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 16.5 t-20 -59.02 -39.45 81.95 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.509 -0.744 . . . . 0.0 110.901 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.2 m -101.63 2.65 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 O-C-N 121.246 -0.909 . . . . 0.0 111.257 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.6 m -106.2 -38.36 6.28 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.089 -1.007 . . . . 0.0 110.472 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 80.2 mt . . . . . 0 N--CA 1.497 1.918 0 O-C-N 121.464 -0.772 . . . . 0.0 110.386 -179.841 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.947 0 CA-C-O 120.57 0.224 . . . . 0.0 110.85 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -50.71 -55.77 15.06 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.407 -0.808 . . . . 0.0 110.796 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -74.37 -42.97 58.42 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.463 -0.773 . . . . 0.0 109.858 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.0 mt -56.12 -40.08 73.2 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.66 -0.65 . . . . 0.0 110.782 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -72.32 -48.82 39.07 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.383 -0.823 . . . . 0.0 110.044 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.445 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 6.1 tp60 -63.04 -54.72 33.73 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.416 -0.802 . . . . 0.0 110.652 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.23 -38.23 39.48 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.457 -0.777 . . . . 0.0 110.812 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.515 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -59.89 -57.8 11.32 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.429 -0.794 . . . . 0.0 110.798 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -77.35 -42.52 36.26 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.712 -0.617 . . . . 0.0 111.469 -178.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -53.42 -43.36 67.9 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.18 -0.95 . . . . 0.0 109.588 179.619 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -69.17 -46.04 68.51 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.455 -0.778 . . . . 0.0 109.13 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -59.18 -43.78 92.17 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.497 -0.752 . . . . 0.0 110.156 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.464 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 3.9 m95 -75.21 -13.67 60.47 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.409 -0.807 . . . . 0.0 111.064 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -101.68 -24.48 14.09 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.849 -1.157 . . . . 0.0 110.659 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 48.0 t -105.89 -40.9 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.294 -0.879 . . . . 0.0 111.037 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.2 m -77.86 -34.35 51.76 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.196 -0.94 . . . . 0.0 111.141 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 31.0 mt . . . . . 0 N--CA 1.498 1.936 0 O-C-N 121.376 -0.827 . . . . 0.0 110.033 -179.957 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 33.6 m120 . . . . . 0 N--CA 1.499 1.978 0 CA-C-O 120.742 0.306 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.3 t -58.42 -47.61 83.37 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.403 -0.81 . . . . 0.0 109.533 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -66.53 -40.37 89.09 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.746 -0.596 . . . . 0.0 109.705 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.418 HD21 ' HA ' ' A' ' 9' ' ' LEU . 0.6 OUTLIER -54.74 -36.98 65.36 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.685 -0.634 . . . . 0.0 110.669 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -83.15 -45.97 13.29 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.376 -0.828 . . . . 0.0 109.925 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.428 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.98 -48.09 83.45 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.422 -0.799 . . . . 0.0 110.177 -179.865 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.25 -39.34 69.66 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.46 -0.775 . . . . 0.0 110.008 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.481 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -55.76 -60.82 2.91 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.373 0.606 . . . . 0.0 110.349 179.633 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -70.86 -31.16 67.76 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.84 -0.538 . . . . 0.0 110.856 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.7 OUTLIER -50.74 -46.36 59.21 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.422 -0.799 . . . . 0.0 109.62 179.237 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.476 ' CD1' HG21 ' A' ' 20' ' ' VAL . 6.7 t90 -73.04 -44.57 60.59 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.506 -0.746 . . . . 0.0 109.177 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -55.18 -45.06 75.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.538 -0.726 . . . . 0.0 109.99 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.443 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 5.5 m95 -73.51 -43.33 60.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.421 -0.799 . . . . 0.0 110.193 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -62.73 -36.14 82.04 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.361 -0.837 . . . . 0.0 110.82 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.476 HG21 ' CD1' ' A' ' 16' ' ' TRP . 90.2 t -84.01 -36.65 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.216 -0.927 . . . . 0.0 110.78 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.3 m -78.91 -42.51 26.96 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.126 -0.984 . . . . 0.0 110.722 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 N--CA 1.498 1.944 0 O-C-N 121.38 -0.825 . . . . 0.0 110.721 -179.762 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.498 1.967 0 CA-C-O 120.505 0.193 . . . . 0.0 110.68 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -54.15 -46.64 72.33 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.417 -0.802 . . . . 0.0 109.774 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -71.43 -40.14 70.59 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.548 -0.72 . . . . 0.0 109.578 178.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -61.69 -48.73 79.47 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.587 -0.696 . . . . 0.0 109.833 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -65.9 -39.57 90.74 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.49 -0.756 . . . . 0.0 109.515 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -60.82 -43.26 98.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.476 -0.765 . . . . 0.0 110.189 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -24.48 53.57 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.579 -0.701 . . . . 0.0 110.974 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.517 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -78.16 -60.6 2.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.256 -0.903 . . . . 0.0 110.236 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -71.36 -28.89 64.37 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.521 -0.737 . . . . 0.0 111.382 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.429 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 2.4 t-20 -53.31 -51.52 62.07 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.174 -0.954 . . . . 0.0 109.539 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -65.33 -43.75 89.97 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -55.59 -59.26 5.09 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.709 -0.619 . . . . 0.0 109.808 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.42 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 6.9 m95 -60.53 -33.12 72.19 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.368 -0.832 . . . . 0.0 110.346 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -57.04 -39.94 75.8 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.308 -0.87 . . . . 0.0 110.217 179.511 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.1 m -95.53 -29.44 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.317 -0.865 . . . . 0.0 110.499 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 94.2 m -68.95 -42.41 76.72 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.209 -0.932 . . . . 0.0 109.987 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.4 mt . . . . . 0 N--CA 1.495 1.812 0 O-C-N 121.486 -0.759 . . . . 0.0 110.237 -179.975 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 . . . . . 0 N--CA 1.498 1.944 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.9 m -58.94 -49.75 76.64 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.387 -0.821 . . . . 0.0 109.406 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -65.02 -45.87 83.73 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.672 -0.642 . . . . 0.0 109.356 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -58.29 -43.95 88.27 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.718 -0.614 . . . . 0.0 109.875 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -67.54 -42.9 81.96 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.584 -0.698 . . . . 0.0 109.509 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 19.5 mm-40 -64.67 -50.94 65.06 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.516 -0.74 . . . . 0.0 110.126 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -53.17 -34.96 59.13 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.503 -0.748 . . . . 0.0 110.347 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.493 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -61.3 -55.26 33.78 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.565 -0.709 . . . . 0.0 110.676 179.814 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -78.9 -42.71 26.48 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.699 -0.626 . . . . 0.0 111.363 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -55.6 -38.3 69.24 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.467 -0.771 . . . . 0.0 110.301 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -63.66 -49.0 74.91 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.412 -0.805 . . . . 0.0 109.453 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -56.22 -51.01 69.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.708 -0.62 . . . . 0.0 109.79 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.407 ' CE3' HD12 ' A' ' 22' ' ' LEU . 30.9 m95 -63.41 -31.83 73.09 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.525 -0.735 . . . . 0.0 110.769 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.15 -41.76 97.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.299 -0.876 . . . . 0.0 110.51 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.6 m -89.76 -14.42 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.326 -0.858 . . . . 0.0 110.969 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.2 m -92.76 -35.41 13.45 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.124 -0.985 . . . . 0.0 110.636 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.407 HD12 ' CE3' ' A' ' 18' ' ' TRP . 31.7 mt . . . . . 0 N--CA 1.496 1.857 0 O-C-N 121.313 -0.867 . . . . 0.0 110.326 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.6 m120 . . . . . 0 N--CA 1.497 1.885 0 CA-C-O 120.721 0.296 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.9 t -58.56 -52.51 65.37 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.481 -0.762 . . . . 0.0 110.783 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.467 ' CZ ' HD13 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -63.07 -30.84 71.91 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.369 -0.832 . . . . 0.0 110.266 179.907 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.467 HD13 ' CZ ' ' A' ' 8' ' ' TYR . 3.6 tp -67.59 -46.94 71.17 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.368 -0.832 . . . . 0.0 109.732 179.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.0 t-105 -60.02 -37.24 79.16 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.621 -0.674 . . . . 0.0 109.379 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.502 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.64 -46.81 88.9 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.568 -0.707 . . . . 0.0 109.592 179.053 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.41 -39.24 56.85 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.74 -0.6 . . . . 0.0 110.483 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.492 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -59.42 -57.46 12.91 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.598 -0.689 . . . . 0.0 110.645 -179.914 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -75.48 -40.0 57.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.598 -0.689 . . . . 0.0 111.603 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.502 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -51.86 -43.33 63.21 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.304 -0.873 . . . . 0.0 110.179 -179.825 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.1 t90 -66.61 -48.9 68.06 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.413 -0.804 . . . . 0.0 109.24 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -56.59 -51.76 67.4 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.796 -0.565 . . . . 0.0 109.877 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.433 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 6.3 m95 -63.87 -30.42 71.51 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.528 -0.732 . . . . 0.0 110.428 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.47 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 8.7 t-20 -65.14 -46.45 80.87 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.268 -0.895 . . . . 0.0 110.65 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.5 m -86.36 -26.05 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.283 -0.885 . . . . 0.0 111.133 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.7 m -78.81 -36.96 41.89 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.215 -0.928 . . . . 0.0 110.648 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 mt . . . . . 0 N--CA 1.499 1.977 0 O-C-N 121.333 -0.854 . . . . 0.0 110.838 -179.965 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.443 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 1.3 t-20 . . . . . 0 N--CA 1.497 1.887 0 CA-C-O 120.61 0.243 . . . . 0.0 110.508 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.1 t -57.1 -44.29 83.05 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.47 -0.769 . . . . 0.0 109.968 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -77.96 -37.27 47.88 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.449 -0.782 . . . . 0.0 109.598 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 12.3 mt -56.5 -41.87 77.37 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.677 -0.639 . . . . 0.0 110.281 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.415 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 4.5 t-105 -58.79 -42.95 90.27 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.447 -0.783 . . . . 0.0 109.584 179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.45 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -61.5 -44.36 97.2 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.435 -0.79 . . . . 0.0 109.433 179.129 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -54.59 -39.15 67.56 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.712 -0.618 . . . . 0.0 110.144 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.495 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -56.79 -60.05 4.13 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.39 0.614 . . . . 0.0 110.248 179.747 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.66 -33.49 72.66 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.556 -0.715 . . . . 0.0 110.567 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.45 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -52.19 -43.74 64.33 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.475 -0.766 . . . . 0.0 109.838 179.437 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.0 t90 -70.06 -45.53 66.89 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.54 -0.725 . . . . 0.0 109.224 178.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -58.81 -48.76 80.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.826 -0.546 . . . . 0.0 109.748 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.47 ' HB3' HD13 ' A' ' 22' ' ' LEU . 5.5 m95 -67.5 -33.84 75.93 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.454 -0.779 . . . . 0.0 110.019 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -64.46 -45.01 89.27 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.335 -0.853 . . . . 0.0 110.549 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.9 m -85.08 -24.63 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.21 -0.932 . . . . 0.0 111.263 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 65.9 m -84.46 -40.35 17.83 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.065 -1.022 . . . . 0.0 110.469 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.47 HD13 ' HB3' ' A' ' 18' ' ' TRP . 10.9 mt . . . . . 0 N--CA 1.499 2.019 0 O-C-N 121.435 -0.791 . . . . 0.0 110.829 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.5 m120 . . . . . 0 N--CA 1.496 1.856 0 CA-C-O 120.778 0.323 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.1 t -58.07 -47.75 82.22 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.459 -0.776 . . . . 0.0 109.654 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -69.26 -41.87 76.32 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.55 -0.718 . . . . 0.0 109.836 179.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.89 -40.41 95.31 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.54 -0.725 . . . . 0.0 110.528 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.7 t90 -66.2 -46.88 75.75 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.337 -0.852 . . . . 0.0 110.154 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -37.58 67.74 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.339 -0.851 . . . . 0.0 110.222 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -32.4 68.87 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.569 -0.707 . . . . 0.0 110.394 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.74 -44.89 88.68 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.458 -0.776 . . . . 0.0 109.983 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -70.2 -39.94 74.89 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.327 -0.858 . . . . 0.0 109.964 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.53 -48.26 77.63 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.498 -0.751 . . . . 0.0 109.282 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -68.74 -42.57 77.39 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.597 -0.689 . . . . 0.0 109.452 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.3 -57.84 10.85 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.711 -0.618 . . . . 0.0 110.207 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.444 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.6 m95 -59.52 -37.12 77.51 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.332 -0.855 . . . . 0.0 110.428 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -56.35 -44.91 80.53 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.505 -0.747 . . . . 0.0 110.821 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.5 m -92.74 -31.78 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.3 -0.875 . . . . 0.0 110.976 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.8 m -69.74 -32.19 70.59 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.184 -0.947 . . . . 0.0 110.264 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.444 HD12 ' HB3' ' A' ' 18' ' ' TRP . 10.4 mt . . . . . 0 N--CA 1.491 1.617 0 O-C-N 121.441 -0.787 . . . . 0.0 109.367 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.897 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.9 p -59.68 -48.79 80.27 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.453 -0.78 . . . . 0.0 109.24 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -66.62 -37.73 85.47 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.644 -0.66 . . . . 0.0 109.221 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.5 mt -58.75 -44.78 90.63 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.717 -0.614 . . . . 0.0 109.963 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.7 t90 -62.85 -45.75 91.1 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.645 -0.659 . . . . 0.0 109.366 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -39.79 74.07 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.514 -0.741 . . . . 0.0 110.011 179.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -63.54 -39.75 95.23 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.622 -0.674 . . . . 0.0 110.385 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -45.69 92.73 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.475 -0.766 . . . . 0.0 109.72 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -72.69 -39.05 67.33 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.252 -0.905 . . . . 0.0 109.726 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.63 -42.91 68.29 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.602 -0.686 . . . . 0.0 109.86 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -70.39 -45.12 66.6 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.453 -0.779 . . . . 0.0 109.297 179.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -55.47 -45.88 76.91 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.69 -0.631 . . . . 0.0 109.65 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 25.6 m95 -72.84 -36.52 67.48 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.613 -0.679 . . . . 0.0 109.958 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -53.99 -43.43 69.98 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.547 -0.721 . . . . 0.0 110.651 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.8 m -84.46 -27.93 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.374 -0.829 . . . . 0.0 110.896 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.8 m -80.54 -24.54 39.22 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.219 -0.926 . . . . 0.0 110.917 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.8 mt . . . . . 0 N--CA 1.499 1.999 0 O-C-N 121.305 -0.872 . . . . 0.0 111.366 -179.692 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 120.599 0.238 . . . . 0.0 110.408 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.6 m -52.72 -48.09 66.9 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.462 -0.774 . . . . 0.0 110.232 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -70.03 -43.14 71.93 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.464 -0.773 . . . . 0.0 109.519 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.1 mt -59.57 -43.46 93.59 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.678 -0.639 . . . . 0.0 110.12 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -62.51 -44.94 95.14 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.637 -0.665 . . . . 0.0 110.032 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -59.08 -41.33 87.76 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.283 -0.886 . . . . 0.0 110.103 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -39.49 94.92 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.607 -0.683 . . . . 0.0 110.364 179.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -45.43 93.49 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.471 -0.768 . . . . 0.0 109.94 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -72.59 -34.87 67.72 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.233 -0.917 . . . . 0.0 109.956 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.31 -47.74 72.1 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.524 -0.735 . . . . 0.0 109.521 178.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -74.16 -41.93 60.72 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.519 -0.738 . . . . 0.0 109.582 179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -55.36 -47.99 74.91 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.544 -0.723 . . . . 0.0 110.427 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 21.1 m95 -72.53 -33.42 66.85 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.447 -0.783 . . . . 0.0 110.379 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -58.96 -30.57 68.0 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.364 -0.835 . . . . 0.0 110.774 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.6 m -100.12 -19.94 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.236 -0.915 . . . . 0.0 110.835 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.4 m -88.91 -27.05 21.24 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.237 -0.914 . . . . 0.0 110.782 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.3 mt . . . . . 0 N--CA 1.5 2.042 0 O-C-N 121.269 -0.894 . . . . 0.0 110.969 -179.955 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 . . . . . 0 N--CA 1.497 1.92 0 CA-C-O 120.43 0.157 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 m -54.65 -52.32 62.66 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.36 -0.837 . . . . 0.0 109.747 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -62.73 -42.65 99.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.521 -0.737 . . . . 0.0 109.386 178.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.76 -44.76 90.67 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.634 -0.666 . . . . 0.0 109.901 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -64.81 -42.86 94.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.712 -0.617 . . . . 0.0 109.673 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -61.19 -39.58 90.72 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.289 -0.882 . . . . 0.0 110.312 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -37.27 86.95 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.402 -0.811 . . . . 0.0 110.275 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.414 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -65.79 -46.35 79.02 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.369 -0.832 . . . . 0.0 109.596 179.653 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -68.62 -35.25 77.06 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.399 -0.813 . . . . 0.0 109.932 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -55.83 -53.22 59.38 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.56 -0.713 . . . . 0.0 109.227 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -65.85 -42.25 90.68 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.676 -0.64 . . . . 0.0 109.396 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.414 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 55.4 t80 -54.87 -57.53 11.22 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.715 -0.616 . . . . 0.0 109.828 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.3 m95 -64.52 -32.91 74.75 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.368 -0.832 . . . . 0.0 110.185 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -55.92 -35.31 66.45 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.455 -0.778 . . . . 0.0 110.491 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 30.1 m -104.33 -9.59 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.283 -0.885 . . . . 0.0 111.002 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 67.1 m -93.44 -33.05 13.97 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.188 -0.945 . . . . 0.0 110.496 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 N--CA 1.499 2.002 0 O-C-N 121.407 -0.808 . . . . 0.0 110.911 179.861 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.8 m120 . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 120.452 0.168 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.508 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -63.86 -57.56 9.47 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.044 -1.035 . . . . 0.0 110.006 179.636 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -69.68 -14.74 62.96 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.316 -0.865 . . . . 0.0 111.158 179.69 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -95.82 -28.51 14.7 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.15 -0.969 . . . . 0.0 111.217 -179.595 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -99.84 -48.47 4.68 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.165 -0.959 . . . . 0.0 110.917 -179.656 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -55.02 -32.74 62.05 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.266 -0.896 . . . . 0.0 110.843 -179.542 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -61.09 -38.15 85.24 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.327 -0.858 . . . . 0.0 110.114 179.395 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.78 -45.14 93.22 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.646 -0.659 . . . . 0.0 109.553 179.7 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -69.18 -35.76 76.61 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.394 -0.816 . . . . 0.0 109.897 179.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -49.5 67.41 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.518 -0.739 . . . . 0.0 109.338 179.109 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -69.67 -43.19 73.02 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.492 -0.755 . . . . 0.0 109.279 178.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.76 -53.18 60.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.749 -0.595 . . . . 0.0 110.182 179.848 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -64.42 -36.46 84.23 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.299 -0.876 . . . . 0.0 110.197 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -58.49 -34.24 70.7 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.472 -0.767 . . . . 0.0 111.271 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.4 m -103.17 -27.66 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.206 -0.934 . . . . 0.0 111.115 -179.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.7 m -77.42 -41.65 39.09 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.163 -0.96 . . . . 0.0 110.768 -179.632 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 N--CA 1.501 2.083 0 O-C-N 121.427 -0.796 . . . . 0.0 110.47 179.971 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.7 m120 . . . . . 0 N--CA 1.495 1.806 0 CA-C-O 120.799 0.333 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 57.7 m -61.25 -56.0 25.62 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.526 -0.734 . . . . 0.0 110.718 -179.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.508 ' CZ ' HD13 ' A' ' 9' ' ' LEU . 1.2 p90 -67.2 -26.6 66.7 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.259 -0.901 . . . . 0.0 110.388 179.89 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.508 HD13 ' CZ ' ' A' ' 8' ' ' TYR . 1.4 tp -60.32 -42.86 96.48 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.327 -0.858 . . . . 0.0 109.836 178.949 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.567 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -78.06 -36.92 47.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.361 -0.837 . . . . 0.0 109.841 179.378 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -66.66 -47.6 71.99 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.403 -0.811 . . . . 0.0 109.727 179.385 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.445 ' O ' ' HB3' ' A' ' 16' ' ' TRP . 9.1 tmm_? -59.07 -17.23 24.05 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.487 -0.758 . . . . 0.0 110.337 178.982 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.427 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -83.42 -58.42 2.84 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.314 -0.866 . . . . 0.0 109.888 179.431 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -82.31 -47.69 12.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.811 -0.555 . . . . 0.0 111.515 -178.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.402 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -53.65 -40.12 65.61 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.164 -0.96 . . . . 0.0 110.284 -179.696 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.445 ' HB3' ' O ' ' A' ' 12' ' ' ARG . 9.1 t90 -75.26 -48.51 22.95 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.313 -0.867 . . . . 0.0 109.561 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -57.18 -49.74 75.03 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.597 -0.69 . . . . 0.0 110.309 -179.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.452 ' HE3' ' HA ' ' A' ' 18' ' ' TRP . 4.9 m95 -65.53 -35.43 80.82 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.187 -0.946 . . . . 0.0 110.033 179.664 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.402 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 5.3 t30 -71.66 -36.49 70.67 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.09 -1.006 . . . . 0.0 110.641 179.546 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.4 p -89.93 -20.65 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.383 -0.823 . . . . 0.0 111.07 -179.732 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.1 m -107.78 -59.21 1.87 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.199 -0.938 . . . . 0.0 110.202 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.1 mt . . . . . 0 N--CA 1.5 2.031 0 O-C-N 121.505 -0.747 . . . . 0.0 110.352 179.624 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 31.3 m120 . . . . . 0 N--CA 1.496 1.837 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.0 m -58.08 -46.84 84.78 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.294 -0.879 . . . . 0.0 109.384 179.057 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.492 ' CD2' HD12 ' A' ' 9' ' ' LEU . 10.9 t80 -59.67 -44.66 93.51 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.782 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.492 HD12 ' CD2' ' A' ' 8' ' ' TYR . 0.3 OUTLIER -67.59 -43.86 79.49 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.738 -0.601 . . . . 0.0 109.975 179.551 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.473 ' CE3' ' HG3' ' A' ' 11' ' ' GLN . 19.1 t90 -61.94 -45.11 95.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.668 -0.645 . . . . 0.0 109.665 179.403 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.473 ' HG3' ' CE3' ' A' ' 10' ' ' TRP . 5.0 mt-30 -58.12 -39.11 77.87 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.486 -0.759 . . . . 0.0 110.244 179.692 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.8 mmt-85 -64.7 -42.96 94.93 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.491 -0.756 . . . . 0.0 110.367 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -44.87 91.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.441 -0.787 . . . . 0.0 109.998 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -74.17 -35.89 64.03 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.225 -0.922 . . . . 0.0 110.223 179.54 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -55.45 -47.78 75.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.39 -0.818 . . . . 0.0 109.781 179.472 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.4 t90 -67.08 -46.07 75.42 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.587 -0.696 . . . . 0.0 109.361 179.043 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -55.14 -52.4 63.42 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.723 -0.61 . . . . 0.0 109.723 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -66.79 -31.13 71.56 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.484 -0.76 . . . . 0.0 110.065 179.384 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.448 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 4.3 t30 -57.98 -46.24 85.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.409 -0.807 . . . . 0.0 110.152 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 30.0 m -84.99 -25.89 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.349 -0.845 . . . . 0.0 110.608 179.589 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.2 m -74.37 -37.64 63.41 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.248 -0.907 . . . . 0.0 110.231 179.713 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.6 mt . . . . . 0 N--CA 1.497 1.897 0 O-C-N 121.501 -0.749 . . . . 0.0 110.373 179.93 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 . . . . . 0 N--CA 1.497 1.879 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 t -55.39 -48.7 73.93 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.365 -0.834 . . . . 0.0 109.585 179.615 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -60.65 -43.65 97.35 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.606 -0.684 . . . . 0.0 109.488 178.983 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.05 -43.18 88.26 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.561 -0.712 . . . . 0.0 109.822 179.604 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.429 ' CE3' ' HG3' ' A' ' 11' ' ' GLN . 12.3 t90 -65.79 -42.65 90.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.645 -0.659 . . . . 0.0 109.931 179.492 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.429 ' HG3' ' CE3' ' A' ' 10' ' ' TRP . 10.0 mt-30 -54.14 -46.28 72.21 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.385 -0.822 . . . . 0.0 110.352 179.869 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -64.36 -33.49 75.97 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.655 -0.653 . . . . 0.0 110.8 -179.923 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.488 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -66.85 -44.55 80.72 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.31 -0.869 . . . . 0.0 110.402 -179.63 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.488 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 6.3 mt-10 -75.94 -49.97 16.26 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.193 -0.942 . . . . 0.0 110.922 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.1 -39.5 59.87 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.329 -0.857 . . . . 0.0 110.185 179.893 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.1 t90 -77.16 -45.29 27.23 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.385 -0.822 . . . . 0.0 109.534 179.035 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -55.65 -53.99 49.71 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.628 -0.67 . . . . 0.0 110.033 -179.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.535 ' HB3' HD13 ' A' ' 22' ' ' LEU . 6.1 m95 -59.97 -33.07 71.45 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.22 -0.925 . . . . 0.0 110.075 179.384 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -38.13 80.57 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.424 -0.798 . . . . 0.0 110.995 179.666 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.9 m -103.93 -25.87 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 O-C-N 121.409 -0.807 . . . . 0.0 111.348 -179.391 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.1 m -82.78 -48.37 10.89 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.094 -1.004 . . . . 0.0 110.757 -179.511 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.535 HD13 ' HB3' ' A' ' 18' ' ' TRP . 49.4 mt . . . . . 0 N--CA 1.497 1.892 0 O-C-N 121.427 -0.796 . . . . 0.0 110.207 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 120.897 0.38 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.4 t -62.66 -46.96 85.77 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -0.839 . . . . 0.0 110.059 179.48 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.05 -39.38 83.04 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.444 -0.785 . . . . 0.0 109.806 179.607 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' A' ' 9' ' ' LEU . 0.2 OUTLIER -67.33 -44.31 79.41 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.433 -0.792 . . . . 0.0 109.963 179.336 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.476 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 3.5 t-105 -60.81 -37.75 83.05 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.647 -0.658 . . . . 0.0 110.252 179.721 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.1 -49.76 73.2 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.298 -0.877 . . . . 0.0 109.648 179.573 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -35.86 75.99 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.611 -0.681 . . . . 0.0 109.825 179.037 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.439 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -55.53 -50.81 68.99 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.722 0.772 . . . . 0.0 109.803 179.146 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -78.44 -31.74 48.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.859 -0.526 . . . . 0.0 110.168 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.41 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -49.52 -49.17 47.09 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.601 -0.687 . . . . 0.0 109.818 179.413 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -72.52 -44.58 62.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.624 -0.673 . . . . 0.0 109.297 178.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -53.8 -48.9 69.37 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.839 -0.538 . . . . 0.0 110.148 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.423 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 5.8 m95 -70.2 -39.45 75.18 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.391 -0.818 . . . . 0.0 109.74 179.391 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 7.7 t-20 -62.45 -55.69 25.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.309 -0.869 . . . . 0.0 110.38 179.595 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.6 p -66.52 -22.66 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.334 -0.853 . . . . 0.0 111.641 -179.828 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.1 m -90.79 -36.25 14.37 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.002 -1.061 . . . . 0.0 110.921 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 N--CA 1.498 1.95 0 O-C-N 121.333 -0.854 . . . . 0.0 110.594 -179.674 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.45 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.498 1.957 0 CA-C-O 120.661 0.267 . . . . 0.0 110.478 . . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.0 m -56.08 -47.66 77.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.459 -0.775 . . . . 0.0 109.41 179.377 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -70.77 -39.39 73.24 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.725 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.45 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 15.1 mt -57.53 -45.95 84.41 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.562 -0.711 . . . . 0.0 109.847 179.582 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.7 t90 -73.9 -48.14 32.98 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.629 -0.669 . . . . 0.0 109.768 179.335 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -56.74 -40.24 75.4 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.408 -0.808 . . . . 0.0 110.385 -179.817 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.63 -38.05 86.25 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.487 -0.758 . . . . 0.0 110.384 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.409 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -65.37 -47.97 74.56 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.357 -0.84 . . . . 0.0 109.213 179.463 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 3.1 mt-10 -69.52 -31.25 69.37 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.535 -0.728 . . . . 0.0 109.848 179.158 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -55.35 -49.53 72.0 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.424 -0.797 . . . . 0.0 108.866 178.601 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.593 ' CD1' HG21 ' A' ' 20' ' ' VAL . 14.3 t90 -70.1 -42.35 72.82 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.576 -0.702 . . . . 0.0 109.236 178.59 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -54.22 -31.8 54.18 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.624 -0.672 . . . . 0.0 110.874 179.728 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.418 ' HB3' ' CD1' ' A' ' 22' ' ' LEU . 24.1 m95 -102.91 -43.22 5.59 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.363 -0.835 . . . . 0.0 110.972 -179.601 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -57.51 -37.78 73.56 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.247 -0.908 . . . . 0.0 111.098 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.593 HG21 ' CD1' ' A' ' 16' ' ' TRP . 89.8 t -65.88 -32.86 60.04 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.238 -0.914 . . . . 0.0 110.316 179.907 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.9 m -93.68 -22.58 18.66 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.534 -0.729 . . . . 0.0 111.029 -179.81 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.418 ' CD1' ' HB3' ' A' ' 18' ' ' TRP . 78.2 mt . . . . . 0 N--CA 1.501 2.079 0 O-C-N 121.255 -0.903 . . . . 0.0 111.309 -179.629 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 . . . . . 0 N--CA 1.5 2.063 0 CA-C-O 120.551 0.215 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.6 t -57.98 -42.96 86.19 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.357 -0.839 . . . . 0.0 109.602 179.524 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -71.92 -39.52 69.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.372 -0.83 . . . . 0.0 109.495 178.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -70.77 -23.01 62.33 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.406 -0.809 . . . . 0.0 110.99 179.835 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -103.88 -53.69 2.71 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.357 -0.839 . . . . 0.0 110.863 -179.405 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -62.44 -49.24 76.23 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.098 -1.001 . . . . 0.0 110.889 -179.508 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -38.53 87.16 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.285 -0.884 . . . . 0.0 110.215 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.486 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -63.45 -43.93 95.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.451 -0.781 . . . . 0.0 109.504 179.48 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.475 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 48.7 mt-10 -69.29 -45.06 70.54 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.354 -0.841 . . . . 0.0 109.968 179.535 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.85 -42.56 65.32 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.384 -0.823 . . . . 0.0 109.586 179.163 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -72.66 -43.86 62.6 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.433 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.486 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 81.8 t80 -56.04 -53.81 52.49 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.72 -0.612 . . . . 0.0 109.62 179.473 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -59.28 -32.56 70.14 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.576 -0.703 . . . . 0.0 109.831 179.189 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -61.31 -35.38 77.19 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.59 -0.693 . . . . 0.0 110.769 179.435 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.7 m -111.03 7.9 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.255 -0.903 . . . . 0.0 111.519 -179.991 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 97.7 m -119.04 -31.6 4.69 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.977 -1.077 . . . . 0.0 111.087 -179.857 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.4 mt . . . . . 0 N--CA 1.501 2.121 0 O-C-N 121.315 -0.866 . . . . 0.0 110.988 -179.806 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 120.518 0.199 . . . . 0.0 110.665 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.8 t -52.69 -43.59 65.69 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.142 -0.974 . . . . 0.0 110.168 -179.974 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.477 ' CZ ' ' HG3' ' A' ' 12' ' ' ARG . 33.9 t80 -79.86 -39.07 31.38 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.457 -0.777 . . . . 0.0 110.075 179.423 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.53 -35.87 78.05 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.583 -0.698 . . . . 0.0 111.186 -179.525 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -58.76 -54.56 45.68 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.267 -0.896 . . . . 0.0 110.44 -179.665 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.69 -38.39 86.69 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.39 -0.819 . . . . 0.0 110.322 179.728 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.477 ' HG3' ' CZ ' ' A' ' 8' ' ' TYR . 13.4 mmm180 -65.54 -8.73 21.24 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.198 -0.939 . . . . 0.0 111.198 179.692 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -101.81 -47.36 4.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.223 -0.923 . . . . 0.0 109.981 179.637 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -88.37 -45.86 9.65 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.919 -0.488 . . . . 0.0 110.864 -178.774 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -39.66 95.3 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.264 -0.898 . . . . 0.0 109.972 179.826 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -72.21 -47.71 48.5 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.427 -0.796 . . . . 0.0 109.668 179.178 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.419 ' O ' HG23 ' A' ' 20' ' ' VAL . 82.6 t80 -57.37 -51.71 68.29 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.68 -0.638 . . . . 0.0 110.166 -179.815 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.412 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 8.6 m95 -65.8 -33.46 75.9 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.312 -0.867 . . . . 0.0 110.465 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -60.49 -57.05 14.37 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.172 -0.955 . . . . 0.0 110.611 179.966 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 17' ' ' PHE . 27.3 m -67.54 -22.79 29.0 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.287 -0.883 . . . . 0.0 111.252 -179.57 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 86.7 m -87.89 -31.06 19.67 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.086 -1.009 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.1 mt . . . . . 0 N--CA 1.497 1.91 0 O-C-N 121.275 -0.891 . . . . 0.0 110.214 -179.93 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.0 t30 . . . . . 0 N--CA 1.494 1.77 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 71.7 m -54.38 -54.91 34.24 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.442 -0.786 . . . . 0.0 109.67 179.546 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -61.61 -44.25 97.34 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.655 -0.653 . . . . 0.0 109.437 178.915 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.6 mt -57.05 -41.12 78.12 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.628 -0.67 . . . . 0.0 110.308 179.69 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.407 ' HA ' ' HD1' ' A' ' 13' ' ' TRP . 28.5 t90 -68.47 -39.33 81.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.472 -0.768 . . . . 0.0 109.988 179.395 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -64.33 -36.63 84.76 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.383 -0.823 . . . . 0.0 110.824 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -39.8 61.06 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.297 -0.877 . . . . 0.0 110.658 -179.807 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.431 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -60.05 -45.5 92.65 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.32 -0.862 . . . . 0.0 110.02 179.952 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.431 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 3.0 mt-10 -65.16 -42.94 93.27 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.308 -0.87 . . . . 0.0 110.264 179.836 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.06 -36.19 70.24 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.513 -0.742 . . . . 0.0 110.174 179.483 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -71.33 -47.07 58.83 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.448 -0.782 . . . . 0.0 109.298 179.272 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -55.89 -53.12 60.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.629 -0.669 . . . . 0.0 110.051 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.417 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 6.1 m95 -59.86 -31.08 69.43 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.352 -0.843 . . . . 0.0 110.697 179.604 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -31.69 72.33 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.352 -0.843 . . . . 0.0 111.283 179.945 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.2 m -106.28 -25.28 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.072 -1.017 . . . . 0.0 111.387 -179.665 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.8 m -82.11 -35.61 28.4 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.131 -0.981 . . . . 0.0 111.29 -179.278 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 N--CA 1.502 2.142 0 O-C-N 121.307 -0.871 . . . . 0.0 111.562 -179.533 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 . . . . . 0 N--CA 1.498 1.927 0 CA-C-O 120.5 0.19 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.7 t -50.61 -49.76 55.78 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.232 -0.917 . . . . 0.0 110.22 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -71.84 -46.52 57.74 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.475 -0.766 . . . . 0.0 110.024 179.497 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -57.75 -41.82 82.67 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.458 -0.776 . . . . 0.0 110.202 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.531 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -75.0 -34.76 61.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.529 -0.732 . . . . 0.0 109.72 179.342 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -64.53 -39.36 93.62 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.529 -0.732 . . . . 0.0 110.32 179.544 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.58 -26.57 22.2 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.314 -0.866 . . . . 0.0 110.332 179.278 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.54 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -86.89 -43.59 12.31 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.564 -0.71 . . . . 0.0 110.806 179.923 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -83.62 -38.69 21.25 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.381 -0.824 . . . . 0.0 111.496 -178.507 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -50.04 -43.72 51.12 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.26 -0.9 . . . . 0.0 109.763 179.551 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.407 ' CD1' HG21 ' A' ' 20' ' ' VAL . 18.5 t90 -73.22 -44.05 60.25 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.561 -0.712 . . . . 0.0 109.086 178.622 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -55.43 -44.92 76.72 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.462 -0.774 . . . . 0.0 109.987 179.525 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -71.77 -51.01 24.84 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.42 -0.8 . . . . 0.0 110.553 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.07 -21.61 65.09 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.16 -0.962 . . . . 0.0 111.803 -179.795 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.407 HG21 ' CD1' ' A' ' 16' ' ' TRP . 99.3 t -102.09 -31.64 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 120.961 -1.087 . . . . 0.0 111.288 -179.21 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.6 m -88.59 -34.06 17.45 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.977 -1.077 . . . . 0.0 111.28 -179.446 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.9 mt . . . . . 0 N--CA 1.501 2.102 0 O-C-N 121.175 -0.953 . . . . 0.0 110.841 -179.743 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 120.649 0.262 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.0 t -58.56 -47.71 83.33 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.292 -0.88 . . . . 0.0 109.69 179.363 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -66.79 -41.68 87.22 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.468 -0.77 . . . . 0.0 109.451 179.011 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.9 -40.27 97.04 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.678 -0.639 . . . . 0.0 110.038 179.499 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 28.0 t90 -61.57 -44.63 96.67 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.65 -0.656 . . . . 0.0 110.264 179.695 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -34.66 78.73 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.406 -0.809 . . . . 0.0 110.501 179.863 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -37.96 77.93 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.364 -0.835 . . . . 0.0 110.4 179.707 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.462 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -60.03 -47.22 86.77 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.448 -0.783 . . . . 0.0 109.675 179.985 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.445 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 28.4 mt-10 -69.01 -38.54 79.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.264 -0.897 . . . . 0.0 109.872 179.314 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.48 -49.26 78.47 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.574 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.4 ' O ' HG23 ' A' ' 20' ' ' VAL . 12.6 t90 -67.11 -42.04 85.22 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.821 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.462 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 69.3 t80 -55.07 -58.06 9.2 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.599 -0.688 . . . . 0.0 109.684 179.687 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -62.93 -34.71 78.03 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.439 -0.788 . . . . 0.0 110.177 179.484 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -53.92 -36.72 63.07 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.5 -0.75 . . . . 0.0 110.602 179.396 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 16' ' ' TRP . 32.6 m -104.42 -23.74 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 121.282 -0.886 . . . . 0.0 110.975 179.839 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 58.0 m -78.09 -27.92 48.58 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.152 -0.968 . . . . 0.0 111.016 -179.874 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.8 mt . . . . . 0 N--CA 1.5 2.053 0 O-C-N 121.381 -0.824 . . . . 0.0 111.081 -179.941 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.499 1.993 0 CA-C-O 120.72 0.295 . . . . 0.0 110.378 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.6 m -57.69 -44.96 86.22 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.345 -0.847 . . . . 0.0 109.647 179.425 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -70.01 -39.88 75.56 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.513 -0.742 . . . . 0.0 109.216 178.648 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.3 mt -61.68 -49.83 74.93 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.745 -0.597 . . . . 0.0 109.948 179.458 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -64.49 -36.74 85.17 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.569 -0.707 . . . . 0.0 109.645 179.221 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -60.08 -44.0 95.08 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.446 -0.784 . . . . 0.0 110.19 179.441 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 ttp85 -53.57 -36.26 61.71 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.615 -0.678 . . . . 0.0 110.689 179.688 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.436 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -61.44 -59.45 5.24 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.564 -0.71 . . . . 0.0 110.227 179.97 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.487 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 8.9 mt-10 -72.87 -30.97 64.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.681 -0.637 . . . . 0.0 110.942 -179.545 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -50.57 -48.66 57.46 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.378 -0.826 . . . . 0.0 109.864 179.676 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.511 ' CD1' HG21 ' A' ' 20' ' ' VAL . 6.2 t90 -72.5 -42.12 65.2 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.528 -0.732 . . . . 0.0 109.302 178.903 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.487 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 15.9 t80 -57.72 -45.27 86.01 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.593 -0.692 . . . . 0.0 110.459 179.962 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.405 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 10.6 m95 -63.44 -57.62 9.69 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.276 -0.89 . . . . 0.0 110.895 -179.534 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.04 -27.13 68.11 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.043 -1.036 . . . . 0.0 111.716 -179.544 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.511 HG21 ' CD1' ' A' ' 16' ' ' TRP . 71.3 t -91.27 -24.88 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.062 -1.024 . . . . 0.0 111.324 -179.392 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.6 m -101.12 -38.02 8.32 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.085 -1.009 . . . . 0.0 111.338 -179.395 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 18' ' ' TRP . 77.3 mt . . . . . 0 N--CA 1.502 2.144 0 O-C-N 121.251 -0.906 . . . . 0.0 110.96 -179.571 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.506 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 59.9 t30 . . . . . 0 N--CA 1.497 1.897 0 N-CA-C 111.355 0.131 . . . . 0.0 111.355 . . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.4 t -52.19 -52.45 52.04 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.102 -0.999 . . . . 0.0 109.929 179.96 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -70.61 -40.88 72.93 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.465 -0.772 . . . . 0.0 109.748 179.121 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.506 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 29.7 mt -60.03 -36.52 77.45 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.63 -0.669 . . . . 0.0 110.403 179.691 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -72.4 -40.1 67.46 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.418 -0.801 . . . . 0.0 110.024 179.485 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.447 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 5.8 mm-40 -61.44 -40.23 93.7 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.464 -0.773 . . . . 0.0 110.471 179.916 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.96 -38.81 65.36 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.568 -0.708 . . . . 0.0 110.321 179.54 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.478 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -58.92 -61.92 2.27 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.697 -0.627 . . . . 0.0 110.303 179.704 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -66.02 -33.84 76.72 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.546 -0.721 . . . . 0.0 110.661 -179.707 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.447 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -51.95 -46.05 64.61 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.471 -0.768 . . . . 0.0 109.193 178.903 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 18.1 t90 -70.99 -43.22 68.47 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.518 -0.739 . . . . 0.0 109.407 178.817 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -58.02 -52.02 67.27 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.635 -0.666 . . . . 0.0 109.916 179.818 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.432 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 7.8 m95 -64.21 -33.98 77.05 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.425 -0.797 . . . . 0.0 110.202 179.426 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -68.2 -41.95 80.62 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.363 -0.836 . . . . 0.0 111.063 179.837 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.4 m -89.4 -25.02 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.187 -0.945 . . . . 0.0 111.438 -179.527 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.6 m -84.72 -51.74 6.58 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.106 -0.996 . . . . 0.0 110.653 -179.718 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.0 mt . . . . . 0 N--CA 1.497 1.925 0 O-C-N 121.415 -0.803 . . . . 0.0 109.749 179.904 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.499 2.018 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 . . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.7 p -57.43 -50.74 72.03 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.39 -0.819 . . . . 0.0 109.672 179.601 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -62.73 -44.86 95.12 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.651 -0.656 . . . . 0.0 109.437 179.0 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.39 -45.57 92.54 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.816 -0.553 . . . . 0.0 110.334 179.732 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.0 t90 -61.94 -49.36 76.44 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.522 -0.736 . . . . 0.0 109.916 179.589 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 50.0 tp60 -55.09 -35.98 65.17 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.447 -0.783 . . . . 0.0 110.297 179.918 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.38 -36.82 77.18 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.423 -0.798 . . . . 0.0 110.457 179.729 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.434 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -60.45 -45.91 91.96 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.476 -0.765 . . . . 0.0 109.333 179.564 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.434 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 5.2 mt-10 -73.32 -35.42 66.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.339 -0.851 . . . . 0.0 109.675 178.959 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -51.98 -46.58 64.89 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.393 -0.817 . . . . 0.0 109.921 179.365 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -68.47 -47.29 67.5 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.506 -0.747 . . . . 0.0 109.27 179.244 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -55.09 -42.35 72.74 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.692 -0.63 . . . . 0.0 109.815 179.596 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.501 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -77.65 -27.81 51.06 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.674 -0.641 . . . . 0.0 110.315 179.612 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 14.4 t-20 -65.0 -43.7 91.66 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.408 -0.807 . . . . 0.0 110.947 -179.806 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 m -80.09 -17.32 12.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.268 -0.895 . . . . 0.0 111.705 -179.461 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.5 p -95.93 -55.79 2.87 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.971 -1.081 . . . . 0.0 110.524 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.501 HD12 ' HB3' ' A' ' 18' ' ' TRP . 6.8 mt . . . . . 0 N--CA 1.499 1.975 0 O-C-N 121.59 -0.694 . . . . 0.0 110.805 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.4 t30 . . . . . 0 N--CA 1.496 1.834 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.4 m -57.98 -43.72 86.68 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.318 -0.864 . . . . 0.0 109.312 179.061 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -67.2 -38.48 85.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.789 -0.569 . . . . 0.0 109.614 178.936 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.01 -41.25 78.01 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.579 -0.701 . . . . 0.0 110.333 179.715 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -75.67 -43.32 48.08 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.504 -0.748 . . . . 0.0 110.317 179.928 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.03 -57.0 13.96 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.306 -0.871 . . . . 0.0 110.614 -179.564 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.7 -37.89 43.89 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.557 -0.715 . . . . 0.0 110.991 -179.783 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.525 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -57.12 -60.0 4.25 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.658 -0.651 . . . . 0.0 110.482 179.85 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -76.01 -35.97 59.33 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.636 -0.665 . . . . 0.0 110.887 -179.476 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -51.91 -49.21 63.51 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.506 -0.746 . . . . 0.0 109.552 179.565 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -67.2 -45.92 75.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.56 -0.712 . . . . 0.0 109.341 178.944 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -54.94 -52.5 62.82 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.672 -0.642 . . . . 0.0 109.892 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -65.14 -39.75 93.44 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.304 -0.872 . . . . 0.0 110.008 179.566 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -66.48 -29.24 69.31 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.459 -0.776 . . . . 0.0 111.336 179.791 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.2 p -101.61 -7.83 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.99 0 O-C-N 121.123 -0.985 . . . . 0.0 111.532 -179.407 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.7 m -109.0 -30.48 8.06 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.958 -1.089 . . . . 0.0 111.174 -179.718 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.0 mt . . . . . 0 N--CA 1.499 1.994 0 O-C-N 121.298 -0.876 . . . . 0.0 110.774 -179.995 . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.5 t30 . . . . . 0 N--CA 1.497 1.886 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -51.11 70.88 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.451 -0.781 . . . . 0.0 109.656 179.524 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -63.68 -40.26 96.36 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.638 -0.664 . . . . 0.0 109.364 178.824 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.9 mt -58.1 -41.81 84.33 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.59 -0.694 . . . . 0.0 110.205 179.561 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 33.3 t90 -65.6 -45.88 81.5 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.471 -0.768 . . . . 0.0 109.819 179.231 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -60.42 -35.53 76.02 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.353 -0.842 . . . . 0.0 110.218 179.9 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -40.13 88.14 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.544 -0.722 . . . . 0.0 110.1 179.305 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -46.35 88.16 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.546 -0.721 . . . . 0.0 109.438 179.501 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -74.18 -41.05 62.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.28 -0.887 . . . . 0.0 109.528 179.024 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -54.06 -47.74 71.33 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.634 -0.666 . . . . 0.0 109.38 179.06 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -62.39 -47.76 82.7 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.531 -0.731 . . . . 0.0 109.282 179.004 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -58.1 -51.37 69.99 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.657 -0.652 . . . . 0.0 110.149 179.704 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.508 ' HE3' ' CD1' ' A' ' 22' ' ' LEU . 35.6 m95 -64.83 -16.31 62.95 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.463 -0.773 . . . . 0.0 110.73 179.472 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -92.91 -28.38 16.51 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.967 -1.083 . . . . 0.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 19.8 m -106.2 0.21 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.112 0 O-C-N 121.097 -1.002 . . . . 0.0 111.737 -179.731 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 86.6 m -110.29 -16.72 13.67 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.917 -1.114 . . . . 0.0 111.179 -179.804 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.508 ' CD1' ' HE3' ' A' ' 18' ' ' TRP . 6.8 mp . . . . . 0 N--CA 1.495 1.778 0 O-C-N 121.199 -0.938 . . . . 0.0 110.143 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 39.8 ttt-85 . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 121.331 0.586 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.41 156.42 30.39 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.211 -0.93 . . . . 0.0 110.272 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.2 -30.95 71.98 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.519 -0.738 . . . . 0.0 110.964 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.1 pp -100.72 7.96 43.56 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.342 -0.849 . . . . 0.0 111.282 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.9 t -105.48 -58.45 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.128 -0.982 . . . . 0.0 110.102 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -62.65 -40.91 98.52 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.426 -0.797 . . . . 0.0 110.429 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -59.67 -45.68 91.34 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.41 -0.806 . . . . 0.0 109.498 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -65.44 -41.82 93.05 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.567 -0.708 . . . . 0.0 109.192 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.12 -46.45 88.99 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.638 -0.664 . . . . 0.0 109.718 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -67.06 -46.05 75.51 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.607 -0.683 . . . . 0.0 109.618 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -54.61 -39.14 67.58 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.503 -0.748 . . . . 0.0 110.142 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -66.68 -38.59 87.13 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.573 -0.704 . . . . 0.0 110.466 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -44.78 96.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.344 -0.847 . . . . 0.0 109.698 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -72.95 -39.05 66.52 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.288 -0.883 . . . . 0.0 109.693 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.9 -46.89 71.55 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.525 -0.734 . . . . 0.0 109.659 179.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -67.09 -45.23 77.89 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.539 -0.726 . . . . 0.0 109.123 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -56.06 -48.45 76.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.726 -0.609 . . . . 0.0 109.488 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -66.18 -39.65 89.87 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.478 -0.764 . . . . 0.0 110.035 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.13 -44.01 67.4 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.455 -0.778 . . . . 0.0 110.786 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.8 m -87.36 -26.74 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 121.311 -0.868 . . . . 0.0 111.048 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.1 m -77.34 -35.48 54.64 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.105 -0.997 . . . . 0.0 110.426 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.3 mt -79.1 -64.72 1.12 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.472 -0.768 . . . . 0.0 109.928 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.0 mmt-85 51.14 80.23 0.31 Allowed Pre-proline 0 N--CA 1.501 2.092 0 O-C-N 121.916 -0.49 . . . . 0.0 110.837 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -76.94 73.86 5.21 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 O-C-N 123.766 1.403 . . . . 0.0 110.684 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -98.97 166.82 11.1 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.377 -0.827 . . . . 0.0 110.496 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.211 0 CA-C-O 118.351 -0.833 . . . . 0.0 111.093 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.7 ttt-85 . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 120.898 0.38 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.09 -178.8 0.13 Allowed 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.806 -0.559 . . . . 0.0 110.857 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.31 -52.58 2.77 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.331 -0.856 . . . . 0.0 110.623 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.76 33.43 1.03 Allowed 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.422 -0.799 . . . . 0.0 110.987 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.9 t -120.01 -53.62 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.238 -0.914 . . . . 0.0 109.873 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -68.89 -34.49 75.51 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.403 -0.811 . . . . 0.0 110.32 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -55.98 -45.34 79.01 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.474 -0.766 . . . . 0.0 109.676 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -37.02 62.96 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.669 -0.645 . . . . 0.0 109.518 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.8 mt -65.74 -43.85 87.73 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.422 -0.799 . . . . 0.0 109.942 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.404 ' CE3' ' HG2' ' A' ' 11' ' ' GLN . 15.4 t90 -69.06 -39.53 79.06 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.477 -0.764 . . . . 0.0 109.82 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.404 ' HG2' ' CE3' ' A' ' 10' ' ' TRP . 2.4 mm100 -58.15 -42.93 86.99 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.386 -0.821 . . . . 0.0 110.071 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.23 -22.04 16.47 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.438 -0.789 . . . . 0.0 110.971 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.535 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -86.73 -57.33 3.02 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.295 -0.878 . . . . 0.0 110.721 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -81.39 -43.74 18.55 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.502 -0.749 . . . . 0.0 111.971 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.06 -38.82 62.8 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.174 -0.954 . . . . 0.0 110.291 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.3 t90 -70.45 -49.54 47.55 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.483 -0.76 . . . . 0.0 109.206 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -57.77 -45.96 85.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.689 -0.632 . . . . 0.0 109.919 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.49 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 3.7 m95 -65.12 -37.12 86.45 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.431 -0.793 . . . . 0.0 110.187 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -42.56 94.58 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.233 -0.917 . . . . 0.0 110.637 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.5 m -87.23 -6.03 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.126 -0.984 . . . . 0.0 111.516 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.6 m -107.95 -38.6 5.77 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.931 -1.106 . . . . 0.0 110.829 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.483 HD13 ' HB3' ' A' ' 18' ' ' TRP . 16.9 mt -95.66 -16.02 22.32 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.356 -0.84 . . . . 0.0 111.332 -179.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.14 67.18 2.71 Favored Pre-proline 0 N--CA 1.499 1.996 0 O-C-N 121.194 -0.941 . . . . 0.0 110.418 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.59 110.19 2.82 Favored 'Trans proline' 0 C--N 1.312 -1.346 0 O-C-N 123.635 1.334 . . . . 0.0 110.646 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 67.71 160.16 0.16 Allowed 'General case' 0 N--CA 1.504 2.249 0 CA-C-O 121.489 0.662 . . . . 0.0 111.147 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.97 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.42 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.221 0.534 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 t -101.94 -3.6 27.54 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.342 -0.849 . . . . 0.0 111.258 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.33 9.19 2.44 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.49 -0.757 . . . . 0.0 111.47 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.0 mt -129.88 -0.55 4.77 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.008 -1.057 . . . . 0.0 111.173 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.9 t -89.98 -52.37 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.077 -1.015 . . . . 0.0 109.926 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -64.71 -38.81 92.25 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.459 -0.776 . . . . 0.0 110.468 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.5 p -57.21 -48.09 79.66 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.433 -0.792 . . . . 0.0 109.675 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -65.22 -39.49 92.83 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.675 -0.641 . . . . 0.0 109.341 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -65.38 -49.21 70.17 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.665 -0.647 . . . . 0.0 109.932 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.5 t90 -62.51 -45.7 91.78 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.703 -0.623 . . . . 0.0 110.132 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.36 -40.61 74.81 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.386 -0.821 . . . . 0.0 109.782 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -39.87 81.56 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.7 -0.625 . . . . 0.0 110.328 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.508 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -57.46 -60.08 4.19 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.728 -0.607 . . . . 0.0 110.417 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.413 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 13.1 mt-10 -71.73 -28.11 63.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.504 -0.747 . . . . 0.0 111.059 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -54.12 -50.71 66.26 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.347 -0.846 . . . . 0.0 109.53 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.3 t90 -68.81 -41.59 78.45 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.366 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.413 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 34.2 t80 -57.43 -55.38 35.6 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.63 -0.669 . . . . 0.0 109.761 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -64.64 -35.27 80.49 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.431 -0.793 . . . . 0.0 110.059 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -56.02 -48.44 75.96 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.36 -0.838 . . . . 0.0 110.717 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 30.6 m -87.06 -25.06 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 O-C-N 121.231 -0.918 . . . . 0.0 111.188 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.3 m -76.23 -39.67 53.96 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.2 -0.937 . . . . 0.0 110.334 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.4 mt -86.6 -8.79 57.2 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.533 -0.73 . . . . 0.0 110.923 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.476 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -59.96 -54.14 58.4 Favored Pre-proline 0 N--CA 1.499 2.019 0 O-C-N 121.252 -0.905 . . . . 0.0 110.873 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.476 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 52.2 Cg_endo -80.83 63.16 8.74 Favored 'Trans proline' 0 C--N 1.319 -1.017 0 O-C-N 123.442 1.233 . . . . 0.0 110.736 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -103.43 -48.2 4.06 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.177 -0.952 . . . . 0.0 110.551 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 118.127 -0.939 . . . . 0.0 110.807 -179.814 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.496 1.861 0 CA-C-O 121.042 0.449 . . . . 0.0 110.359 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.468 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.3 OUTLIER -137.72 166.35 24.18 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.506 -0.746 . . . . 0.0 110.379 179.858 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.84 -46.76 3.31 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.354 -0.841 . . . . 0.0 111.013 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.7 mp -105.02 13.41 30.96 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.28 -0.888 . . . . 0.0 111.215 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.468 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 98.6 t -111.93 -52.11 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.139 -0.976 . . . . 0.0 110.119 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.73 -21.53 63.46 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.425 -0.797 . . . . 0.0 110.828 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.5 p -52.6 -35.63 54.7 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.426 -0.796 . . . . 0.0 110.451 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -99.59 -32.36 11.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.558 -0.714 . . . . 0.0 109.862 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 13' ' ' TRP . 1.3 mm? -69.25 -35.89 76.59 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.428 -0.795 . . . . 0.0 110.743 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 22.8 t90 -57.66 -48.48 79.38 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.497 -0.752 . . . . 0.0 110.404 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -47.89 82.2 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.482 -0.761 . . . . 0.0 110.033 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -37.54 84.56 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.471 -0.768 . . . . 0.0 110.045 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.445 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -58.69 -57.24 13.88 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 121.572 0.701 . . . . 0.0 109.992 179.504 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -71.5 -30.32 65.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.843 -0.535 . . . . 0.0 110.873 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -53.35 -49.16 67.71 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.315 -0.866 . . . . 0.0 109.531 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.9 t90 -69.02 -43.87 73.87 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.553 -0.717 . . . . 0.0 109.202 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -57.6 -56.28 23.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.741 -0.599 . . . . 0.0 110.125 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -60.88 -34.77 75.13 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.469 -0.77 . . . . 0.0 110.049 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -60.71 -42.36 97.06 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.497 -0.752 . . . . 0.0 110.772 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.2 m -94.69 -10.04 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.321 -0.862 . . . . 0.0 111.341 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.9 m -95.99 -38.56 10.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.09 -1.006 . . . . 0.0 110.513 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.8 mt -84.01 -16.86 42.44 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.469 -0.769 . . . . 0.0 111.084 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.476 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.73 -53.58 42.61 Favored Pre-proline 0 N--CA 1.499 2.023 0 O-C-N 121.304 -0.873 . . . . 0.0 110.631 179.723 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 45.4 Cg_endo -71.77 158.39 53.26 Favored 'Trans proline' 0 N--CA 1.486 1.084 0 O-C-N 123.455 1.239 . . . . 0.0 110.592 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -92.51 -39.15 11.54 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.625 -0.672 . . . . 0.0 110.518 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 . . . . . 0 N--CA 1.497 1.886 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.335 -179.997 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 121.219 0.533 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.468 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.1 OUTLIER -122.83 142.87 50.28 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.249 -0.907 . . . . 0.0 110.458 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -70.34 -32.02 69.55 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.445 -0.784 . . . . 0.0 110.847 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tp -91.17 -0.58 57.73 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.406 -0.809 . . . . 0.0 111.309 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.468 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 93.3 t -123.7 -47.06 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.07 -1.019 . . . . 0.0 110.399 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.566 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 63.7 t30 -69.15 -17.9 63.88 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.437 -0.789 . . . . 0.0 111.271 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -52.07 -51.29 58.58 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.179 -0.95 . . . . 0.0 109.961 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -73.68 -40.9 63.32 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.489 -0.757 . . . . 0.0 109.584 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 30.0 mt -59.06 -37.8 77.89 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.598 -0.689 . . . . 0.0 110.452 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -67.82 -48.99 64.67 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.498 -0.751 . . . . 0.0 110.16 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -64.11 -42.64 96.8 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.413 -0.804 . . . . 0.0 110.132 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -24.82 67.14 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.446 -0.784 . . . . 0.0 110.248 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.487 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -85.46 -54.5 4.53 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.437 -0.789 . . . . 0.0 110.146 179.826 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.58 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 8.1 mt-10 -69.83 -23.79 63.36 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.627 -0.671 . . . . 0.0 111.529 -179.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -52.26 -55.1 23.47 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.072 -1.018 . . . . 0.0 109.423 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -67.76 -41.28 83.55 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.566 -0.709 . . . . 0.0 109.461 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.58 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 29.9 t80 -56.21 -54.96 39.06 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.784 -0.573 . . . . 0.0 110.439 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.478 ' HB3' HD11 ' A' ' 22' ' ' LEU . 21.1 m95 -61.35 -41.06 96.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.372 -0.83 . . . . 0.0 110.478 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -53.92 -42.98 69.35 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.312 -0.868 . . . . 0.0 111.502 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.4 m -89.79 -22.13 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.136 -0.977 . . . . 0.0 111.018 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 64.5 m -82.08 -26.65 33.46 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.112 -0.992 . . . . 0.0 110.444 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.478 HD11 ' HB3' ' A' ' 18' ' ' TRP . 71.1 mt -82.68 -13.1 57.02 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.359 -0.838 . . . . 0.0 110.844 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.492 ' HB2' ' HD3' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -63.73 -53.06 53.58 Favored Pre-proline 0 N--CA 1.499 1.975 0 O-C-N 121.231 -0.918 . . . . 0.0 110.834 179.802 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.492 ' HD3' ' HB2' ' A' ' 23' ' ' ARG . 46.6 Cg_endo -72.04 179.68 4.68 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 O-C-N 123.5 1.263 . . . . 0.0 110.91 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 168.82 8.01 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.471 -0.768 . . . . 0.0 110.732 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.535 ' HB2' ' CZ ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 117.863 -1.065 . . . . 0.0 110.219 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.9 ptt-85 . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 121.149 0.499 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.0 t -91.16 -177.37 4.87 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.38 -0.825 . . . . 0.0 110.233 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.98 -46.14 2.54 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.483 -0.761 . . . . 0.0 110.702 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 mt -86.9 18.55 3.44 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.287 -0.883 . . . . 0.0 111.374 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.5 t -106.49 -56.28 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.065 -1.022 . . . . 0.0 109.752 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -66.61 -39.53 88.4 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.446 -0.784 . . . . 0.0 110.249 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 t -56.73 -52.75 63.77 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.299 -0.876 . . . . 0.0 109.268 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -60.77 -44.02 97.29 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.657 -0.652 . . . . 0.0 109.283 178.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.1 mt -59.03 -41.52 88.02 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.883 -0.511 . . . . 0.0 110.225 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 40.2 t90 -62.61 -48.43 79.44 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.479 -0.763 . . . . 0.0 110.226 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -58.16 -36.72 73.43 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.387 -0.821 . . . . 0.0 110.282 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -69.97 -37.94 75.94 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.424 -0.798 . . . . 0.0 110.123 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.488 ' CD1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -58.51 -41.72 86.07 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.546 -0.721 . . . . 0.0 109.326 179.577 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.488 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 45.5 mt-10 -67.24 -48.31 68.17 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.478 -0.764 . . . . 0.0 109.375 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -56.22 -49.21 74.76 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.816 -0.553 . . . . 0.0 109.612 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 8.8 t90 -62.37 -47.11 85.64 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.654 -0.654 . . . . 0.0 109.397 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -57.83 -51.39 69.8 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.7 -0.625 . . . . 0.0 109.827 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.5 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 3.7 m95 -63.52 -30.0 71.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.418 -0.801 . . . . 0.0 110.351 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -40.84 75.58 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.096 -1.003 . . . . 0.0 110.428 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 22.3 m -88.56 -26.97 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.229 -0.92 . . . . 0.0 110.773 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 90.5 m -84.31 -48.33 9.83 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.286 -0.884 . . . . 0.0 110.472 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 18' ' ' TRP . 50.3 mt -89.59 -44.09 10.32 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.397 -0.814 . . . . 0.0 109.998 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 51.34 67.62 4.05 Favored Pre-proline 0 N--CA 1.5 2.05 0 O-C-N 121.958 -0.464 . . . . 0.0 110.898 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.79 163.47 38.78 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 123.673 1.354 . . . . 0.0 110.714 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -107.94 42.16 1.41 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.424 -0.798 . . . . 0.0 110.355 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? . . . . . 0 N--CA 1.503 2.176 0 CA-C-O 118.083 -0.96 . . . . 0.0 111.065 179.754 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.857 0 CA-C-O 121.125 0.488 . . . . 0.0 110.51 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 t -147.86 175.33 11.04 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.447 -0.783 . . . . 0.0 110.557 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.95 -31.56 72.78 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.648 -0.658 . . . . 0.0 110.595 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -74.16 -33.6 63.55 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.272 -0.893 . . . . 0.0 110.209 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.3 t -65.63 -49.87 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.586 -0.696 . . . . 0.0 110.274 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -62.82 -37.02 85.11 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.53 -0.731 . . . . 0.0 110.465 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.1 t -58.62 -46.32 87.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.306 -0.871 . . . . 0.0 109.611 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.489 ' CZ ' ' HD2' ' A' ' 12' ' ' ARG . 21.7 t80 -67.5 -43.84 79.91 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.569 -0.707 . . . . 0.0 109.305 178.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.601 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 1.4 mm? -60.86 -44.84 96.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.67 -0.644 . . . . 0.0 110.241 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -61.17 -40.69 94.83 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.635 -0.666 . . . . 0.0 110.079 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -57.0 -45.4 83.03 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.438 -0.789 . . . . 0.0 110.155 179.799 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.601 ' HD3' ' HA ' ' A' ' 9' ' ' LEU . 29.5 mtp85 -54.37 -41.83 69.62 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.754 -0.591 . . . . 0.0 110.409 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.455 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -54.37 -60.05 3.86 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.392 0.615 . . . . 0.0 110.051 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -68.51 -31.39 70.61 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.593 -0.692 . . . . 0.0 110.544 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -52.83 -43.83 66.28 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.448 -0.783 . . . . 0.0 109.579 179.197 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.9 t90 -68.63 -47.09 67.51 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -57.28 -52.14 66.53 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.804 -0.56 . . . . 0.0 109.679 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.466 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 5.0 m95 -63.19 -33.3 75.18 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.33 -0.856 . . . . 0.0 110.151 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.448 ' HA ' ' HD2' ' A' ' 24' ' ' PRO . 5.0 m-20 -64.12 -41.0 97.4 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.453 -0.78 . . . . 0.0 110.681 179.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.7 m -93.83 -18.84 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.224 -0.922 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.1 m -91.84 -53.35 4.32 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.002 -1.061 . . . . 0.0 109.925 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.3 mt -83.56 -16.37 45.64 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.498 -0.751 . . . . 0.0 110.56 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 50.83 60.28 15.0 Favored Pre-proline 0 N--CA 1.501 2.106 0 O-C-N 121.668 -0.645 . . . . 0.0 110.866 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' A' ' 19' ' ' ASN . 48.5 Cg_endo -73.25 155.36 51.63 Favored 'Trans proline' 0 C--N 1.313 -1.333 0 O-C-N 123.57 1.3 . . . . 0.0 110.556 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -89.47 150.0 22.68 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.569 -0.707 . . . . 0.0 110.267 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.499 1.982 0 CA-C-O 118.55 -0.738 . . . . 0.0 110.85 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.499 1.978 0 CA-C-O 121.075 0.464 . . . . 0.0 110.665 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -165.6 149.77 8.36 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.281 -0.887 . . . . 0.0 110.36 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -94.99 -26.87 15.91 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.509 -0.744 . . . . 0.0 110.906 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.61 21.83 16.13 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.222 -0.924 . . . . 0.0 110.964 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.0 t -111.64 -36.44 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.249 -0.907 . . . . 0.0 110.006 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -98.22 -36.66 9.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.274 -0.891 . . . . 0.0 110.047 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.3 m -57.6 -52.79 63.99 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.602 -0.686 . . . . 0.0 110.747 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.485 ' CZ ' HD11 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -66.11 -27.86 68.37 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.377 -0.827 . . . . 0.0 110.149 179.632 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.485 HD11 ' CZ ' ' A' ' 8' ' ' TYR . 3.0 tp -70.55 -41.44 72.48 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.513 -0.742 . . . . 0.0 109.575 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.5 t90 -60.53 -47.38 86.41 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.506 -0.746 . . . . 0.0 109.371 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -60.05 -37.05 78.68 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.454 -0.779 . . . . 0.0 109.901 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.6 mtp85 -63.09 -39.15 93.87 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.501 -0.749 . . . . 0.0 110.159 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.452 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -63.2 -46.73 85.66 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.608 -0.682 . . . . 0.0 109.495 179.513 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -70.19 -36.63 74.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.408 -0.807 . . . . 0.0 109.699 179.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.415 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.3 OUTLIER -57.36 -48.96 77.67 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 178.628 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.5 t90 -69.76 -41.63 74.92 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.615 -0.678 . . . . 0.0 109.194 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.452 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 57.8 t80 -55.15 -58.93 5.68 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.704 -0.622 . . . . 0.0 109.416 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 23.7 m95 -61.4 -33.2 73.28 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.511 -0.743 . . . . 0.0 110.111 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 2.2 t30 -54.4 -37.51 65.12 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.487 -0.758 . . . . 0.0 110.463 179.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -102.91 -27.52 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.49 -0.756 . . . . 0.0 110.782 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 99.9 m -73.2 -39.12 65.82 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.251 -0.906 . . . . 0.0 110.862 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.42 -34.98 77.83 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.511 -0.743 . . . . 0.0 110.929 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -121.02 79.7 33.79 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.286 -0.884 . . . . 0.0 110.278 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -76.87 70.62 6.47 Favored 'Trans proline' 0 C--N 1.315 -1.199 0 O-C-N 123.739 1.389 . . . . 0.0 110.27 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -116.43 -164.72 0.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.354 -0.842 . . . . 0.0 110.34 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 tpt85 . . . . . 0 N--CA 1.496 1.85 0 CA-C-O 118.361 -0.828 . . . . 0.0 110.272 179.888 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 9.2 ttp-105 . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 121.268 0.556 . . . . 0.0 110.075 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.57 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 1.2 m -143.22 130.33 20.74 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.317 -0.865 . . . . 0.0 110.496 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -106.56 -34.64 7.3 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.599 -0.688 . . . . 0.0 110.689 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -106.01 -13.42 15.48 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.395 -0.816 . . . . 0.0 111.438 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.57 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 59.5 t -68.26 -50.44 57.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 121.214 -0.929 . . . . 0.0 110.059 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -65.08 -37.85 88.87 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.469 -0.769 . . . . 0.0 110.087 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.3 m -61.92 -44.41 96.83 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.319 -0.863 . . . . 0.0 109.728 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -60.79 -41.31 95.33 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.551 -0.718 . . . . 0.0 109.308 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.2 OUTLIER -71.36 -39.41 71.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.699 -0.625 . . . . 0.0 109.996 179.396 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -64.63 -47.47 78.43 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.637 -0.665 . . . . 0.0 110.097 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -54.84 -40.42 69.6 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.369 -0.832 . . . . 0.0 110.363 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -41.59 87.08 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.561 -0.712 . . . . 0.0 110.341 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.409 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -59.55 -46.87 87.61 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.343 -0.848 . . . . 0.0 109.557 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 2.8 mt-10 -70.88 -37.77 73.06 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.343 -0.848 . . . . 0.0 110.038 179.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -46.84 72.01 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.544 -0.723 . . . . 0.0 109.546 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -64.35 -45.95 85.58 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.524 -0.735 . . . . 0.0 109.335 178.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -52.46 -47.49 66.44 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.781 -0.575 . . . . 0.0 109.664 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 22.2 m95 -63.14 -38.05 89.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.579 -0.701 . . . . 0.0 110.147 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -54.79 -35.43 63.85 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.223 -0.923 . . . . 0.0 110.94 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.4 m -106.72 -2.78 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.075 -1.015 . . . . 0.0 111.617 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.2 m -113.37 -16.81 12.41 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.033 -1.042 . . . . 0.0 111.341 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.3 mt -59.61 -34.96 73.43 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.2 -0.937 . . . . 0.0 110.645 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.8 ttm105 58.02 75.8 0.51 Allowed Pre-proline 0 N--CA 1.499 1.993 0 O-C-N 121.865 -0.522 . . . . 0.0 110.554 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.77 171.86 16.48 Favored 'Trans proline' 0 C--N 1.315 -1.23 0 O-C-N 123.841 1.443 . . . . 0.0 110.926 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -78.59 -38.08 40.9 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.571 -0.706 . . . . 0.0 110.544 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 . . . . . 0 N--CA 1.501 2.076 0 CA-C-O 118.188 -0.91 . . . . 0.0 110.949 -179.864 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.8 mtt180 . . . . . 0 N--CA 1.495 1.793 0 CA-C-O 121.074 0.464 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.401 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.4 OUTLIER -73.27 147.97 44.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.408 -0.807 . . . . 0.0 110.359 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -106.47 -40.87 5.45 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.592 -0.693 . . . . 0.0 110.873 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -84.95 10.7 11.06 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.299 -0.876 . . . . 0.0 111.446 -179.683 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.401 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 70.9 t -99.35 -50.4 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.098 -1.002 . . . . 0.0 109.586 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.29 -37.67 88.32 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.537 -0.727 . . . . 0.0 110.417 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.6 p -58.15 -53.15 61.47 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.452 -0.78 . . . . 0.0 109.421 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 32.1 t80 -65.39 -39.39 92.16 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.43 -34.82 74.51 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.712 -0.618 . . . . 0.0 109.851 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -73.55 -40.4 63.99 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.463 -0.773 . . . . 0.0 109.654 178.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.439 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.95 -36.21 78.77 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.556 -0.715 . . . . 0.0 109.945 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -55.29 -39.44 69.88 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.56 -0.713 . . . . 0.0 110.328 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.457 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -56.26 -61.03 2.67 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-O 121.387 0.613 . . . . 0.0 110.506 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.41 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 20.1 mt-10 -69.53 -30.44 68.27 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.578 -0.701 . . . . 0.0 110.823 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.439 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -52.38 -49.48 64.34 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.377 -0.827 . . . . 0.0 109.41 179.29 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 15.8 t90 -69.2 -43.61 73.81 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.548 -0.72 . . . . 0.0 109.461 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.41 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 34.5 t80 -55.92 -55.36 33.52 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.658 -0.651 . . . . 0.0 109.578 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 40.1 m95 -63.05 -33.22 74.98 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.478 -0.764 . . . . 0.0 110.112 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 16.5 t-20 -59.02 -39.45 81.95 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.509 -0.744 . . . . 0.0 110.901 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.425 ' HA ' ' HB3' ' A' ' 24' ' ' PRO . 28.2 m -101.63 2.65 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 O-C-N 121.246 -0.909 . . . . 0.0 111.257 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.6 m -106.2 -38.36 6.28 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.089 -1.007 . . . . 0.0 110.472 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.468 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 80.2 mt -66.17 -58.2 5.94 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.464 -0.772 . . . . 0.0 110.386 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.468 ' HD3' ' HB3' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -165.38 81.51 1.16 Allowed Pre-proline 0 N--CA 1.497 1.913 0 O-C-N 121.485 -0.759 . . . . 0.0 110.236 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.425 ' HB3' ' HA ' ' A' ' 20' ' ' VAL . 47.7 Cg_endo -72.28 175.6 9.76 Favored 'Trans proline' 0 C--N 1.313 -1.316 0 O-C-N 123.932 1.491 . . . . 0.0 110.884 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER 60.99 178.17 0.1 Allowed 'General case' 0 N--CA 1.505 2.275 0 CA-C-O 121.286 0.565 . . . . 0.0 111.002 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.035 0 O-C-N 121.27 -0.894 . . . . 0.0 110.834 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.879 0 CA-C-O 121.061 0.458 . . . . 0.0 110.443 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -119.0 162.22 18.91 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.462 -0.774 . . . . 0.0 109.921 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -90.78 -40.23 11.92 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.42 -0.8 . . . . 0.0 110.556 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.4 tp -91.73 21.83 4.52 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.285 -0.884 . . . . 0.0 110.882 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.9 t -124.12 -46.0 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.207 -0.933 . . . . 0.0 110.356 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -23.06 60.66 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.34 -0.85 . . . . 0.0 110.85 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -50.71 -55.77 15.06 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.407 -0.808 . . . . 0.0 110.796 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -74.37 -42.97 58.42 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.463 -0.773 . . . . 0.0 109.858 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.0 mt -56.12 -40.08 73.2 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.66 -0.65 . . . . 0.0 110.782 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -72.32 -48.82 39.07 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.383 -0.823 . . . . 0.0 110.044 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.445 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 6.1 tp60 -63.04 -54.72 33.73 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.416 -0.802 . . . . 0.0 110.652 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.23 -38.23 39.48 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.457 -0.777 . . . . 0.0 110.812 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.515 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -59.89 -57.8 11.32 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.429 -0.794 . . . . 0.0 110.798 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -77.35 -42.52 36.26 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.712 -0.617 . . . . 0.0 111.469 -178.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -53.42 -43.36 67.9 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.18 -0.95 . . . . 0.0 109.588 179.619 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -69.17 -46.04 68.51 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.455 -0.778 . . . . 0.0 109.13 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -59.18 -43.78 92.17 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.497 -0.752 . . . . 0.0 110.156 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.464 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 3.9 m95 -75.21 -13.67 60.47 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.409 -0.807 . . . . 0.0 111.064 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -101.68 -24.48 14.09 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.849 -1.157 . . . . 0.0 110.659 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 48.0 t -105.89 -40.9 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.294 -0.879 . . . . 0.0 111.037 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.2 m -77.86 -34.35 51.76 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.196 -0.94 . . . . 0.0 111.141 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 31.0 mt -71.56 -63.92 1.03 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.376 -0.827 . . . . 0.0 110.033 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? 48.57 63.45 10.34 Favored Pre-proline 0 N--CA 1.502 2.17 0 O-C-N 121.853 -0.529 . . . . 0.0 110.925 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -77.4 82.96 2.25 Favored 'Trans proline' 0 C--N 1.315 -1.188 0 O-C-N 123.643 1.339 . . . . 0.0 110.489 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 54.3 40.06 31.41 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.548 -0.72 . . . . 0.0 110.744 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.9 mtm-85 . . . . . 0 N--CA 1.496 1.874 0 CA-C-O 117.927 -1.035 . . . . 0.0 110.464 179.945 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 121.299 0.571 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.08 148.61 40.42 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.214 -0.929 . . . . 0.0 110.267 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.79 -10.6 21.63 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.613 -0.679 . . . . 0.0 111.082 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.9 tp -101.31 2.3 39.57 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.221 -0.924 . . . . 0.0 110.972 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.4 t -106.32 -57.1 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.255 -0.903 . . . . 0.0 109.866 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -62.93 -42.5 99.82 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.56 -0.713 . . . . 0.0 110.442 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.3 t -58.42 -47.61 83.37 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.403 -0.81 . . . . 0.0 109.533 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -66.53 -40.37 89.09 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.746 -0.596 . . . . 0.0 109.705 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.418 HD21 ' HA ' ' A' ' 9' ' ' LEU . 0.6 OUTLIER -54.74 -36.98 65.36 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.685 -0.634 . . . . 0.0 110.669 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -83.15 -45.97 13.29 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.376 -0.828 . . . . 0.0 109.925 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.428 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.98 -48.09 83.45 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.422 -0.799 . . . . 0.0 110.177 -179.865 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.25 -39.34 69.66 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.46 -0.775 . . . . 0.0 110.008 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.481 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -55.76 -60.82 2.91 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.373 0.606 . . . . 0.0 110.349 179.633 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -70.86 -31.16 67.76 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.84 -0.538 . . . . 0.0 110.856 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.7 OUTLIER -50.74 -46.36 59.21 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.422 -0.799 . . . . 0.0 109.62 179.237 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.476 ' CD1' HG21 ' A' ' 20' ' ' VAL . 6.7 t90 -73.04 -44.57 60.59 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.506 -0.746 . . . . 0.0 109.177 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -55.18 -45.06 75.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.538 -0.726 . . . . 0.0 109.99 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.443 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 5.5 m95 -73.51 -43.33 60.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.421 -0.799 . . . . 0.0 110.193 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -62.73 -36.14 82.04 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.361 -0.837 . . . . 0.0 110.82 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.476 HG21 ' CD1' ' A' ' 16' ' ' TRP . 90.2 t -84.01 -36.65 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.216 -0.927 . . . . 0.0 110.78 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.3 m -78.91 -42.51 26.96 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.126 -0.984 . . . . 0.0 110.722 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 12.4 mt -86.79 -27.56 23.5 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.38 -0.825 . . . . 0.0 110.721 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 6.3 ttt-85 55.74 71.66 1.19 Allowed Pre-proline 0 N--CA 1.5 2.05 0 O-C-N 121.73 -0.606 . . . . 0.0 110.518 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -73.46 149.87 45.26 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 O-C-N 123.726 1.382 . . . . 0.0 110.794 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -96.32 -51.47 4.37 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.685 -0.634 . . . . 0.0 110.223 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.228 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 120.98 0.419 . . . . 0.0 110.473 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.469 ' CB ' ' HB ' ' A' ' 5' ' ' VAL . 0.2 OUTLIER -127.24 172.34 10.67 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.47 -0.769 . . . . 0.0 110.536 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -91.1 -42.12 10.66 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.491 -0.756 . . . . 0.0 110.706 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.44 14.25 31.78 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.423 -0.798 . . . . 0.0 111.112 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.469 ' HB ' ' CB ' ' A' ' 2' ' ' SER . 40.7 t -121.49 -49.09 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.189 -0.944 . . . . 0.0 109.869 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.95 -31.25 72.39 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.397 -0.814 . . . . 0.0 110.68 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -54.15 -46.64 72.33 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.417 -0.802 . . . . 0.0 109.774 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -71.43 -40.14 70.59 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.548 -0.72 . . . . 0.0 109.578 178.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -61.69 -48.73 79.47 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.587 -0.696 . . . . 0.0 109.833 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -65.9 -39.57 90.74 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.49 -0.756 . . . . 0.0 109.515 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -60.82 -43.26 98.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.476 -0.765 . . . . 0.0 110.189 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -24.48 53.57 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.579 -0.701 . . . . 0.0 110.974 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.517 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -78.16 -60.6 2.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.256 -0.903 . . . . 0.0 110.236 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -71.36 -28.89 64.37 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.521 -0.737 . . . . 0.0 111.382 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.429 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 2.4 t-20 -53.31 -51.52 62.07 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.174 -0.954 . . . . 0.0 109.539 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -65.33 -43.75 89.97 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -55.59 -59.26 5.09 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.709 -0.619 . . . . 0.0 109.808 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.42 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 6.9 m95 -60.53 -33.12 72.19 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.368 -0.832 . . . . 0.0 110.346 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -57.04 -39.94 75.8 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.308 -0.87 . . . . 0.0 110.217 179.511 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.568 ' HA ' ' HB3' ' A' ' 24' ' ' PRO . 27.1 m -95.53 -29.44 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.317 -0.865 . . . . 0.0 110.499 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 94.2 m -68.95 -42.41 76.72 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.209 -0.932 . . . . 0.0 109.987 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.4 mt -80.58 -69.37 0.6 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.486 -0.759 . . . . 0.0 110.237 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -154.86 97.41 2.49 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.443 -0.785 . . . . 0.0 109.975 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.568 ' HB3' ' HA ' ' A' ' 20' ' ' VAL . 44.2 Cg_endo -72.38 126.21 11.41 Favored 'Trans proline' 0 C--N 1.313 -1.3 0 O-C-N 123.912 1.48 . . . . 0.0 110.779 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -94.45 -59.37 1.96 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.499 -0.75 . . . . 0.0 110.197 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.292 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 . . . . . 0 N--CA 1.495 1.813 0 CA-C-O 121.24 0.543 . . . . 0.0 110.09 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.613 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.4 OUTLIER -142.6 144.18 32.73 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.459 -0.775 . . . . 0.0 110.33 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -104.2 -44.62 4.92 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.67 -0.643 . . . . 0.0 110.73 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.31 -37.22 15.07 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.403 -0.811 . . . . 0.0 110.754 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.613 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 84.6 t -58.22 -41.62 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.527 -0.733 . . . . 0.0 110.128 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -62.7 -37.43 86.46 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.531 -0.731 . . . . 0.0 110.209 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.9 m -58.94 -49.75 76.64 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.387 -0.821 . . . . 0.0 109.406 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -65.02 -45.87 83.73 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.672 -0.642 . . . . 0.0 109.356 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -58.29 -43.95 88.27 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.718 -0.614 . . . . 0.0 109.875 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -67.54 -42.9 81.96 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.584 -0.698 . . . . 0.0 109.509 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 19.5 mm-40 -64.67 -50.94 65.06 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.516 -0.74 . . . . 0.0 110.126 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -53.17 -34.96 59.13 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.503 -0.748 . . . . 0.0 110.347 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.493 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -61.3 -55.26 33.78 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.565 -0.709 . . . . 0.0 110.676 179.814 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -78.9 -42.71 26.48 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.699 -0.626 . . . . 0.0 111.363 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -55.6 -38.3 69.24 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.467 -0.771 . . . . 0.0 110.301 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -63.66 -49.0 74.91 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.412 -0.805 . . . . 0.0 109.453 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -56.22 -51.01 69.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.708 -0.62 . . . . 0.0 109.79 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.407 ' CE3' HD12 ' A' ' 22' ' ' LEU . 30.9 m95 -63.41 -31.83 73.09 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.525 -0.735 . . . . 0.0 110.769 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.15 -41.76 97.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.299 -0.876 . . . . 0.0 110.51 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.6 m -89.76 -14.42 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.326 -0.858 . . . . 0.0 110.969 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.2 m -92.76 -35.41 13.45 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.124 -0.985 . . . . 0.0 110.636 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.407 HD12 ' CE3' ' A' ' 18' ' ' TRP . 31.7 mt -91.87 -86.82 0.22 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.313 -0.867 . . . . 0.0 110.326 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.8 ttt180 -166.36 116.28 0.77 Allowed Pre-proline 0 N--CA 1.495 1.786 0 O-C-N 121.316 -0.865 . . . . 0.0 110.237 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.51 142.7 49.78 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.865 1.455 . . . . 0.0 110.664 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -96.41 -55.67 2.86 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.686 -0.634 . . . . 0.0 110.202 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.117 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.026 0.441 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.35 147.4 42.22 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.432 -0.793 . . . . 0.0 110.307 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.35 -38.11 5.57 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.469 -0.769 . . . . 0.0 110.835 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.13 13.35 6.35 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.32 -0.863 . . . . 0.0 111.525 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.8 t -100.74 -39.09 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.077 -1.014 . . . . 0.0 110.343 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -90.8 -37.88 13.35 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.238 -0.914 . . . . 0.0 110.584 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.9 t -58.56 -52.51 65.37 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.481 -0.762 . . . . 0.0 110.783 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.467 ' CZ ' HD13 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -63.07 -30.84 71.91 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.369 -0.832 . . . . 0.0 110.266 179.907 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.467 HD13 ' CZ ' ' A' ' 8' ' ' TYR . 3.6 tp -67.59 -46.94 71.17 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.368 -0.832 . . . . 0.0 109.732 179.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.0 t-105 -60.02 -37.24 79.16 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.621 -0.674 . . . . 0.0 109.379 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.502 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.64 -46.81 88.9 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.568 -0.707 . . . . 0.0 109.592 179.053 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.41 -39.24 56.85 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.74 -0.6 . . . . 0.0 110.483 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.492 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -59.42 -57.46 12.91 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.598 -0.689 . . . . 0.0 110.645 -179.914 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -75.48 -40.0 57.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.598 -0.689 . . . . 0.0 111.603 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.502 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -51.86 -43.33 63.21 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.304 -0.873 . . . . 0.0 110.179 -179.825 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.1 t90 -66.61 -48.9 68.06 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.413 -0.804 . . . . 0.0 109.24 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -56.59 -51.76 67.4 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.796 -0.565 . . . . 0.0 109.877 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.433 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 6.3 m95 -63.87 -30.42 71.51 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.528 -0.732 . . . . 0.0 110.428 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.47 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 8.7 t-20 -65.14 -46.45 80.87 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.268 -0.895 . . . . 0.0 110.65 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.5 m -86.36 -26.05 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.283 -0.885 . . . . 0.0 111.133 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.7 m -78.81 -36.96 41.89 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.215 -0.928 . . . . 0.0 110.648 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 mt -89.31 -26.24 21.22 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.333 -0.854 . . . . 0.0 110.838 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 12.6 mtt85 57.56 91.1 0.08 OUTLIER Pre-proline 0 N--CA 1.502 2.165 0 O-C-N 121.817 -0.552 . . . . 0.0 111.019 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.76 119.18 6.14 Favored 'Trans proline' 0 C--N 1.314 -1.25 0 O-C-N 123.674 1.355 . . . . 0.0 110.05 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 55.08 64.26 1.85 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.728 -0.608 . . . . 0.0 110.026 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 . . . . . 0 N--CA 1.502 2.149 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.686 -179.721 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.776 0 CA-C-O 121.256 0.551 . . . . 0.0 110.182 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.6 m -144.04 158.26 43.82 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.388 -0.82 . . . . 0.0 110.25 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.27 99.21 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.544 -0.722 . . . . 0.0 110.317 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.67 -35.02 67.61 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.455 -0.778 . . . . 0.0 110.366 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.0 t -70.38 -48.01 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.447 -0.783 . . . . 0.0 110.157 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.443 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 1.3 t-20 -65.47 -36.08 82.82 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.542 -0.724 . . . . 0.0 110.508 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.1 t -57.1 -44.29 83.05 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.47 -0.769 . . . . 0.0 109.968 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -77.96 -37.27 47.88 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.449 -0.782 . . . . 0.0 109.598 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 12.3 mt -56.5 -41.87 77.37 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.677 -0.639 . . . . 0.0 110.281 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.415 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 4.5 t-105 -58.79 -42.95 90.27 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.447 -0.783 . . . . 0.0 109.584 179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.45 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -61.5 -44.36 97.2 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.435 -0.79 . . . . 0.0 109.433 179.129 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -54.59 -39.15 67.56 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.712 -0.618 . . . . 0.0 110.144 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.495 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -56.79 -60.05 4.13 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.39 0.614 . . . . 0.0 110.248 179.747 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.66 -33.49 72.66 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.556 -0.715 . . . . 0.0 110.567 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.45 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -52.19 -43.74 64.33 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.475 -0.766 . . . . 0.0 109.838 179.437 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.0 t90 -70.06 -45.53 66.89 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.54 -0.725 . . . . 0.0 109.224 178.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -58.81 -48.76 80.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.826 -0.546 . . . . 0.0 109.748 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.47 ' HB3' HD13 ' A' ' 22' ' ' LEU . 5.5 m95 -67.5 -33.84 75.93 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.454 -0.779 . . . . 0.0 110.019 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -64.46 -45.01 89.27 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.335 -0.853 . . . . 0.0 110.549 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.9 m -85.08 -24.63 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.21 -0.932 . . . . 0.0 111.263 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 65.9 m -84.46 -40.35 17.83 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.065 -1.022 . . . . 0.0 110.469 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.47 HD13 ' HB3' ' A' ' 18' ' ' TRP . 10.9 mt -96.55 -22.19 17.23 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.435 -0.791 . . . . 0.0 110.829 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 52.92 65.88 5.45 Favored Pre-proline 0 N--CA 1.5 2.061 0 O-C-N 121.663 -0.648 . . . . 0.0 110.488 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.8 91.76 0.8 Allowed 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.718 1.378 . . . . 0.0 110.914 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -112.3 139.12 48.12 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 110.217 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.915 0 CA-C-O 118.268 -0.873 . . . . 0.0 110.615 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.0 ttm180 . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 121.033 0.444 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.485 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 0.4 OUTLIER -162.77 175.65 11.08 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.582 -0.699 . . . . 0.0 110.179 -179.947 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.01 -38.98 8.76 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.361 -0.837 . . . . 0.0 110.75 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 mt -106.31 9.32 31.98 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.375 -0.828 . . . . 0.0 111.515 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 2' ' ' SER . 78.5 t -108.83 -56.81 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.04 -1.038 . . . . 0.0 109.644 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -65.2 -38.92 91.99 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.63 -0.669 . . . . 0.0 110.165 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.1 t -58.07 -47.75 82.22 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.459 -0.776 . . . . 0.0 109.654 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -69.26 -41.87 76.32 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.55 -0.718 . . . . 0.0 109.836 179.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.89 -40.41 95.31 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.54 -0.725 . . . . 0.0 110.528 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.7 t90 -66.2 -46.88 75.75 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.337 -0.852 . . . . 0.0 110.154 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -37.58 67.74 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.339 -0.851 . . . . 0.0 110.222 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -32.4 68.87 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.569 -0.707 . . . . 0.0 110.394 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.74 -44.89 88.68 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.458 -0.776 . . . . 0.0 109.983 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -70.2 -39.94 74.89 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.327 -0.858 . . . . 0.0 109.964 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.53 -48.26 77.63 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.498 -0.751 . . . . 0.0 109.282 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -68.74 -42.57 77.39 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.597 -0.689 . . . . 0.0 109.452 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.3 -57.84 10.85 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.711 -0.618 . . . . 0.0 110.207 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.444 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.6 m95 -59.52 -37.12 77.51 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.332 -0.855 . . . . 0.0 110.428 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -56.35 -44.91 80.53 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.505 -0.747 . . . . 0.0 110.821 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.5 m -92.74 -31.78 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.3 -0.875 . . . . 0.0 110.976 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.8 m -69.74 -32.19 70.59 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.184 -0.947 . . . . 0.0 110.264 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 10.4 mt -105.4 -103.3 0.32 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.441 -0.787 . . . . 0.0 109.367 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.711 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER 173.91 -55.48 0.0 OUTLIER Pre-proline 0 N--CA 1.503 2.179 0 O-C-N 121.541 -0.724 . . . . 0.0 110.483 179.346 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.711 ' HD3' ' HB3' ' A' ' 23' ' ' ARG . 53.8 Cg_endo -79.82 -171.77 1.34 Allowed 'Trans proline' 0 N--CA 1.487 1.112 0 O-C-N 123.286 1.15 . . . . 0.0 110.953 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.6 166.85 22.08 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.507 -0.746 . . . . 0.0 110.158 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.304 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 27.2 ttt85 . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 120.979 0.418 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.39 -166.26 0.16 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.686 -0.634 . . . . 0.0 110.7 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -114.58 -50.44 2.79 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.153 -0.967 . . . . 0.0 110.89 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.16 26.64 3.19 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.316 -0.865 . . . . 0.0 111.036 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 52.5 t -106.25 -53.99 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.16 -0.962 . . . . 0.0 109.682 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.88 -35.68 81.33 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.449 -0.782 . . . . 0.0 110.165 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.9 p -59.68 -48.79 80.27 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.453 -0.78 . . . . 0.0 109.24 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -66.62 -37.73 85.47 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.644 -0.66 . . . . 0.0 109.221 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.5 mt -58.75 -44.78 90.63 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.717 -0.614 . . . . 0.0 109.963 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.7 t90 -62.85 -45.75 91.1 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.645 -0.659 . . . . 0.0 109.366 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -39.79 74.07 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.514 -0.741 . . . . 0.0 110.011 179.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -63.54 -39.75 95.23 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.622 -0.674 . . . . 0.0 110.385 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -45.69 92.73 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.475 -0.766 . . . . 0.0 109.72 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -72.69 -39.05 67.33 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.252 -0.905 . . . . 0.0 109.726 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.63 -42.91 68.29 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.602 -0.686 . . . . 0.0 109.86 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -70.39 -45.12 66.6 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.453 -0.779 . . . . 0.0 109.297 179.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -55.47 -45.88 76.91 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.69 -0.631 . . . . 0.0 109.65 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 25.6 m95 -72.84 -36.52 67.48 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.613 -0.679 . . . . 0.0 109.958 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -53.99 -43.43 69.98 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.547 -0.721 . . . . 0.0 110.651 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.499 ' HA ' ' CD ' ' A' ' 23' ' ' ARG . 28.8 m -84.46 -27.93 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.374 -0.829 . . . . 0.0 110.896 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.8 m -80.54 -24.54 39.22 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.219 -0.926 . . . . 0.0 110.917 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.3 -3.53 47.23 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.305 -0.872 . . . . 0.0 111.366 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.499 ' CD ' ' HA ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -48.47 -55.37 19.48 Favored Pre-proline 0 N--CA 1.504 2.246 0 O-C-N 121.394 -0.816 . . . . 0.0 111.237 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.436 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 46.8 Cg_endo -71.95 98.56 0.9 Allowed 'Trans proline' 0 N--CA 1.486 1.04 0 O-C-N 123.468 1.246 . . . . 0.0 110.375 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.21 -167.23 0.98 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.466 -0.771 . . . . 0.0 110.559 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.749 0 O-C-N 121.318 -0.864 . . . . 0.0 110.268 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 28.9 ttp85 . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 120.992 0.425 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.457 ' O ' ' CB ' ' A' ' 3' ' ' ALA . 48.7 m 54.29 -114.09 0.84 Allowed 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.771 -0.581 . . . . 0.0 110.597 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.457 ' CB ' ' O ' ' A' ' 2' ' ' SER . . . 74.32 -48.53 0.66 Allowed 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.545 -0.722 . . . . 0.0 110.641 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.7 mt -114.3 9.81 17.03 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.28 -0.887 . . . . 0.0 110.596 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.8 t -116.67 -47.64 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.27 -0.894 . . . . 0.0 109.689 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.94 -34.05 30.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.429 -0.794 . . . . 0.0 110.408 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.6 m -52.72 -48.09 66.9 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.462 -0.774 . . . . 0.0 110.232 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -70.03 -43.14 71.93 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.464 -0.773 . . . . 0.0 109.519 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.1 mt -59.57 -43.46 93.59 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.678 -0.639 . . . . 0.0 110.12 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -62.51 -44.94 95.14 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.637 -0.665 . . . . 0.0 110.032 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -59.08 -41.33 87.76 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.283 -0.886 . . . . 0.0 110.103 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -39.49 94.92 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.607 -0.683 . . . . 0.0 110.364 179.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -45.43 93.49 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.471 -0.768 . . . . 0.0 109.94 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -72.59 -34.87 67.72 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.233 -0.917 . . . . 0.0 109.956 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.31 -47.74 72.1 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.524 -0.735 . . . . 0.0 109.521 178.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -74.16 -41.93 60.72 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.519 -0.738 . . . . 0.0 109.582 179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -55.36 -47.99 74.91 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.544 -0.723 . . . . 0.0 110.427 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 21.1 m95 -72.53 -33.42 66.85 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.447 -0.783 . . . . 0.0 110.379 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -58.96 -30.57 68.0 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.364 -0.835 . . . . 0.0 110.774 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.6 m -100.12 -19.94 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.236 -0.915 . . . . 0.0 110.835 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.4 m -88.91 -27.05 21.24 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.237 -0.914 . . . . 0.0 110.782 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.3 mt -83.96 -22.38 31.47 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.269 -0.894 . . . . 0.0 110.969 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.516 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -59.72 -52.96 70.17 Favored Pre-proline 0 N--CA 1.499 2.001 0 O-C-N 121.454 -0.779 . . . . 0.0 110.841 -179.889 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.516 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 50.8 Cg_endo -87.26 22.38 0.93 Allowed 'Trans proline' 0 C--N 1.32 -0.971 0 O-C-N 123.478 1.251 . . . . 0.0 111.496 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.0 -177.32 0.08 Allowed 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.405 -0.809 . . . . 0.0 111.308 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.627 -179.789 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.122 0.486 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.25 141.43 34.13 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.405 -0.809 . . . . 0.0 110.621 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -72.57 -22.98 60.91 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.551 -0.718 . . . . 0.0 111.044 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -84.87 6.43 24.8 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.201 -0.937 . . . . 0.0 111.408 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.2 t -101.51 -50.22 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 121.112 -0.993 . . . . 0.0 109.999 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -74.42 -40.78 61.77 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.498 -0.751 . . . . 0.0 110.624 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 m -54.65 -52.32 62.66 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.36 -0.837 . . . . 0.0 109.747 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -62.73 -42.65 99.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.521 -0.737 . . . . 0.0 109.386 178.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.76 -44.76 90.67 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.634 -0.666 . . . . 0.0 109.901 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -64.81 -42.86 94.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.712 -0.617 . . . . 0.0 109.673 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -61.19 -39.58 90.72 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.289 -0.882 . . . . 0.0 110.312 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -37.27 86.95 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.402 -0.811 . . . . 0.0 110.275 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.414 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -65.79 -46.35 79.02 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.369 -0.832 . . . . 0.0 109.596 179.653 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -68.62 -35.25 77.06 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.399 -0.813 . . . . 0.0 109.932 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -55.83 -53.22 59.38 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.56 -0.713 . . . . 0.0 109.227 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -65.85 -42.25 90.68 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.676 -0.64 . . . . 0.0 109.396 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.414 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 55.4 t80 -54.87 -57.53 11.22 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.715 -0.616 . . . . 0.0 109.828 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.3 m95 -64.52 -32.91 74.75 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.368 -0.832 . . . . 0.0 110.185 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -55.92 -35.31 66.45 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.455 -0.778 . . . . 0.0 110.491 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 30.1 m -104.33 -9.59 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.283 -0.885 . . . . 0.0 111.002 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 67.1 m -93.44 -33.05 13.97 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.188 -0.945 . . . . 0.0 110.496 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.3 mt -82.35 -20.02 38.1 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.407 -0.808 . . . . 0.0 110.911 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.568 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -63.62 -52.86 55.86 Favored Pre-proline 0 N--CA 1.498 1.942 0 O-C-N 121.363 -0.836 . . . . 0.0 111.017 -179.767 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.568 ' HD3' ' HB3' ' A' ' 23' ' ' ARG . 52.5 Cg_endo -78.34 50.85 3.49 Favored 'Trans proline' 0 N--CA 1.488 1.2 0 O-C-N 123.37 1.195 . . . . 0.0 110.627 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -166.05 160.75 16.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.253 -0.905 . . . . 0.0 110.161 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 117.828 -1.082 . . . . 0.0 110.4 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.815 0 CA-C-O 121.05 0.452 . . . . 0.0 110.103 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 t -75.51 148.74 38.72 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.385 -0.822 . . . . 0.0 110.006 179.682 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.46 -4.8 16.06 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.46 -0.775 . . . . 0.0 111.321 -179.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.6 mt -117.9 -4.73 11.08 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.002 -1.061 . . . . 0.0 111.303 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 58.9 t -114.96 -53.86 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.082 -1.011 . . . . 0.0 110.175 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -85.65 -13.76 47.62 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.507 -0.745 . . . . 0.0 111.324 -179.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.508 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -63.86 -57.56 9.47 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.044 -1.035 . . . . 0.0 110.006 179.636 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -69.68 -14.74 62.96 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.316 -0.865 . . . . 0.0 111.158 179.69 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -95.82 -28.51 14.7 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.15 -0.969 . . . . 0.0 111.217 -179.595 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -99.84 -48.47 4.68 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.165 -0.959 . . . . 0.0 110.917 -179.656 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -55.02 -32.74 62.05 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.266 -0.896 . . . . 0.0 110.843 -179.542 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -61.09 -38.15 85.24 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.327 -0.858 . . . . 0.0 110.114 179.395 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.78 -45.14 93.22 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.646 -0.659 . . . . 0.0 109.553 179.7 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -69.18 -35.76 76.61 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.394 -0.816 . . . . 0.0 109.897 179.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -49.5 67.41 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.518 -0.739 . . . . 0.0 109.338 179.109 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -69.67 -43.19 73.02 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.492 -0.755 . . . . 0.0 109.279 178.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.76 -53.18 60.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.749 -0.595 . . . . 0.0 110.182 179.848 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -64.42 -36.46 84.23 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.299 -0.876 . . . . 0.0 110.197 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -58.49 -34.24 70.7 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.472 -0.767 . . . . 0.0 111.271 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.4 m -103.17 -27.66 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.206 -0.934 . . . . 0.0 111.115 -179.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.7 m -77.42 -41.65 39.09 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.163 -0.96 . . . . 0.0 110.768 -179.632 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.7 mt -67.7 -35.27 78.5 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.427 -0.796 . . . . 0.0 110.47 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -131.86 88.58 41.44 Favored Pre-proline 0 N--CA 1.493 1.677 0 O-C-N 121.51 -0.744 . . . . 0.0 110.08 179.782 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.8 151.63 57.48 Favored 'Trans proline' 0 C--N 1.312 -1.349 0 O-C-N 123.825 1.434 . . . . 0.0 110.721 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.42 155.25 43.03 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.713 -0.617 . . . . 0.0 110.416 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.893 0 CA-C-O 117.774 -1.108 . . . . 0.0 110.688 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 121.255 0.55 . . . . 0.0 110.039 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.493 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.4 OUTLIER -149.33 148.74 29.87 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.282 -0.886 . . . . 0.0 110.321 -179.892 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.06 -32.47 6.56 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.438 -0.789 . . . . 0.0 111.257 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 mp -105.64 14.83 27.85 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.117 -0.989 . . . . 0.0 111.438 -179.536 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.493 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 54.2 t -98.12 -33.42 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 O-C-N 121.132 -0.98 . . . . 0.0 109.912 179.345 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -87.27 -26.45 23.45 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.249 -0.907 . . . . 0.0 110.284 179.39 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 57.7 m -61.25 -56.0 25.62 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.526 -0.734 . . . . 0.0 110.718 -179.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.508 ' CZ ' HD13 ' A' ' 9' ' ' LEU . 1.2 p90 -67.2 -26.6 66.7 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.259 -0.901 . . . . 0.0 110.388 179.89 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.508 HD13 ' CZ ' ' A' ' 8' ' ' TYR . 1.4 tp -60.32 -42.86 96.48 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.327 -0.858 . . . . 0.0 109.836 178.949 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.567 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -78.06 -36.92 47.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.361 -0.837 . . . . 0.0 109.841 179.378 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -66.66 -47.6 71.99 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.403 -0.811 . . . . 0.0 109.727 179.385 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.445 ' O ' ' HB3' ' A' ' 16' ' ' TRP . 9.1 tmm_? -59.07 -17.23 24.05 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.487 -0.758 . . . . 0.0 110.337 178.982 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.427 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -83.42 -58.42 2.84 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.314 -0.866 . . . . 0.0 109.888 179.431 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -82.31 -47.69 12.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.811 -0.555 . . . . 0.0 111.515 -178.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.402 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -53.65 -40.12 65.61 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.164 -0.96 . . . . 0.0 110.284 -179.696 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.445 ' HB3' ' O ' ' A' ' 12' ' ' ARG . 9.1 t90 -75.26 -48.51 22.95 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.313 -0.867 . . . . 0.0 109.561 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -57.18 -49.74 75.03 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.597 -0.69 . . . . 0.0 110.309 -179.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.452 ' HE3' ' HA ' ' A' ' 18' ' ' TRP . 4.9 m95 -65.53 -35.43 80.82 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.187 -0.946 . . . . 0.0 110.033 179.664 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.548 ' HA ' ' HD2' ' A' ' 24' ' ' PRO . 5.3 t30 -71.66 -36.49 70.67 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.09 -1.006 . . . . 0.0 110.641 179.546 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.4 p -89.93 -20.65 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.383 -0.823 . . . . 0.0 111.07 -179.732 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.1 m -107.78 -59.21 1.87 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.199 -0.938 . . . . 0.0 110.202 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.1 mt -67.61 -31.19 71.06 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.505 -0.747 . . . . 0.0 110.352 179.624 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 53.29 63.11 8.72 Favored Pre-proline 0 N--CA 1.501 2.104 0 O-C-N 121.769 -0.582 . . . . 0.0 111.02 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.548 ' HD2' ' HA ' ' A' ' 19' ' ' ASN . 49.1 Cg_endo -73.52 170.84 19.01 Favored 'Trans proline' 0 C--N 1.315 -1.197 0 O-C-N 123.78 1.41 . . . . 0.0 110.627 179.67 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 57.55 -158.41 0.27 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.746 -0.596 . . . . 0.0 110.835 179.717 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.2 tpt85 . . . . . 0 N--CA 1.494 1.744 0 O-C-N 121.194 -0.941 . . . . 0.0 110.125 -179.924 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.9 mtt85 . . . . . 0 N--CA 1.495 1.798 0 CA-C-O 120.945 0.402 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.423 ' HB3' HG22 ' A' ' 5' ' ' VAL . 3.8 m -142.67 158.38 43.72 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.487 -0.758 . . . . 0.0 110.503 -179.974 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -97.36 -35.35 10.73 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.63 -0.669 . . . . 0.0 110.521 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 tp -89.48 15.13 9.8 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.279 -0.888 . . . . 0.0 111.179 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.423 HG22 ' HB3' ' A' ' 2' ' ' SER . 79.1 t -107.81 -53.66 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.017 -1.052 . . . . 0.0 109.527 179.564 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -69.32 -43.84 72.93 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.648 -0.657 . . . . 0.0 110.078 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.0 m -58.08 -46.84 84.78 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.294 -0.879 . . . . 0.0 109.384 179.057 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.492 ' CD2' HD12 ' A' ' 9' ' ' LEU . 10.9 t80 -59.67 -44.66 93.51 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.782 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.492 HD12 ' CD2' ' A' ' 8' ' ' TYR . 0.3 OUTLIER -67.59 -43.86 79.49 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.738 -0.601 . . . . 0.0 109.975 179.551 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.473 ' CE3' ' HG3' ' A' ' 11' ' ' GLN . 19.1 t90 -61.94 -45.11 95.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.668 -0.645 . . . . 0.0 109.665 179.403 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.473 ' HG3' ' CE3' ' A' ' 10' ' ' TRP . 5.0 mt-30 -58.12 -39.11 77.87 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.486 -0.759 . . . . 0.0 110.244 179.692 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.8 mmt-85 -64.7 -42.96 94.93 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.491 -0.756 . . . . 0.0 110.367 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -44.87 91.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.441 -0.787 . . . . 0.0 109.998 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -74.17 -35.89 64.03 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.225 -0.922 . . . . 0.0 110.223 179.54 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -55.45 -47.78 75.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.39 -0.818 . . . . 0.0 109.781 179.472 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.4 t90 -67.08 -46.07 75.42 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.587 -0.696 . . . . 0.0 109.361 179.043 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -55.14 -52.4 63.42 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.723 -0.61 . . . . 0.0 109.723 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -66.79 -31.13 71.56 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.484 -0.76 . . . . 0.0 110.065 179.384 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.448 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 4.3 t30 -57.98 -46.24 85.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.409 -0.807 . . . . 0.0 110.152 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 30.0 m -84.99 -25.89 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.349 -0.845 . . . . 0.0 110.608 179.589 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.2 m -74.37 -37.64 63.41 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.248 -0.907 . . . . 0.0 110.231 179.713 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.6 mt -84.33 -36.23 22.7 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.501 -0.749 . . . . 0.0 110.373 179.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -141.95 82.25 13.76 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.426 -0.796 . . . . 0.0 110.34 179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.66 152.5 69.86 Favored 'Trans proline' 0 C--N 1.314 -1.26 0 O-C-N 123.543 1.286 . . . . 0.0 110.787 179.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -94.31 -54.33 3.59 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.688 -0.632 . . . . 0.0 110.429 -179.84 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 117.884 -1.055 . . . . 0.0 110.26 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.0 ptp180 . . . . . 0 N--CA 1.497 1.906 0 CA-C-O 121.074 0.464 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.9 -168.07 2.83 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.544 -0.723 . . . . 0.0 110.234 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -111.26 -53.28 2.72 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.303 -0.873 . . . . 0.0 110.582 -179.755 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.1 pp -107.78 0.02 21.96 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.338 -0.851 . . . . 0.0 111.126 -179.977 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.9 t -101.34 -54.13 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.173 -0.954 . . . . 0.0 109.763 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -68.7 -40.94 79.79 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.579 -0.701 . . . . 0.0 110.365 179.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 t -55.39 -48.7 73.93 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.365 -0.834 . . . . 0.0 109.585 179.615 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -60.65 -43.65 97.35 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.606 -0.684 . . . . 0.0 109.488 178.983 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.05 -43.18 88.26 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.561 -0.712 . . . . 0.0 109.822 179.604 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.429 ' CE3' ' HG3' ' A' ' 11' ' ' GLN . 12.3 t90 -65.79 -42.65 90.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.645 -0.659 . . . . 0.0 109.931 179.492 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.429 ' HG3' ' CE3' ' A' ' 10' ' ' TRP . 10.0 mt-30 -54.14 -46.28 72.21 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.385 -0.822 . . . . 0.0 110.352 179.869 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -64.36 -33.49 75.97 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.655 -0.653 . . . . 0.0 110.8 -179.923 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.488 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -66.85 -44.55 80.72 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.31 -0.869 . . . . 0.0 110.402 -179.63 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.488 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 6.3 mt-10 -75.94 -49.97 16.26 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.193 -0.942 . . . . 0.0 110.922 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.1 -39.5 59.87 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.329 -0.857 . . . . 0.0 110.185 179.893 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.1 t90 -77.16 -45.29 27.23 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.385 -0.822 . . . . 0.0 109.534 179.035 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -55.65 -53.99 49.71 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.628 -0.67 . . . . 0.0 110.033 -179.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.535 ' HB3' HD13 ' A' ' 22' ' ' LEU . 6.1 m95 -59.97 -33.07 71.45 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.22 -0.925 . . . . 0.0 110.075 179.384 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -38.13 80.57 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.424 -0.798 . . . . 0.0 110.995 179.666 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.9 m -103.93 -25.87 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 O-C-N 121.409 -0.807 . . . . 0.0 111.348 -179.391 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.1 m -82.78 -48.37 10.89 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.094 -1.004 . . . . 0.0 110.757 -179.511 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.535 HD13 ' HB3' ' A' ' 18' ' ' TRP . 49.4 mt -79.71 -75.34 0.26 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.427 -0.796 . . . . 0.0 110.207 179.981 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 ttp180 51.33 74.06 0.86 Allowed Pre-proline 0 N--CA 1.501 2.075 0 O-C-N 121.686 -0.634 . . . . 0.0 110.511 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -79.03 68.43 8.28 Favored 'Trans proline' 0 C--N 1.316 -1.17 0 O-C-N 123.805 1.423 . . . . 0.0 110.67 -179.742 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 51.57 58.81 5.09 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.557 -0.714 . . . . 0.0 110.679 179.919 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.501 -179.843 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 120.981 0.42 . . . . 0.0 110.323 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.406 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.1 OUTLIER -148.75 154.26 39.33 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.54 -0.725 . . . . 0.0 110.316 179.934 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.08 -34.8 10.25 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.541 -0.725 . . . . 0.0 110.759 -179.743 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.38 -21.88 35.68 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.262 -0.899 . . . . 0.0 111.128 -179.878 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.406 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 75.7 t -70.09 -46.52 72.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.278 -0.889 . . . . 0.0 110.092 179.989 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -61.72 -37.54 84.55 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.461 -0.775 . . . . 0.0 110.203 179.737 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.4 t -62.66 -46.96 85.77 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -0.839 . . . . 0.0 110.059 179.48 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.05 -39.38 83.04 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.444 -0.785 . . . . 0.0 109.806 179.607 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' A' ' 9' ' ' LEU . 0.2 OUTLIER -67.33 -44.31 79.41 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.433 -0.792 . . . . 0.0 109.963 179.336 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.476 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 3.5 t-105 -60.81 -37.75 83.05 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.647 -0.658 . . . . 0.0 110.252 179.721 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.1 -49.76 73.2 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.298 -0.877 . . . . 0.0 109.648 179.573 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -35.86 75.99 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.611 -0.681 . . . . 0.0 109.825 179.037 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.439 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -55.53 -50.81 68.99 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.722 0.772 . . . . 0.0 109.803 179.146 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -78.44 -31.74 48.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.859 -0.526 . . . . 0.0 110.168 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.41 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -49.52 -49.17 47.09 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.601 -0.687 . . . . 0.0 109.818 179.413 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -72.52 -44.58 62.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.624 -0.673 . . . . 0.0 109.297 178.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -53.8 -48.9 69.37 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.839 -0.538 . . . . 0.0 110.148 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.423 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 5.8 m95 -70.2 -39.45 75.18 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.391 -0.818 . . . . 0.0 109.74 179.391 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 7.7 t-20 -62.45 -55.69 25.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.309 -0.869 . . . . 0.0 110.38 179.595 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.6 p -66.52 -22.66 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.334 -0.853 . . . . 0.0 111.641 -179.828 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.1 m -90.79 -36.25 14.37 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.002 -1.061 . . . . 0.0 110.921 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.6 mt -88.59 -39.85 13.8 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.333 -0.854 . . . . 0.0 110.594 -179.674 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -152.98 91.49 3.43 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 121.547 -0.721 . . . . 0.0 110.126 -179.766 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -74.51 70.36 4.92 Favored 'Trans proline' 0 C--N 1.315 -1.208 0 O-C-N 123.777 1.409 . . . . 0.0 111.135 -179.595 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -96.88 -42.6 7.86 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.317 -0.864 . . . . 0.0 109.852 179.508 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.174 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 120.913 0.387 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.8 t 55.57 -149.42 0.45 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.671 -0.643 . . . . 0.0 110.627 -179.805 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.93 -53.92 0.16 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.318 -0.864 . . . . 0.0 110.612 -179.807 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.63 4.38 43.27 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.387 -0.821 . . . . 0.0 111.297 -179.775 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 78.8 t -100.28 -56.41 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 121.092 -1.005 . . . . 0.0 109.781 179.773 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.45 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.3 OUTLIER -65.23 -34.85 79.33 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.544 -0.723 . . . . 0.0 110.478 179.727 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.0 m -56.08 -47.66 77.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.459 -0.775 . . . . 0.0 109.41 179.377 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -70.77 -39.39 73.24 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.725 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.45 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 15.1 mt -57.53 -45.95 84.41 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.562 -0.711 . . . . 0.0 109.847 179.582 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.7 t90 -73.9 -48.14 32.98 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.629 -0.669 . . . . 0.0 109.768 179.335 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -56.74 -40.24 75.4 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.408 -0.808 . . . . 0.0 110.385 -179.817 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.63 -38.05 86.25 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.487 -0.758 . . . . 0.0 110.384 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.409 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -65.37 -47.97 74.56 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.357 -0.84 . . . . 0.0 109.213 179.463 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 3.1 mt-10 -69.52 -31.25 69.37 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.535 -0.728 . . . . 0.0 109.848 179.158 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -55.35 -49.53 72.0 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.424 -0.797 . . . . 0.0 108.866 178.601 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.593 ' CD1' HG21 ' A' ' 20' ' ' VAL . 14.3 t90 -70.1 -42.35 72.82 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.576 -0.702 . . . . 0.0 109.236 178.59 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -54.22 -31.8 54.18 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.624 -0.672 . . . . 0.0 110.874 179.728 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.418 ' HB3' ' CD1' ' A' ' 22' ' ' LEU . 24.1 m95 -102.91 -43.22 5.59 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.363 -0.835 . . . . 0.0 110.972 -179.601 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -57.51 -37.78 73.56 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.247 -0.908 . . . . 0.0 111.098 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.593 HG21 ' CD1' ' A' ' 16' ' ' TRP . 89.8 t -65.88 -32.86 60.04 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.238 -0.914 . . . . 0.0 110.316 179.907 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.9 m -93.68 -22.58 18.66 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.534 -0.729 . . . . 0.0 111.029 -179.81 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.418 ' CD1' ' HB3' ' A' ' 18' ' ' TRP . 78.2 mt -95.78 -2.56 47.42 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.255 -0.903 . . . . 0.0 111.309 -179.629 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.451 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -51.88 -52.0 65.44 Favored Pre-proline 0 N--CA 1.501 2.102 0 O-C-N 121.362 -0.836 . . . . 0.0 111.302 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 47.0 Cg_endo -74.49 82.02 1.96 Allowed 'Trans proline' 0 N--CA 1.486 1.032 0 O-C-N 123.555 1.292 . . . . 0.0 110.51 179.924 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -147.11 75.52 1.38 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.343 -0.848 . . . . 0.0 110.124 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.503 2.215 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 19.7 ttp180 . . . . . 0 N--CA 1.495 1.798 0 CA-C-O 121.246 0.546 . . . . 0.0 110.104 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m -145.34 158.97 43.72 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.351 -0.843 . . . . 0.0 110.492 -179.805 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.43 -34.21 10.37 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.5 -0.75 . . . . 0.0 110.328 179.554 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 tp -88.62 8.76 26.84 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.399 -0.813 . . . . 0.0 111.231 179.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 63.3 t -98.15 -46.16 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.061 -1.025 . . . . 0.0 110.149 179.739 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -63.44 -41.27 98.67 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.417 -0.802 . . . . 0.0 110.633 179.842 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.6 t -57.98 -42.96 86.19 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.357 -0.839 . . . . 0.0 109.602 179.524 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -71.92 -39.52 69.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.372 -0.83 . . . . 0.0 109.495 178.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -70.77 -23.01 62.33 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.406 -0.809 . . . . 0.0 110.99 179.835 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -103.88 -53.69 2.71 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.357 -0.839 . . . . 0.0 110.863 -179.405 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -62.44 -49.24 76.23 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.098 -1.001 . . . . 0.0 110.889 -179.508 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -38.53 87.16 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.285 -0.884 . . . . 0.0 110.215 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.486 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -63.45 -43.93 95.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.451 -0.781 . . . . 0.0 109.504 179.48 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.475 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 48.7 mt-10 -69.29 -45.06 70.54 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.354 -0.841 . . . . 0.0 109.968 179.535 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.85 -42.56 65.32 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.384 -0.823 . . . . 0.0 109.586 179.163 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -72.66 -43.86 62.6 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.433 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.486 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 81.8 t80 -56.04 -53.81 52.49 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.72 -0.612 . . . . 0.0 109.62 179.473 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -59.28 -32.56 70.14 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.576 -0.703 . . . . 0.0 109.831 179.189 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -61.31 -35.38 77.19 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.59 -0.693 . . . . 0.0 110.769 179.435 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.7 m -111.03 7.9 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.255 -0.903 . . . . 0.0 111.519 -179.991 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 97.7 m -119.04 -31.6 4.69 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.977 -1.077 . . . . 0.0 111.087 -179.857 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.4 mt -61.17 -38.29 85.94 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.315 -0.866 . . . . 0.0 110.988 -179.806 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.425 ' CB ' ' CD ' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -70.71 -58.61 4.32 Favored Pre-proline 0 N--CA 1.499 1.975 0 O-C-N 121.488 -0.757 . . . . 0.0 111.043 -179.581 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 23' ' ' ARG . 48.4 Cg_endo -74.18 100.91 1.35 Allowed 'Trans proline' 0 N--CA 1.487 1.133 0 O-C-N 123.48 1.253 . . . . 0.0 110.738 -179.807 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -133.98 112.06 10.92 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.447 -0.783 . . . . 0.0 109.893 179.764 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.872 0 CA-C-O 117.823 -1.084 . . . . 0.0 110.824 -179.743 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 . . . . . 0 N--CA 1.495 1.785 0 CA-C-O 121.003 0.43 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.3 m -121.77 164.49 17.34 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.586 -0.696 . . . . 0.0 110.422 179.876 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.49 -40.87 9.25 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.53 -0.731 . . . . 0.0 110.413 179.784 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.93 14.57 7.09 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.407 -0.808 . . . . 0.0 111.147 179.928 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.2 t -104.46 -54.03 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.011 -1.056 . . . . 0.0 109.793 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -72.92 -37.91 67.02 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.5 -0.75 . . . . 0.0 110.665 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.8 t -52.69 -43.59 65.69 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.142 -0.974 . . . . 0.0 110.168 -179.974 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.477 ' CZ ' ' HG3' ' A' ' 12' ' ' ARG . 33.9 t80 -79.86 -39.07 31.38 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.457 -0.777 . . . . 0.0 110.075 179.423 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.53 -35.87 78.05 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.583 -0.698 . . . . 0.0 111.186 -179.525 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -58.76 -54.56 45.68 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.267 -0.896 . . . . 0.0 110.44 -179.665 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.69 -38.39 86.69 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.39 -0.819 . . . . 0.0 110.322 179.728 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.477 ' HG3' ' CZ ' ' A' ' 8' ' ' TYR . 13.4 mmm180 -65.54 -8.73 21.24 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.198 -0.939 . . . . 0.0 111.198 179.692 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -101.81 -47.36 4.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.223 -0.923 . . . . 0.0 109.981 179.637 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -88.37 -45.86 9.65 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.919 -0.488 . . . . 0.0 110.864 -178.774 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -39.66 95.3 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.264 -0.898 . . . . 0.0 109.972 179.826 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -72.21 -47.71 48.5 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.427 -0.796 . . . . 0.0 109.668 179.178 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.419 ' O ' HG23 ' A' ' 20' ' ' VAL . 82.6 t80 -57.37 -51.71 68.29 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.68 -0.638 . . . . 0.0 110.166 -179.815 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.412 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 8.6 m95 -65.8 -33.46 75.9 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.312 -0.867 . . . . 0.0 110.465 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -60.49 -57.05 14.37 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.172 -0.955 . . . . 0.0 110.611 179.966 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 17' ' ' PHE . 27.3 m -67.54 -22.79 29.0 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.287 -0.883 . . . . 0.0 111.252 -179.57 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 86.7 m -87.89 -31.06 19.67 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.086 -1.009 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.1 mt -81.64 -69.19 0.63 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.275 -0.891 . . . . 0.0 110.214 -179.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.33 83.54 0.74 Allowed Pre-proline 0 N--CA 1.498 1.928 0 O-C-N 121.599 -0.688 . . . . 0.0 110.15 -179.759 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.408 ' HG3' ' HA ' ' A' ' 20' ' ' VAL . 49.3 Cg_endo -74.94 179.38 6.12 Favored 'Trans proline' 0 C--N 1.314 -1.258 0 O-C-N 123.872 1.459 . . . . 0.0 110.822 -179.985 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.503 ' O ' ' HB2' ' A' ' 26' ' ' ARG . 1.3 mt-10 -66.32 -37.98 86.62 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.469 -0.769 . . . . 0.0 110.162 179.627 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.503 ' HB2' ' O ' ' A' ' 25' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.504 2.227 0 CA-C-O 117.587 -1.197 . . . . 0.0 110.679 179.972 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 . . . . . 0 N--CA 1.497 1.922 0 CA-C-O 121.073 0.463 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.0 t -129.25 165.39 21.48 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.07 -1.019 . . . . 0.0 110.458 179.844 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -97.69 -45.29 6.42 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.505 -0.747 . . . . 0.0 110.41 -179.951 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 pp -57.36 -25.26 59.17 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.549 -0.72 . . . . 0.0 111.258 -179.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.4 t -65.93 -50.15 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.291 -0.881 . . . . 0.0 109.551 179.396 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -66.02 -36.64 83.81 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.515 -0.741 . . . . 0.0 110.021 179.46 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 71.7 m -54.38 -54.91 34.24 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.442 -0.786 . . . . 0.0 109.67 179.546 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -61.61 -44.25 97.34 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.655 -0.653 . . . . 0.0 109.437 178.915 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.6 mt -57.05 -41.12 78.12 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.628 -0.67 . . . . 0.0 110.308 179.69 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.407 ' HA ' ' HD1' ' A' ' 13' ' ' TRP . 28.5 t90 -68.47 -39.33 81.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.472 -0.768 . . . . 0.0 109.988 179.395 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -64.33 -36.63 84.76 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.383 -0.823 . . . . 0.0 110.824 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -39.8 61.06 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.297 -0.877 . . . . 0.0 110.658 -179.807 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.431 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -60.05 -45.5 92.65 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.32 -0.862 . . . . 0.0 110.02 179.952 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.431 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 3.0 mt-10 -65.16 -42.94 93.27 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.308 -0.87 . . . . 0.0 110.264 179.836 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.06 -36.19 70.24 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.513 -0.742 . . . . 0.0 110.174 179.483 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -71.33 -47.07 58.83 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.448 -0.782 . . . . 0.0 109.298 179.272 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -55.89 -53.12 60.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.629 -0.669 . . . . 0.0 110.051 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.417 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 6.1 m95 -59.86 -31.08 69.43 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.352 -0.843 . . . . 0.0 110.697 179.604 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -31.69 72.33 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.352 -0.843 . . . . 0.0 111.283 179.945 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.2 m -106.28 -25.28 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.072 -1.017 . . . . 0.0 111.387 -179.665 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.8 m -82.11 -35.61 28.4 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.131 -0.981 . . . . 0.0 111.29 -179.278 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.68 -17.02 58.1 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.307 -0.871 . . . . 0.0 111.562 -179.533 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.1 ttm-85 57.26 64.53 4.24 Favored Pre-proline 0 N--CA 1.501 2.083 0 O-C-N 121.511 -0.743 . . . . 0.0 110.606 -179.786 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -74.31 65.13 5.41 Favored 'Trans proline' 0 C--N 1.316 -1.142 0 O-C-N 123.831 1.437 . . . . 0.0 110.542 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -158.76 -60.08 0.07 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.294 -0.879 . . . . 0.0 110.29 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.5 mtm105 . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 118.066 -0.968 . . . . 0.0 110.202 -179.828 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 121.06 0.457 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -142.94 134.37 26.25 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.413 -0.804 . . . . 0.0 110.273 179.95 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.54 8.78 19.37 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.624 -0.672 . . . . 0.0 111.136 179.822 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -121.23 4.63 10.3 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.035 -1.041 . . . . 0.0 111.392 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.5 t -90.33 -54.85 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.117 -0.99 . . . . 0.0 110.154 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -66.1 -38.84 89.24 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.451 -0.781 . . . . 0.0 110.737 -179.915 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.7 t -50.61 -49.76 55.78 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.232 -0.917 . . . . 0.0 110.22 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -71.84 -46.52 57.74 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.475 -0.766 . . . . 0.0 110.024 179.497 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -57.75 -41.82 82.67 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.458 -0.776 . . . . 0.0 110.202 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.531 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -75.0 -34.76 61.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.529 -0.732 . . . . 0.0 109.72 179.342 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -64.53 -39.36 93.62 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.529 -0.732 . . . . 0.0 110.32 179.544 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.58 -26.57 22.2 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.314 -0.866 . . . . 0.0 110.332 179.278 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.54 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -86.89 -43.59 12.31 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.564 -0.71 . . . . 0.0 110.806 179.923 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -83.62 -38.69 21.25 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.381 -0.824 . . . . 0.0 111.496 -178.507 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -50.04 -43.72 51.12 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.26 -0.9 . . . . 0.0 109.763 179.551 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.407 ' CD1' HG21 ' A' ' 20' ' ' VAL . 18.5 t90 -73.22 -44.05 60.25 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.561 -0.712 . . . . 0.0 109.086 178.622 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -55.43 -44.92 76.72 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.462 -0.774 . . . . 0.0 109.987 179.525 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -71.77 -51.01 24.84 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.42 -0.8 . . . . 0.0 110.553 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.07 -21.61 65.09 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.16 -0.962 . . . . 0.0 111.803 -179.795 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.407 HG21 ' CD1' ' A' ' 16' ' ' TRP . 99.3 t -102.09 -31.64 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 120.961 -1.087 . . . . 0.0 111.288 -179.21 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.6 m -88.59 -34.06 17.45 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.977 -1.077 . . . . 0.0 111.28 -179.446 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.9 mt -71.35 -28.64 64.2 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.175 -0.953 . . . . 0.0 110.841 -179.743 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.453 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 9.3 mtt-85 -56.06 -58.88 13.74 Favored Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 121.481 -0.762 . . . . 0.0 110.913 -179.779 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.453 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 51.3 Cg_endo -76.13 54.58 4.23 Favored 'Trans proline' 0 N--CA 1.489 1.222 0 O-C-N 123.422 1.222 . . . . 0.0 110.408 179.53 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -170.55 -47.89 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.408 -0.807 . . . . 0.0 109.818 -179.969 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 ttm180 . . . . . 0 N--CA 1.494 1.757 0 CA-C-O 117.829 -1.082 . . . . 0.0 110.363 179.904 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.766 0 CA-C-O 121.087 0.47 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.35 -175.25 0.11 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.552 -0.718 . . . . 0.0 110.947 179.99 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.25 -45.33 0.17 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.486 -0.759 . . . . 0.0 110.705 -179.729 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.69 -31.95 41.35 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.376 -0.828 . . . . 0.0 110.716 179.95 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 91.9 t -65.63 -51.57 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.503 -0.748 . . . . 0.0 110.142 -179.993 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.59 -39.44 94.4 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.579 -0.701 . . . . 0.0 110.433 179.861 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.0 t -58.56 -47.71 83.33 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.292 -0.88 . . . . 0.0 109.69 179.363 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -66.79 -41.68 87.22 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.468 -0.77 . . . . 0.0 109.451 179.011 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.9 -40.27 97.04 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.678 -0.639 . . . . 0.0 110.038 179.499 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 28.0 t90 -61.57 -44.63 96.67 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.65 -0.656 . . . . 0.0 110.264 179.695 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -34.66 78.73 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.406 -0.809 . . . . 0.0 110.501 179.863 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -37.96 77.93 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.364 -0.835 . . . . 0.0 110.4 179.707 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.462 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -60.03 -47.22 86.77 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.448 -0.783 . . . . 0.0 109.675 179.985 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.445 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 28.4 mt-10 -69.01 -38.54 79.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.264 -0.897 . . . . 0.0 109.872 179.314 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.48 -49.26 78.47 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.574 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.4 ' O ' HG23 ' A' ' 20' ' ' VAL . 12.6 t90 -67.11 -42.04 85.22 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.821 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.462 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 69.3 t80 -55.07 -58.06 9.2 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.599 -0.688 . . . . 0.0 109.684 179.687 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -62.93 -34.71 78.03 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.439 -0.788 . . . . 0.0 110.177 179.484 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -53.92 -36.72 63.07 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.5 -0.75 . . . . 0.0 110.602 179.396 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 16' ' ' TRP . 32.6 m -104.42 -23.74 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 121.282 -0.886 . . . . 0.0 110.975 179.839 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 58.0 m -78.09 -27.92 48.58 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.152 -0.968 . . . . 0.0 111.016 -179.874 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.8 mt -74.47 -12.45 60.5 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.381 -0.824 . . . . 0.0 111.081 -179.941 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.2 mtt180 57.65 78.8 0.35 Allowed Pre-proline 0 N--CA 1.501 2.103 0 O-C-N 121.674 -0.641 . . . . 0.0 110.734 179.967 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -76.03 63.66 6.86 Favored 'Trans proline' 0 C--N 1.315 -1.214 0 O-C-N 123.828 1.436 . . . . 0.0 110.395 179.654 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -140.09 141.95 36.13 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.451 -0.781 . . . . 0.0 110.273 -179.899 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.868 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.463 -179.835 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 . . . . . 0 N--CA 1.495 1.778 0 CA-C-O 121.173 0.511 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.471 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 59.3 m -91.93 132.74 36.27 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.383 -0.823 . . . . 0.0 110.114 179.92 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.46 -42.52 3.65 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.516 -0.74 . . . . 0.0 110.645 -179.874 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 mp -105.93 -22.42 12.91 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.445 -0.784 . . . . 0.0 111.065 -179.704 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.471 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 94.7 t -60.75 -52.98 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.403 -0.811 . . . . 0.0 110.313 -179.542 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.34 -32.85 74.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.497 -0.752 . . . . 0.0 110.378 179.741 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.6 m -57.69 -44.96 86.22 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.345 -0.847 . . . . 0.0 109.647 179.425 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -70.01 -39.88 75.56 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.513 -0.742 . . . . 0.0 109.216 178.648 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.3 mt -61.68 -49.83 74.93 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.745 -0.597 . . . . 0.0 109.948 179.458 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -64.49 -36.74 85.17 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.569 -0.707 . . . . 0.0 109.645 179.221 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -60.08 -44.0 95.08 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.446 -0.784 . . . . 0.0 110.19 179.441 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 ttp85 -53.57 -36.26 61.71 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.615 -0.678 . . . . 0.0 110.689 179.688 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.436 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -61.44 -59.45 5.24 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.564 -0.71 . . . . 0.0 110.227 179.97 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.487 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 8.9 mt-10 -72.87 -30.97 64.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.681 -0.637 . . . . 0.0 110.942 -179.545 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -50.57 -48.66 57.46 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.378 -0.826 . . . . 0.0 109.864 179.676 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.511 ' CD1' HG21 ' A' ' 20' ' ' VAL . 6.2 t90 -72.5 -42.12 65.2 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.528 -0.732 . . . . 0.0 109.302 178.903 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.487 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 15.9 t80 -57.72 -45.27 86.01 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.593 -0.692 . . . . 0.0 110.459 179.962 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.405 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 10.6 m95 -63.44 -57.62 9.69 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.276 -0.89 . . . . 0.0 110.895 -179.534 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.04 -27.13 68.11 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.043 -1.036 . . . . 0.0 111.716 -179.544 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.511 HG21 ' CD1' ' A' ' 16' ' ' TRP . 71.3 t -91.27 -24.88 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.062 -1.024 . . . . 0.0 111.324 -179.392 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.6 m -101.12 -38.02 8.32 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.085 -1.009 . . . . 0.0 111.338 -179.395 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 18' ' ' TRP . 77.3 mt -63.44 -33.79 76.33 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.251 -0.906 . . . . 0.0 110.96 -179.571 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.5 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 3.7 mmm180 -60.76 -60.47 10.54 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 121.424 -0.798 . . . . 0.0 110.331 179.99 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.5 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 51.7 Cg_endo -77.35 72.36 5.99 Favored 'Trans proline' 0 N--CA 1.487 1.089 0 O-C-N 123.565 1.297 . . . . 0.0 110.223 179.169 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.39 100.43 12.2 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.325 -0.86 . . . . 0.0 110.126 -179.887 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.073 0 CA-C-O 117.886 -1.054 . . . . 0.0 110.668 -179.843 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.444 ' HG2' ' HB2' ' A' ' 6' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.864 0 CA-C-O 120.898 0.38 . . . . 0.0 110.182 . . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.474 ' O ' ' CB ' ' A' ' 3' ' ' ALA . 7.5 t -86.39 9.26 18.59 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.213 -0.929 . . . . 0.0 111.534 -179.659 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.474 ' CB ' ' O ' ' A' ' 2' ' ' SER . . . 75.46 -39.21 0.39 Allowed 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.526 -0.734 . . . . 0.0 111.736 179.912 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -108.29 14.98 24.46 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.017 -1.052 . . . . 0.0 111.402 -179.754 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 98.3 t -112.59 -42.77 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.122 -0.986 . . . . 0.0 110.528 179.75 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.506 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 59.9 t30 -83.57 -20.99 32.79 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.207 -0.933 . . . . 0.0 111.355 -179.862 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.4 t -52.19 -52.45 52.04 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.102 -0.999 . . . . 0.0 109.929 179.96 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -70.61 -40.88 72.93 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.465 -0.772 . . . . 0.0 109.748 179.121 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.506 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 29.7 mt -60.03 -36.52 77.45 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.63 -0.669 . . . . 0.0 110.403 179.691 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -72.4 -40.1 67.46 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.418 -0.801 . . . . 0.0 110.024 179.485 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.447 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 5.8 mm-40 -61.44 -40.23 93.7 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.464 -0.773 . . . . 0.0 110.471 179.916 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.96 -38.81 65.36 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.568 -0.708 . . . . 0.0 110.321 179.54 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.478 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -58.92 -61.92 2.27 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.697 -0.627 . . . . 0.0 110.303 179.704 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -66.02 -33.84 76.72 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.546 -0.721 . . . . 0.0 110.661 -179.707 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.447 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -51.95 -46.05 64.61 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.471 -0.768 . . . . 0.0 109.193 178.903 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 18.1 t90 -70.99 -43.22 68.47 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.518 -0.739 . . . . 0.0 109.407 178.817 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -58.02 -52.02 67.27 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.635 -0.666 . . . . 0.0 109.916 179.818 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.432 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 7.8 m95 -64.21 -33.98 77.05 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.425 -0.797 . . . . 0.0 110.202 179.426 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -68.2 -41.95 80.62 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.363 -0.836 . . . . 0.0 111.063 179.837 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.4 m -89.4 -25.02 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.187 -0.945 . . . . 0.0 111.438 -179.527 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.6 m -84.72 -51.74 6.58 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.106 -0.996 . . . . 0.0 110.653 -179.718 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.0 mt -70.62 -63.4 1.1 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.415 -0.803 . . . . 0.0 109.749 179.904 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.506 ' HD2' ' HG3' ' A' ' 26' ' ' ARG . 1.9 mtm-85 49.1 75.37 0.67 Allowed Pre-proline 0 N--CA 1.5 2.072 0 O-C-N 121.816 -0.552 . . . . 0.0 111.251 179.362 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -77.86 53.21 4.31 Favored 'Trans proline' 0 C--N 1.313 -1.319 0 O-C-N 123.672 1.354 . . . . 0.0 110.483 179.535 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -169.76 -52.33 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.404 -0.81 . . . . 0.0 110.217 -179.75 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.506 ' HG3' ' HD2' ' A' ' 23' ' ' ARG . 1.5 ptt-85 . . . . . 0 N--CA 1.498 1.929 0 CA-C-O 118.374 -0.822 . . . . 0.0 110.524 179.999 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.9 ttt-85 . . . . . 0 N--CA 1.495 1.802 0 CA-C-O 121.117 0.484 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 t -99.18 -1.35 39.53 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.427 -0.796 . . . . 0.0 111.188 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.64 10.03 1.3 Allowed 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.466 -0.771 . . . . 0.0 111.59 -179.469 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.6 mt -132.52 3.79 3.91 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.976 -1.077 . . . . 0.0 111.079 179.893 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 37.4 t -98.17 -53.09 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.187 -0.945 . . . . 0.0 109.569 179.74 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -62.16 -41.53 98.39 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.744 -0.597 . . . . 0.0 110.451 179.695 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.7 p -57.43 -50.74 72.03 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.39 -0.819 . . . . 0.0 109.672 179.601 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -62.73 -44.86 95.12 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.651 -0.656 . . . . 0.0 109.437 179.0 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.39 -45.57 92.54 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.816 -0.553 . . . . 0.0 110.334 179.732 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.0 t90 -61.94 -49.36 76.44 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.522 -0.736 . . . . 0.0 109.916 179.589 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 50.0 tp60 -55.09 -35.98 65.17 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.447 -0.783 . . . . 0.0 110.297 179.918 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.38 -36.82 77.18 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.423 -0.798 . . . . 0.0 110.457 179.729 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.434 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -60.45 -45.91 91.96 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.476 -0.765 . . . . 0.0 109.333 179.564 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.434 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 5.2 mt-10 -73.32 -35.42 66.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.339 -0.851 . . . . 0.0 109.675 178.959 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -51.98 -46.58 64.89 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.393 -0.817 . . . . 0.0 109.921 179.365 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -68.47 -47.29 67.5 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.506 -0.747 . . . . 0.0 109.27 179.244 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -55.09 -42.35 72.74 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.692 -0.63 . . . . 0.0 109.815 179.596 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.501 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -77.65 -27.81 51.06 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.674 -0.641 . . . . 0.0 110.315 179.612 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 14.4 t-20 -65.0 -43.7 91.66 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.408 -0.807 . . . . 0.0 110.947 -179.806 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 m -80.09 -17.32 12.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.268 -0.895 . . . . 0.0 111.705 -179.461 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.5 p -95.93 -55.79 2.87 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.971 -1.081 . . . . 0.0 110.524 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.501 HD12 ' HB3' ' A' ' 18' ' ' TRP . 6.8 mt -76.92 -28.73 55.39 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.59 -0.694 . . . . 0.0 110.805 -179.902 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 59.72 87.77 0.13 Allowed Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.679 -0.638 . . . . 0.0 110.508 -179.979 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.33 169.48 19.54 Favored 'Trans proline' 0 C--N 1.314 -1.266 0 O-C-N 123.705 1.371 . . . . 0.0 111.158 -179.822 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -102.07 -52.07 3.24 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.638 -0.664 . . . . 0.0 110.497 -179.614 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.92 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.449 -179.951 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 121.311 0.577 . . . . 0.0 110.066 . . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.558 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 1.1 m -80.19 141.34 35.75 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.342 -0.849 . . . . 0.0 110.434 -179.864 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.86 -37.53 5.38 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.544 -0.723 . . . . 0.0 110.886 -179.874 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 mp -111.06 15.72 21.51 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.269 -0.894 . . . . 0.0 111.15 -179.693 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.558 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 75.0 t -107.95 -54.18 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.14 -0.975 . . . . 0.0 109.526 179.434 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.79 -41.85 64.55 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.578 -0.701 . . . . 0.0 109.872 179.33 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.4 m -57.98 -43.72 86.68 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.318 -0.864 . . . . 0.0 109.312 179.061 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -67.2 -38.48 85.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.789 -0.569 . . . . 0.0 109.614 178.936 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.01 -41.25 78.01 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.579 -0.701 . . . . 0.0 110.333 179.715 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -75.67 -43.32 48.08 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.504 -0.748 . . . . 0.0 110.317 179.928 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.03 -57.0 13.96 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.306 -0.871 . . . . 0.0 110.614 -179.564 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.7 -37.89 43.89 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.557 -0.715 . . . . 0.0 110.991 -179.783 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.525 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -57.12 -60.0 4.25 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.658 -0.651 . . . . 0.0 110.482 179.85 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -76.01 -35.97 59.33 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.636 -0.665 . . . . 0.0 110.887 -179.476 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -51.91 -49.21 63.51 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.506 -0.746 . . . . 0.0 109.552 179.565 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -67.2 -45.92 75.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.56 -0.712 . . . . 0.0 109.341 178.944 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -54.94 -52.5 62.82 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.672 -0.642 . . . . 0.0 109.892 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -65.14 -39.75 93.44 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.304 -0.872 . . . . 0.0 110.008 179.566 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -66.48 -29.24 69.31 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.459 -0.776 . . . . 0.0 111.336 179.791 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.2 p -101.61 -7.83 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.99 0 O-C-N 121.123 -0.985 . . . . 0.0 111.532 -179.407 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.7 m -109.0 -30.48 8.06 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.958 -1.089 . . . . 0.0 111.174 -179.718 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.0 mt -75.14 -35.79 61.63 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.298 -0.876 . . . . 0.0 110.774 -179.995 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.444 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -58.57 -55.17 48.69 Favored Pre-proline 0 N--CA 1.499 1.988 0 O-C-N 121.509 -0.744 . . . . 0.0 110.692 179.962 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.444 ' HD3' ' HB3' ' A' ' 23' ' ' ARG . 50.5 Cg_endo -74.24 -170.05 0.67 Allowed 'Trans proline' 0 N--CA 1.487 1.143 0 O-C-N 123.527 1.278 . . . . 0.0 110.598 179.591 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.59 -157.14 0.34 Allowed 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.624 -0.673 . . . . 0.0 110.59 179.983 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.935 0 CA-C-O 118.173 -0.918 . . . . 0.0 110.689 -179.947 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 121.135 0.493 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.48 -175.81 3.35 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.526 -0.734 . . . . 0.0 110.118 179.985 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.52 -45.6 93.23 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.536 -0.728 . . . . 0.0 110.834 179.928 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.53 9.86 31.41 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.434 -0.791 . . . . 0.0 111.064 179.897 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 69.4 t -102.76 -40.96 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.119 -0.988 . . . . 0.0 110.361 179.931 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -84.45 -35.01 23.33 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.257 -0.902 . . . . 0.0 110.315 179.814 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -51.11 70.88 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.451 -0.781 . . . . 0.0 109.656 179.524 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -63.68 -40.26 96.36 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.638 -0.664 . . . . 0.0 109.364 178.824 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.9 mt -58.1 -41.81 84.33 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.59 -0.694 . . . . 0.0 110.205 179.561 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 33.3 t90 -65.6 -45.88 81.5 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.471 -0.768 . . . . 0.0 109.819 179.231 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -60.42 -35.53 76.02 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.353 -0.842 . . . . 0.0 110.218 179.9 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -40.13 88.14 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.544 -0.722 . . . . 0.0 110.1 179.305 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -46.35 88.16 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.546 -0.721 . . . . 0.0 109.438 179.501 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -74.18 -41.05 62.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.28 -0.887 . . . . 0.0 109.528 179.024 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -54.06 -47.74 71.33 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.634 -0.666 . . . . 0.0 109.38 179.06 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -62.39 -47.76 82.7 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.531 -0.731 . . . . 0.0 109.282 179.004 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -58.1 -51.37 69.99 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.657 -0.652 . . . . 0.0 110.149 179.704 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.508 ' HE3' ' CD1' ' A' ' 22' ' ' LEU . 35.6 m95 -64.83 -16.31 62.95 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.463 -0.773 . . . . 0.0 110.73 179.472 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -92.91 -28.38 16.51 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.967 -1.083 . . . . 0.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 19.8 m -106.2 0.21 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.112 0 O-C-N 121.097 -1.002 . . . . 0.0 111.737 -179.731 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 86.6 m -110.29 -16.72 13.67 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.917 -1.114 . . . . 0.0 111.179 -179.804 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.508 ' CD1' ' HE3' ' A' ' 18' ' ' TRP . 6.8 mp -95.38 -35.79 11.61 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.199 -0.938 . . . . 0.0 110.143 -179.889 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 mmt85 -130.26 65.9 76.79 Favored Pre-proline 0 N--CA 1.496 1.835 0 O-C-N 121.495 -0.753 . . . . 0.0 110.148 179.502 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -79.17 67.56 8.55 Favored 'Trans proline' 0 C--N 1.316 -1.158 0 O-C-N 123.674 1.355 . . . . 0.0 110.584 -179.933 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 50.33 59.51 4.51 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.519 -0.738 . . . . 0.0 110.663 -179.897 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 118.336 -0.84 . . . . 0.0 110.35 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 . . . . . 0 N--CA 1.499 1.992 0 CA-C-O 120.711 0.291 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -59.67 -45.68 91.34 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.41 -0.806 . . . . 0.0 109.498 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -65.44 -41.82 93.05 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.567 -0.708 . . . . 0.0 109.192 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.12 -46.45 88.99 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.638 -0.664 . . . . 0.0 109.718 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -67.06 -46.05 75.51 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.607 -0.683 . . . . 0.0 109.618 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -54.61 -39.14 67.58 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.503 -0.748 . . . . 0.0 110.142 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -66.68 -38.59 87.13 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.573 -0.704 . . . . 0.0 110.466 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -44.78 96.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.344 -0.847 . . . . 0.0 109.698 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -72.95 -39.05 66.52 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.288 -0.883 . . . . 0.0 109.693 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.9 -46.89 71.55 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.525 -0.734 . . . . 0.0 109.659 179.216 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -67.09 -45.23 77.89 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.539 -0.726 . . . . 0.0 109.123 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -56.06 -48.45 76.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.726 -0.609 . . . . 0.0 109.488 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -66.18 -39.65 89.87 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.478 -0.764 . . . . 0.0 110.035 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.13 -44.01 67.4 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.455 -0.778 . . . . 0.0 110.786 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.8 m -87.36 -26.74 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 121.311 -0.868 . . . . 0.0 111.048 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.1 m -77.34 -35.48 54.64 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.105 -0.997 . . . . 0.0 110.426 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.3 mt . . . . . 0 N--CA 1.495 1.809 0 O-C-N 121.472 -0.768 . . . . 0.0 109.928 179.887 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.496 1.845 0 CA-C-O 120.722 0.296 . . . . 0.0 110.32 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -55.98 -45.34 79.01 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.474 -0.766 . . . . 0.0 109.676 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -37.02 62.96 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.669 -0.645 . . . . 0.0 109.518 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.8 mt -65.74 -43.85 87.73 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.422 -0.799 . . . . 0.0 109.942 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.416 ' CE3' ' HG2' ' A' ' 11' ' ' GLN . 15.4 t90 -69.06 -39.53 79.06 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.477 -0.764 . . . . 0.0 109.82 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.416 ' HG2' ' CE3' ' A' ' 10' ' ' TRP . 2.4 mm100 -58.15 -42.93 86.99 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.386 -0.821 . . . . 0.0 110.071 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.23 -22.04 16.47 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.438 -0.789 . . . . 0.0 110.971 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.558 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -86.73 -57.33 3.02 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.295 -0.878 . . . . 0.0 110.721 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -81.39 -43.74 18.55 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.502 -0.749 . . . . 0.0 111.971 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.06 -38.82 62.8 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.174 -0.954 . . . . 0.0 110.291 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.512 ' O ' HG22 ' A' ' 20' ' ' VAL . 10.3 t90 -70.45 -49.54 47.55 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.483 -0.76 . . . . 0.0 109.206 179.031 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -57.77 -45.96 85.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.689 -0.632 . . . . 0.0 109.919 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.482 ' HB3' HD12 ' A' ' 22' ' ' LEU . 3.7 m95 -65.12 -37.12 86.45 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.431 -0.793 . . . . 0.0 110.187 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -42.56 94.58 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.233 -0.917 . . . . 0.0 110.637 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 16' ' ' TRP . 33.5 m -87.23 -6.03 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.126 -0.984 . . . . 0.0 111.516 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.6 m -107.95 -38.6 5.77 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.931 -1.106 . . . . 0.0 110.829 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.482 HD12 ' HB3' ' A' ' 18' ' ' TRP . 16.9 mt . . . . . 0 N--CA 1.499 1.991 0 O-C-N 121.356 -0.84 . . . . 0.0 111.332 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 . . . . . 0 N--CA 1.496 1.861 0 N-CA-C 110.468 -0.197 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.5 p -57.21 -48.09 79.66 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.433 -0.792 . . . . 0.0 109.675 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -65.22 -39.49 92.83 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.675 -0.641 . . . . 0.0 109.341 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 9' ' ' LEU . 1.1 mm? -65.38 -49.21 70.17 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.665 -0.647 . . . . 0.0 109.932 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.5 t90 -62.51 -45.7 91.78 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.703 -0.623 . . . . 0.0 110.132 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.36 -40.61 74.81 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.386 -0.821 . . . . 0.0 109.782 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -39.87 81.56 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.7 -0.625 . . . . 0.0 110.328 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.539 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -57.46 -60.08 4.19 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.728 -0.607 . . . . 0.0 110.417 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.505 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 13.1 mt-10 -71.73 -28.11 63.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.504 -0.747 . . . . 0.0 111.059 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -54.12 -50.71 66.26 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.347 -0.846 . . . . 0.0 109.53 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.503 ' O ' HG22 ' A' ' 20' ' ' VAL . 9.3 t90 -68.81 -41.59 78.45 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.366 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.505 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 34.2 t80 -57.43 -55.38 35.6 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.63 -0.669 . . . . 0.0 109.761 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -64.64 -35.27 80.49 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.431 -0.793 . . . . 0.0 110.059 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -56.02 -48.44 75.96 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.36 -0.838 . . . . 0.0 110.717 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 16' ' ' TRP . 30.6 m -87.06 -25.06 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 O-C-N 121.231 -0.918 . . . . 0.0 111.188 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.3 m -76.23 -39.67 53.96 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.2 -0.937 . . . . 0.0 110.334 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.4 mt . . . . . 0 N--CA 1.498 1.963 0 O-C-N 121.533 -0.73 . . . . 0.0 110.923 179.853 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.443 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 120.493 0.187 . . . . 0.0 110.828 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.5 p -52.6 -35.63 54.7 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.426 -0.796 . . . . 0.0 110.451 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.4 ' CD2' HD22 ' A' ' 9' ' ' LEU . 8.0 t80 -99.59 -32.36 11.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.558 -0.714 . . . . 0.0 109.862 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 1.3 mm? -69.25 -35.89 76.59 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.428 -0.795 . . . . 0.0 110.743 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 22.8 t90 -57.66 -48.48 79.38 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.497 -0.752 . . . . 0.0 110.404 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -47.89 82.2 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.482 -0.761 . . . . 0.0 110.033 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -37.54 84.56 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.471 -0.768 . . . . 0.0 110.045 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.457 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -58.69 -57.24 13.88 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 121.572 0.701 . . . . 0.0 109.992 179.504 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.406 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 14.2 mt-10 -71.5 -30.32 65.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.843 -0.535 . . . . 0.0 110.873 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -53.35 -49.16 67.71 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.315 -0.866 . . . . 0.0 109.531 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.42 ' O ' HG22 ' A' ' 20' ' ' VAL . 7.9 t90 -69.02 -43.87 73.87 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.553 -0.717 . . . . 0.0 109.202 178.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.406 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 90.3 t80 -57.6 -56.28 23.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.741 -0.599 . . . . 0.0 110.125 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.572 ' HB3' HD12 ' A' ' 22' ' ' LEU . 13.2 m95 -60.88 -34.77 75.13 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.469 -0.77 . . . . 0.0 110.049 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -60.71 -42.36 97.06 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.497 -0.752 . . . . 0.0 110.772 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 16' ' ' TRP . 28.2 m -94.69 -10.04 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.321 -0.862 . . . . 0.0 111.341 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.9 m -95.99 -38.56 10.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.09 -1.006 . . . . 0.0 110.513 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.572 HD12 ' HB3' ' A' ' 18' ' ' TRP . 46.8 mt . . . . . 0 N--CA 1.499 1.983 0 O-C-N 121.469 -0.769 . . . . 0.0 111.084 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.633 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 63.7 t30 . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 111.271 0.1 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -52.07 -51.29 58.58 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.179 -0.95 . . . . 0.0 109.961 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -73.68 -40.9 63.32 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.489 -0.757 . . . . 0.0 109.584 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.633 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 30.0 mt -59.06 -37.8 77.89 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.598 -0.689 . . . . 0.0 110.452 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -67.82 -48.99 64.67 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.498 -0.751 . . . . 0.0 110.16 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -64.11 -42.64 96.8 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.413 -0.804 . . . . 0.0 110.132 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -24.82 67.14 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.446 -0.784 . . . . 0.0 110.248 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.504 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -85.46 -54.5 4.53 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.437 -0.789 . . . . 0.0 110.146 179.826 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.673 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 8.1 mt-10 -69.83 -23.79 63.36 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.627 -0.671 . . . . 0.0 111.529 -179.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -52.26 -55.1 23.47 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.072 -1.018 . . . . 0.0 109.423 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -67.76 -41.28 83.55 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.566 -0.709 . . . . 0.0 109.461 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.673 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 29.9 t80 -56.21 -54.96 39.06 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.784 -0.573 . . . . 0.0 110.439 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.409 ' CD1' ' HB3' ' A' ' 14' ' ' GLU . 21.1 m95 -61.35 -41.06 96.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.372 -0.83 . . . . 0.0 110.478 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -53.92 -42.98 69.35 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.312 -0.868 . . . . 0.0 111.502 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.404 HG22 ' H ' ' A' ' 20' ' ' VAL . 33.4 m -89.79 -22.13 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.136 -0.977 . . . . 0.0 111.018 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 64.5 m -82.08 -26.65 33.46 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.112 -0.992 . . . . 0.0 110.444 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 71.1 mt . . . . . 0 N--CA 1.498 1.953 0 O-C-N 121.359 -0.838 . . . . 0.0 110.844 179.741 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 . . . . . 0 N--CA 1.497 1.876 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 t -56.73 -52.75 63.77 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.299 -0.876 . . . . 0.0 109.268 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -60.77 -44.02 97.29 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.657 -0.652 . . . . 0.0 109.283 178.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 9' ' ' LEU . 9.1 mt -59.03 -41.52 88.02 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.883 -0.511 . . . . 0.0 110.225 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 40.2 t90 -62.61 -48.43 79.44 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.479 -0.763 . . . . 0.0 110.226 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -58.16 -36.72 73.43 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.387 -0.821 . . . . 0.0 110.282 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -69.97 -37.94 75.94 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.424 -0.798 . . . . 0.0 110.123 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.511 ' CD1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -58.51 -41.72 86.07 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.546 -0.721 . . . . 0.0 109.326 179.577 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.511 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 45.5 mt-10 -67.24 -48.31 68.17 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.478 -0.764 . . . . 0.0 109.375 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -56.22 -49.21 74.76 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.816 -0.553 . . . . 0.0 109.612 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 8.8 t90 -62.37 -47.11 85.64 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.654 -0.654 . . . . 0.0 109.397 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -57.83 -51.39 69.8 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.7 -0.625 . . . . 0.0 109.827 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.465 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 3.7 m95 -63.52 -30.0 71.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.418 -0.801 . . . . 0.0 110.351 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -40.84 75.58 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.096 -1.003 . . . . 0.0 110.428 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 22.3 m -88.56 -26.97 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.229 -0.92 . . . . 0.0 110.773 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 90.5 m -84.31 -48.33 9.83 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.286 -0.884 . . . . 0.0 110.472 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.433 HD11 ' CE3' ' A' ' 18' ' ' TRP . 50.3 mt . . . . . 0 N--CA 1.497 1.901 0 O-C-N 121.397 -0.814 . . . . 0.0 109.998 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.501 2.081 0 CA-C-O 120.604 0.24 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.1 t -58.62 -46.32 87.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.306 -0.871 . . . . 0.0 109.611 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.492 ' CZ ' ' HD2' ' A' ' 12' ' ' ARG . 21.7 t80 -67.5 -43.84 79.91 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.569 -0.707 . . . . 0.0 109.305 178.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.67 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 1.4 mm? -60.86 -44.84 96.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.67 -0.644 . . . . 0.0 110.241 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.415 ' CE3' ' HG2' ' A' ' 11' ' ' GLN . 17.9 t90 -61.17 -40.69 94.83 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.635 -0.666 . . . . 0.0 110.079 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.474 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -57.0 -45.4 83.03 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.438 -0.789 . . . . 0.0 110.155 179.799 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.67 ' HD3' ' HA ' ' A' ' 9' ' ' LEU . 29.5 mtp85 -54.37 -41.83 69.62 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.754 -0.591 . . . . 0.0 110.409 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.485 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -54.37 -60.05 3.86 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.392 0.615 . . . . 0.0 110.051 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -68.51 -31.39 70.61 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.593 -0.692 . . . . 0.0 110.544 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -52.83 -43.83 66.28 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.448 -0.783 . . . . 0.0 109.579 179.197 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.512 ' O ' HG22 ' A' ' 20' ' ' VAL . 10.9 t90 -68.63 -47.09 67.51 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -57.28 -52.14 66.53 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.804 -0.56 . . . . 0.0 109.679 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.436 ' HE3' ' HA ' ' A' ' 18' ' ' TRP . 5.0 m95 -63.19 -33.3 75.18 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.33 -0.856 . . . . 0.0 110.151 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -64.12 -41.0 97.4 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.453 -0.78 . . . . 0.0 110.681 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 16' ' ' TRP . 35.7 m -93.83 -18.84 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.224 -0.922 . . . . 0.0 111.21 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.1 m -91.84 -53.35 4.32 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.002 -1.061 . . . . 0.0 109.925 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.3 mt . . . . . 0 N--CA 1.496 1.827 0 O-C-N 121.498 -0.751 . . . . 0.0 110.56 179.54 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 120.89 0.376 . . . . 0.0 110.047 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.3 m -57.6 -52.79 63.99 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.602 -0.686 . . . . 0.0 110.747 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.663 ' CZ ' HD13 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -66.11 -27.86 68.37 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.377 -0.827 . . . . 0.0 110.149 179.632 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.663 HD13 ' CZ ' ' A' ' 8' ' ' TYR . 3.0 tp -70.55 -41.44 72.48 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.513 -0.742 . . . . 0.0 109.575 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.5 t90 -60.53 -47.38 86.41 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.506 -0.746 . . . . 0.0 109.371 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -60.05 -37.05 78.68 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.454 -0.779 . . . . 0.0 109.901 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.6 mtp85 -63.09 -39.15 93.87 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.501 -0.749 . . . . 0.0 110.159 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.459 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -63.2 -46.73 85.66 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.608 -0.682 . . . . 0.0 109.495 179.513 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.451 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 4.3 mt-10 -70.19 -36.63 74.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.408 -0.807 . . . . 0.0 109.699 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.43 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.3 OUTLIER -57.36 -48.96 77.67 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 178.628 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.5 t90 -69.76 -41.63 74.92 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.615 -0.678 . . . . 0.0 109.194 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.459 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 57.8 t80 -55.15 -58.93 5.68 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.704 -0.622 . . . . 0.0 109.416 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 23.7 m95 -61.4 -33.2 73.28 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.511 -0.743 . . . . 0.0 110.111 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 2.2 t30 -54.4 -37.51 65.12 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.487 -0.758 . . . . 0.0 110.463 179.306 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -102.91 -27.52 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.49 -0.756 . . . . 0.0 110.782 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 99.9 m -73.2 -39.12 65.82 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.251 -0.906 . . . . 0.0 110.862 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.422 ' HA ' HD23 ' A' ' 22' ' ' LEU . 45.7 mt . . . . . 0 N--CA 1.501 2.104 0 O-C-N 121.511 -0.743 . . . . 0.0 110.929 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 . . . . . 0 N--CA 1.498 1.95 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.3 m -61.92 -44.41 96.83 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.319 -0.863 . . . . 0.0 109.728 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -60.79 -41.31 95.33 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.551 -0.718 . . . . 0.0 109.308 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.36 -39.41 71.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.699 -0.625 . . . . 0.0 109.996 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -64.63 -47.47 78.43 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.637 -0.665 . . . . 0.0 110.097 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -54.84 -40.42 69.6 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.369 -0.832 . . . . 0.0 110.363 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -41.59 87.08 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.561 -0.712 . . . . 0.0 110.341 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.409 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -59.55 -46.87 87.61 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.343 -0.848 . . . . 0.0 109.557 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 2.8 mt-10 -70.88 -37.77 73.06 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.343 -0.848 . . . . 0.0 110.038 179.316 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -46.84 72.01 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.544 -0.723 . . . . 0.0 109.546 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -64.35 -45.95 85.58 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.524 -0.735 . . . . 0.0 109.335 178.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.41 ' CZ ' HG21 ' A' ' 21' ' ' THR . 82.4 t80 -52.46 -47.49 66.44 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.781 -0.575 . . . . 0.0 109.664 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 22.2 m95 -63.14 -38.05 89.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.579 -0.701 . . . . 0.0 110.147 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -54.79 -35.43 63.85 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.223 -0.923 . . . . 0.0 110.94 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.4 m -106.72 -2.78 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.075 -1.015 . . . . 0.0 111.617 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.41 HG21 ' CZ ' ' A' ' 17' ' ' PHE . 82.2 m -113.37 -16.81 12.41 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.033 -1.042 . . . . 0.0 111.341 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.3 mt . . . . . 0 N--CA 1.501 2.117 0 O-C-N 121.2 -0.937 . . . . 0.0 110.645 -179.962 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 CA-C-O 120.631 0.253 . . . . 0.0 110.417 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.6 p -58.15 -53.15 61.47 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.452 -0.78 . . . . 0.0 109.421 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 32.1 t80 -65.39 -39.39 92.16 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 9' ' ' LEU . 12.5 mt -60.43 -34.82 74.51 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.712 -0.618 . . . . 0.0 109.851 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -73.55 -40.4 63.99 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.463 -0.773 . . . . 0.0 109.654 178.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.454 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.95 -36.21 78.77 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.556 -0.715 . . . . 0.0 109.945 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -55.29 -39.44 69.88 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.56 -0.713 . . . . 0.0 110.328 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.506 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -56.26 -61.03 2.67 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-O 121.387 0.613 . . . . 0.0 110.506 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.5 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 20.1 mt-10 -69.53 -30.44 68.27 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.578 -0.701 . . . . 0.0 110.823 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -52.38 -49.48 64.34 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.377 -0.827 . . . . 0.0 109.41 179.29 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.475 ' O ' HG22 ' A' ' 20' ' ' VAL . 15.8 t90 -69.2 -43.61 73.81 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.548 -0.72 . . . . 0.0 109.461 178.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.5 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 34.5 t80 -55.92 -55.36 33.52 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.658 -0.651 . . . . 0.0 109.578 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 40.1 m95 -63.05 -33.22 74.98 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.478 -0.764 . . . . 0.0 110.112 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 16.5 t-20 -59.02 -39.45 81.95 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.509 -0.744 . . . . 0.0 110.901 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.475 HG22 ' O ' ' A' ' 16' ' ' TRP . 28.2 m -101.63 2.65 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 O-C-N 121.246 -0.909 . . . . 0.0 111.257 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.6 m -106.2 -38.36 6.28 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.089 -1.007 . . . . 0.0 110.472 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 80.2 mt . . . . . 0 N--CA 1.497 1.918 0 O-C-N 121.464 -0.772 . . . . 0.0 110.386 -179.841 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.451 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.947 0 CA-C-O 120.57 0.224 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -50.71 -55.77 15.06 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.407 -0.808 . . . . 0.0 110.796 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -74.37 -42.97 58.42 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.463 -0.773 . . . . 0.0 109.858 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 9.0 mt -56.12 -40.08 73.2 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.66 -0.65 . . . . 0.0 110.782 -179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -72.32 -48.82 39.07 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.383 -0.823 . . . . 0.0 110.044 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 6.1 tp60 -63.04 -54.72 33.73 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.416 -0.802 . . . . 0.0 110.652 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.23 -38.23 39.48 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.457 -0.777 . . . . 0.0 110.812 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.534 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -59.89 -57.8 11.32 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.429 -0.794 . . . . 0.0 110.798 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -77.35 -42.52 36.26 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.712 -0.617 . . . . 0.0 111.469 -178.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -53.42 -43.36 67.9 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.18 -0.95 . . . . 0.0 109.588 179.619 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.49 ' CD1' HG21 ' A' ' 20' ' ' VAL . 28.2 t90 -69.17 -46.04 68.51 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.455 -0.778 . . . . 0.0 109.13 178.735 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -59.18 -43.78 92.17 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.497 -0.752 . . . . 0.0 110.156 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.488 ' O ' HD12 ' A' ' 22' ' ' LEU . 3.9 m95 -75.21 -13.67 60.47 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.409 -0.807 . . . . 0.0 111.064 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -101.68 -24.48 14.09 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.849 -1.157 . . . . 0.0 110.659 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.49 HG21 ' CD1' ' A' ' 16' ' ' TRP . 48.0 t -105.89 -40.9 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.294 -0.879 . . . . 0.0 111.037 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.2 m -77.86 -34.35 51.76 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.196 -0.94 . . . . 0.0 111.141 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.488 HD12 ' O ' ' A' ' 18' ' ' TRP . 31.0 mt . . . . . 0 N--CA 1.498 1.936 0 O-C-N 121.376 -0.827 . . . . 0.0 110.033 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 33.6 m120 . . . . . 0 N--CA 1.499 1.978 0 CA-C-O 120.742 0.306 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.3 t -58.42 -47.61 83.37 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.403 -0.81 . . . . 0.0 109.533 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -66.53 -40.37 89.09 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.746 -0.596 . . . . 0.0 109.705 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.458 ' HA ' HD22 ' A' ' 9' ' ' LEU . 0.6 OUTLIER -54.74 -36.98 65.36 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.685 -0.634 . . . . 0.0 110.669 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -83.15 -45.97 13.29 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.376 -0.828 . . . . 0.0 109.925 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.98 -48.09 83.45 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.422 -0.799 . . . . 0.0 110.177 -179.865 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.25 -39.34 69.66 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.46 -0.775 . . . . 0.0 110.008 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.505 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -55.76 -60.82 2.91 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.373 0.606 . . . . 0.0 110.349 179.633 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -70.86 -31.16 67.76 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.84 -0.538 . . . . 0.0 110.856 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.446 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 15.2 t-20 -50.74 -46.36 59.21 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.422 -0.799 . . . . 0.0 109.62 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.636 ' NE1' HG21 ' A' ' 20' ' ' VAL . 6.7 t90 -73.04 -44.57 60.59 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.506 -0.746 . . . . 0.0 109.177 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -55.18 -45.06 75.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.538 -0.726 . . . . 0.0 109.99 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.525 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -73.51 -43.33 60.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.421 -0.799 . . . . 0.0 110.193 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -62.73 -36.14 82.04 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.361 -0.837 . . . . 0.0 110.82 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.636 HG21 ' NE1' ' A' ' 16' ' ' TRP . 90.2 t -84.01 -36.65 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.216 -0.927 . . . . 0.0 110.78 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.3 m -78.91 -42.51 26.96 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.126 -0.984 . . . . 0.0 110.722 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 18' ' ' TRP . 12.4 mt . . . . . 0 N--CA 1.498 1.944 0 O-C-N 121.38 -0.825 . . . . 0.0 110.721 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.43 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.498 1.967 0 CA-C-O 120.505 0.193 . . . . 0.0 110.68 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -54.15 -46.64 72.33 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.417 -0.802 . . . . 0.0 109.774 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -71.43 -40.14 70.59 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.548 -0.72 . . . . 0.0 109.578 178.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.451 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.9 mm? -61.69 -48.73 79.47 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.587 -0.696 . . . . 0.0 109.833 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -65.9 -39.57 90.74 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.49 -0.756 . . . . 0.0 109.515 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -60.82 -43.26 98.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.476 -0.765 . . . . 0.0 110.189 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -24.48 53.57 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.579 -0.701 . . . . 0.0 110.974 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.549 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -78.16 -60.6 2.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.256 -0.903 . . . . 0.0 110.236 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -71.36 -28.89 64.37 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.521 -0.737 . . . . 0.0 111.382 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 2.4 t-20 -53.31 -51.52 62.07 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.174 -0.954 . . . . 0.0 109.539 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -65.33 -43.75 89.97 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -55.59 -59.26 5.09 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.709 -0.619 . . . . 0.0 109.808 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 6.9 m95 -60.53 -33.12 72.19 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.368 -0.832 . . . . 0.0 110.346 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -57.04 -39.94 75.8 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.308 -0.87 . . . . 0.0 110.217 179.511 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.406 HG22 ' H ' ' A' ' 20' ' ' VAL . 27.1 m -95.53 -29.44 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.317 -0.865 . . . . 0.0 110.499 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 94.2 m -68.95 -42.41 76.72 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.209 -0.932 . . . . 0.0 109.987 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.4 mt . . . . . 0 N--CA 1.495 1.812 0 O-C-N 121.486 -0.759 . . . . 0.0 110.237 -179.975 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 . . . . . 0 N--CA 1.498 1.944 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.9 m -58.94 -49.75 76.64 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.387 -0.821 . . . . 0.0 109.406 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -65.02 -45.87 83.73 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.672 -0.642 . . . . 0.0 109.356 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -58.29 -43.95 88.27 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.718 -0.614 . . . . 0.0 109.875 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -67.54 -42.9 81.96 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.584 -0.698 . . . . 0.0 109.509 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.48 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 19.5 mm-40 -64.67 -50.94 65.06 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.516 -0.74 . . . . 0.0 110.126 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -53.17 -34.96 59.13 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.503 -0.748 . . . . 0.0 110.347 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.498 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -61.3 -55.26 33.78 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.565 -0.709 . . . . 0.0 110.676 179.814 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -78.9 -42.71 26.48 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.699 -0.626 . . . . 0.0 111.363 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -55.6 -38.3 69.24 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.467 -0.771 . . . . 0.0 110.301 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -63.66 -49.0 74.91 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.412 -0.805 . . . . 0.0 109.453 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -56.22 -51.01 69.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.708 -0.62 . . . . 0.0 109.79 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.525 ' HB3' HD12 ' A' ' 22' ' ' LEU . 30.9 m95 -63.41 -31.83 73.09 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.525 -0.735 . . . . 0.0 110.769 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.15 -41.76 97.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.299 -0.876 . . . . 0.0 110.51 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.6 m -89.76 -14.42 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.326 -0.858 . . . . 0.0 110.969 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.2 m -92.76 -35.41 13.45 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.124 -0.985 . . . . 0.0 110.636 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 18' ' ' TRP . 31.7 mt . . . . . 0 N--CA 1.496 1.857 0 O-C-N 121.313 -0.867 . . . . 0.0 110.326 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.6 m120 . . . . . 0 N--CA 1.497 1.885 0 CA-C-O 120.721 0.296 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.9 t -58.56 -52.51 65.37 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.481 -0.762 . . . . 0.0 110.783 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.579 ' CE1' HD13 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -63.07 -30.84 71.91 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.369 -0.832 . . . . 0.0 110.266 179.907 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.579 HD13 ' CE1' ' A' ' 8' ' ' TYR . 3.6 tp -67.59 -46.94 71.17 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.368 -0.832 . . . . 0.0 109.732 179.092 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.439 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 4.0 t-105 -60.02 -37.24 79.16 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.621 -0.674 . . . . 0.0 109.379 179.101 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.515 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.64 -46.81 88.9 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.568 -0.707 . . . . 0.0 109.592 179.053 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.41 -39.24 56.85 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.74 -0.6 . . . . 0.0 110.483 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.516 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -59.42 -57.46 12.91 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.598 -0.689 . . . . 0.0 110.645 -179.914 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -75.48 -40.0 57.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.598 -0.689 . . . . 0.0 111.603 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -51.86 -43.33 63.21 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.304 -0.873 . . . . 0.0 110.179 -179.825 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.1 t90 -66.61 -48.9 68.06 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.413 -0.804 . . . . 0.0 109.24 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -56.59 -51.76 67.4 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.796 -0.565 . . . . 0.0 109.877 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.405 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.3 m95 -63.87 -30.42 71.51 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.528 -0.732 . . . . 0.0 110.428 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.486 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 8.7 t-20 -65.14 -46.45 80.87 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.268 -0.895 . . . . 0.0 110.65 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.5 m -86.36 -26.05 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.283 -0.885 . . . . 0.0 111.133 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.7 m -78.81 -36.96 41.89 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.215 -0.928 . . . . 0.0 110.648 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.405 HD12 ' HB3' ' A' ' 18' ' ' TRP . 60.9 mt . . . . . 0 N--CA 1.499 1.977 0 O-C-N 121.333 -0.854 . . . . 0.0 110.838 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.509 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 1.3 t-20 . . . . . 0 N--CA 1.497 1.887 0 CA-C-O 120.61 0.243 . . . . 0.0 110.508 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.1 t -57.1 -44.29 83.05 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.47 -0.769 . . . . 0.0 109.968 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -77.96 -37.27 47.88 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.449 -0.782 . . . . 0.0 109.598 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 12.3 mt -56.5 -41.87 77.37 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.677 -0.639 . . . . 0.0 110.281 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.45 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 4.5 t-105 -58.79 -42.95 90.27 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.447 -0.783 . . . . 0.0 109.584 179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -61.5 -44.36 97.2 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.435 -0.79 . . . . 0.0 109.433 179.129 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -54.59 -39.15 67.56 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.712 -0.618 . . . . 0.0 110.144 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.521 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -56.79 -60.05 4.13 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.39 0.614 . . . . 0.0 110.248 179.747 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.66 -33.49 72.66 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.556 -0.715 . . . . 0.0 110.567 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -52.19 -43.74 64.33 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.475 -0.766 . . . . 0.0 109.838 179.437 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.524 ' O ' HG22 ' A' ' 20' ' ' VAL . 7.0 t90 -70.06 -45.53 66.89 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.54 -0.725 . . . . 0.0 109.224 178.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -58.81 -48.76 80.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.826 -0.546 . . . . 0.0 109.748 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.519 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -67.5 -33.84 75.93 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.454 -0.779 . . . . 0.0 110.019 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 19.9 t-20 -64.46 -45.01 89.27 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.335 -0.853 . . . . 0.0 110.549 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 16' ' ' TRP . 29.9 m -85.08 -24.63 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.21 -0.932 . . . . 0.0 111.263 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 65.9 m -84.46 -40.35 17.83 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.065 -1.022 . . . . 0.0 110.469 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.519 HD12 ' HB3' ' A' ' 18' ' ' TRP . 10.9 mt . . . . . 0 N--CA 1.499 2.019 0 O-C-N 121.435 -0.791 . . . . 0.0 110.829 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.5 m120 . . . . . 0 N--CA 1.496 1.856 0 CA-C-O 120.778 0.323 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.1 t -58.07 -47.75 82.22 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.459 -0.776 . . . . 0.0 109.654 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -69.26 -41.87 76.32 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.55 -0.718 . . . . 0.0 109.836 179.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.89 -40.41 95.31 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.54 -0.725 . . . . 0.0 110.528 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.7 t90 -66.2 -46.88 75.75 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.337 -0.852 . . . . 0.0 110.154 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -37.58 67.74 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.339 -0.851 . . . . 0.0 110.222 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -32.4 68.87 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.569 -0.707 . . . . 0.0 110.394 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.74 -44.89 88.68 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.458 -0.776 . . . . 0.0 109.983 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -70.2 -39.94 74.89 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.327 -0.858 . . . . 0.0 109.964 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.53 -48.26 77.63 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.498 -0.751 . . . . 0.0 109.282 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -68.74 -42.57 77.39 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.597 -0.689 . . . . 0.0 109.452 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.3 -57.84 10.85 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.711 -0.618 . . . . 0.0 110.207 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.473 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.6 m95 -59.52 -37.12 77.51 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.332 -0.855 . . . . 0.0 110.428 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -56.35 -44.91 80.53 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.505 -0.747 . . . . 0.0 110.821 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.5 m -92.74 -31.78 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.3 -0.875 . . . . 0.0 110.976 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.8 m -69.74 -32.19 70.59 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.184 -0.947 . . . . 0.0 110.264 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.473 HD12 ' HB3' ' A' ' 18' ' ' TRP . 10.4 mt . . . . . 0 N--CA 1.491 1.617 0 O-C-N 121.441 -0.787 . . . . 0.0 109.367 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.422 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.897 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.9 p -59.68 -48.79 80.27 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.453 -0.78 . . . . 0.0 109.24 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -66.62 -37.73 85.47 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.644 -0.66 . . . . 0.0 109.221 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 9' ' ' LEU . 11.5 mt -58.75 -44.78 90.63 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.717 -0.614 . . . . 0.0 109.963 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.7 t90 -62.85 -45.75 91.1 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.645 -0.659 . . . . 0.0 109.366 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -39.79 74.07 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.514 -0.741 . . . . 0.0 110.011 179.567 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -63.54 -39.75 95.23 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.622 -0.674 . . . . 0.0 110.385 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -45.69 92.73 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.475 -0.766 . . . . 0.0 109.72 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -72.69 -39.05 67.33 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.252 -0.905 . . . . 0.0 109.726 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.63 -42.91 68.29 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.602 -0.686 . . . . 0.0 109.86 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -70.39 -45.12 66.6 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.453 -0.779 . . . . 0.0 109.297 179.049 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -55.47 -45.88 76.91 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.69 -0.631 . . . . 0.0 109.65 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 25.6 m95 -72.84 -36.52 67.48 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.613 -0.679 . . . . 0.0 109.958 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -53.99 -43.43 69.98 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.547 -0.721 . . . . 0.0 110.651 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.8 m -84.46 -27.93 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.374 -0.829 . . . . 0.0 110.896 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.8 m -80.54 -24.54 39.22 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.219 -0.926 . . . . 0.0 110.917 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.8 mt . . . . . 0 N--CA 1.499 1.999 0 O-C-N 121.305 -0.872 . . . . 0.0 111.366 -179.692 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 120.599 0.238 . . . . 0.0 110.408 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.6 m -52.72 -48.09 66.9 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.462 -0.774 . . . . 0.0 110.232 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -70.03 -43.14 71.93 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.464 -0.773 . . . . 0.0 109.519 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 9' ' ' LEU . 9.1 mt -59.57 -43.46 93.59 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.678 -0.639 . . . . 0.0 110.12 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -62.51 -44.94 95.14 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.637 -0.665 . . . . 0.0 110.032 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -59.08 -41.33 87.76 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.283 -0.886 . . . . 0.0 110.103 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -39.49 94.92 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.607 -0.683 . . . . 0.0 110.364 179.39 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -45.43 93.49 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.471 -0.768 . . . . 0.0 109.94 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -72.59 -34.87 67.72 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.233 -0.917 . . . . 0.0 109.956 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -54.31 -47.74 72.1 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.524 -0.735 . . . . 0.0 109.521 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -74.16 -41.93 60.72 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.519 -0.738 . . . . 0.0 109.582 179.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -55.36 -47.99 74.91 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.544 -0.723 . . . . 0.0 110.427 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 21.1 m95 -72.53 -33.42 66.85 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.447 -0.783 . . . . 0.0 110.379 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -58.96 -30.57 68.0 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.364 -0.835 . . . . 0.0 110.774 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.6 m -100.12 -19.94 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.236 -0.915 . . . . 0.0 110.835 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.4 m -88.91 -27.05 21.24 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.237 -0.914 . . . . 0.0 110.782 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.3 mt . . . . . 0 N--CA 1.5 2.042 0 O-C-N 121.269 -0.894 . . . . 0.0 110.969 -179.955 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 . . . . . 0 N--CA 1.497 1.92 0 CA-C-O 120.43 0.157 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 m -54.65 -52.32 62.66 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.36 -0.837 . . . . 0.0 109.747 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -62.73 -42.65 99.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.521 -0.737 . . . . 0.0 109.386 178.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.431 ' HA ' HD23 ' A' ' 9' ' ' LEU . 8.6 mt -58.76 -44.76 90.67 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.634 -0.666 . . . . 0.0 109.901 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -64.81 -42.86 94.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.712 -0.617 . . . . 0.0 109.673 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -61.19 -39.58 90.72 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.289 -0.882 . . . . 0.0 110.312 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -37.27 86.95 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.402 -0.811 . . . . 0.0 110.275 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.424 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -65.79 -46.35 79.02 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.369 -0.832 . . . . 0.0 109.596 179.653 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.413 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 3.9 mt-10 -68.62 -35.25 77.06 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.399 -0.813 . . . . 0.0 109.932 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 2.3 t-20 -55.83 -53.22 59.38 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.56 -0.713 . . . . 0.0 109.227 178.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.4 ' O ' HG22 ' A' ' 20' ' ' VAL . 9.2 t90 -65.85 -42.25 90.68 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.676 -0.64 . . . . 0.0 109.396 178.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.424 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 55.4 t80 -54.87 -57.53 11.22 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.715 -0.616 . . . . 0.0 109.828 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.415 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 16.3 m95 -64.52 -32.91 74.75 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.368 -0.832 . . . . 0.0 110.185 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 3.6 t30 -55.92 -35.31 66.45 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.455 -0.778 . . . . 0.0 110.491 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 16' ' ' TRP . 30.1 m -104.33 -9.59 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.283 -0.885 . . . . 0.0 111.002 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.415 ' HB ' ' HA ' ' A' ' 18' ' ' TRP . 67.1 m -93.44 -33.05 13.97 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.188 -0.945 . . . . 0.0 110.496 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 N--CA 1.499 2.002 0 O-C-N 121.407 -0.808 . . . . 0.0 110.911 179.861 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.8 m120 . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 120.452 0.168 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.53 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -63.86 -57.56 9.47 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.044 -1.035 . . . . 0.0 110.006 179.636 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -69.68 -14.74 62.96 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.316 -0.865 . . . . 0.0 111.158 179.69 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -95.82 -28.51 14.7 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.15 -0.969 . . . . 0.0 111.217 -179.595 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -99.84 -48.47 4.68 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.165 -0.959 . . . . 0.0 110.917 -179.656 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.53 ' HB2' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -55.02 -32.74 62.05 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.266 -0.896 . . . . 0.0 110.843 -179.542 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -61.09 -38.15 85.24 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.327 -0.858 . . . . 0.0 110.114 179.395 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.412 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -59.78 -45.14 93.22 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.646 -0.659 . . . . 0.0 109.553 179.7 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.412 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 21.7 mt-10 -69.18 -35.76 76.61 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.394 -0.816 . . . . 0.0 109.897 179.485 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -49.5 67.41 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.518 -0.739 . . . . 0.0 109.338 179.109 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -69.67 -43.19 73.02 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.492 -0.755 . . . . 0.0 109.279 178.738 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.76 -53.18 60.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.749 -0.595 . . . . 0.0 110.182 179.848 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -64.42 -36.46 84.23 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.299 -0.876 . . . . 0.0 110.197 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -58.49 -34.24 70.7 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.472 -0.767 . . . . 0.0 111.271 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.4 m -103.17 -27.66 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.206 -0.934 . . . . 0.0 111.115 -179.746 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.7 m -77.42 -41.65 39.09 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.163 -0.96 . . . . 0.0 110.768 -179.632 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 N--CA 1.501 2.083 0 O-C-N 121.427 -0.796 . . . . 0.0 110.47 179.971 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.7 m120 . . . . . 0 N--CA 1.495 1.806 0 CA-C-O 120.799 0.333 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 57.7 m -61.25 -56.0 25.62 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.526 -0.734 . . . . 0.0 110.718 -179.9 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.485 ' CZ ' HD13 ' A' ' 9' ' ' LEU . 1.2 p90 -67.2 -26.6 66.7 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.259 -0.901 . . . . 0.0 110.388 179.89 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' A' ' 9' ' ' LEU . 1.4 tp -60.32 -42.86 96.48 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.327 -0.858 . . . . 0.0 109.836 178.949 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.605 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -78.06 -36.92 47.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.361 -0.837 . . . . 0.0 109.841 179.378 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -66.66 -47.6 71.99 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.403 -0.811 . . . . 0.0 109.727 179.385 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' A' ' 16' ' ' TRP . 9.1 tmm_? -59.07 -17.23 24.05 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.487 -0.758 . . . . 0.0 110.337 178.982 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.457 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -83.42 -58.42 2.84 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.314 -0.866 . . . . 0.0 109.888 179.431 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -82.31 -47.69 12.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.811 -0.555 . . . . 0.0 111.515 -178.742 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -53.65 -40.12 65.61 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.164 -0.96 . . . . 0.0 110.284 -179.696 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.469 ' HB3' ' O ' ' A' ' 12' ' ' ARG . 9.1 t90 -75.26 -48.51 22.95 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.313 -0.867 . . . . 0.0 109.561 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -57.18 -49.74 75.03 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.597 -0.69 . . . . 0.0 110.309 -179.596 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.709 ' CE3' HD12 ' A' ' 22' ' ' LEU . 4.9 m95 -65.53 -35.43 80.82 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.187 -0.946 . . . . 0.0 110.033 179.664 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 5.3 t30 -71.66 -36.49 70.67 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.09 -1.006 . . . . 0.0 110.641 179.546 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.4 p -89.93 -20.65 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.383 -0.823 . . . . 0.0 111.07 -179.732 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.1 m -107.78 -59.21 1.87 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.199 -0.938 . . . . 0.0 110.202 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.709 HD12 ' CE3' ' A' ' 18' ' ' TRP . 3.1 mt . . . . . 0 N--CA 1.5 2.031 0 O-C-N 121.505 -0.747 . . . . 0.0 110.352 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 31.3 m120 . . . . . 0 N--CA 1.496 1.837 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.0 m -58.08 -46.84 84.78 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.294 -0.879 . . . . 0.0 109.384 179.057 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -59.67 -44.66 93.51 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.782 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 9' ' ' LEU . 0.3 OUTLIER -67.59 -43.86 79.49 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.738 -0.601 . . . . 0.0 109.975 179.551 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.476 ' CE3' ' HG3' ' A' ' 11' ' ' GLN . 19.1 t90 -61.94 -45.11 95.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.668 -0.645 . . . . 0.0 109.665 179.403 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.476 ' HG3' ' CE3' ' A' ' 10' ' ' TRP . 5.0 mt-30 -58.12 -39.11 77.87 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.486 -0.759 . . . . 0.0 110.244 179.692 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.8 mmt-85 -64.7 -42.96 94.93 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.491 -0.756 . . . . 0.0 110.367 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -44.87 91.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.441 -0.787 . . . . 0.0 109.998 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -74.17 -35.89 64.03 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.225 -0.922 . . . . 0.0 110.223 179.54 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -55.45 -47.78 75.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.39 -0.818 . . . . 0.0 109.781 179.472 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.4 t90 -67.08 -46.07 75.42 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.587 -0.696 . . . . 0.0 109.361 179.043 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -55.14 -52.4 63.42 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.723 -0.61 . . . . 0.0 109.723 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.408 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.3 m95 -66.79 -31.13 71.56 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.484 -0.76 . . . . 0.0 110.065 179.384 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 4.3 t30 -57.98 -46.24 85.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.409 -0.807 . . . . 0.0 110.152 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.432 HG22 ' H ' ' A' ' 20' ' ' VAL . 30.0 m -84.99 -25.89 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.349 -0.845 . . . . 0.0 110.608 179.589 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.408 ' HB ' ' HA ' ' A' ' 18' ' ' TRP . 55.2 m -74.37 -37.64 63.41 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.248 -0.907 . . . . 0.0 110.231 179.713 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.6 mt . . . . . 0 N--CA 1.497 1.897 0 O-C-N 121.501 -0.749 . . . . 0.0 110.373 179.93 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 . . . . . 0 N--CA 1.497 1.879 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 t -55.39 -48.7 73.93 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.365 -0.834 . . . . 0.0 109.585 179.615 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -60.65 -43.65 97.35 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.606 -0.684 . . . . 0.0 109.488 178.983 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.05 -43.18 88.26 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.561 -0.712 . . . . 0.0 109.822 179.604 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.44 ' CE3' ' HG3' ' A' ' 11' ' ' GLN . 12.3 t90 -65.79 -42.65 90.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.645 -0.659 . . . . 0.0 109.931 179.492 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.44 ' HG3' ' CE3' ' A' ' 10' ' ' TRP . 6.5 mt-30 -54.14 -46.28 72.21 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.385 -0.822 . . . . 0.0 110.352 179.869 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -64.36 -33.49 75.97 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.655 -0.653 . . . . 0.0 110.8 -179.923 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.512 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -66.85 -44.55 80.72 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.31 -0.869 . . . . 0.0 110.402 -179.63 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.512 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 6.3 mt-10 -75.94 -49.97 16.26 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.193 -0.942 . . . . 0.0 110.922 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.1 -39.5 59.87 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.329 -0.857 . . . . 0.0 110.185 179.893 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.1 t90 -77.16 -45.29 27.23 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.385 -0.822 . . . . 0.0 109.534 179.035 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -55.65 -53.99 49.71 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.628 -0.67 . . . . 0.0 110.033 -179.981 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.6 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.1 m95 -59.97 -33.07 71.45 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.22 -0.925 . . . . 0.0 110.075 179.384 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -38.13 80.57 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.424 -0.798 . . . . 0.0 110.995 179.666 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.9 m -103.93 -25.87 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 O-C-N 121.409 -0.807 . . . . 0.0 111.348 -179.391 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.1 m -82.78 -48.37 10.89 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.094 -1.004 . . . . 0.0 110.757 -179.511 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.6 HD12 ' HB3' ' A' ' 18' ' ' TRP . 49.4 mt . . . . . 0 N--CA 1.497 1.892 0 O-C-N 121.427 -0.796 . . . . 0.0 110.207 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 120.897 0.38 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.4 t -62.66 -46.96 85.77 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -0.839 . . . . 0.0 110.059 179.48 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.05 -39.38 83.04 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.444 -0.785 . . . . 0.0 109.806 179.607 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.451 ' HA ' HD22 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -67.33 -44.31 79.41 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.433 -0.792 . . . . 0.0 109.963 179.336 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.502 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 3.5 t-105 -60.81 -37.75 83.05 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.647 -0.658 . . . . 0.0 110.252 179.721 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.1 -49.76 73.2 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.298 -0.877 . . . . 0.0 109.648 179.573 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -35.86 75.99 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.611 -0.681 . . . . 0.0 109.825 179.037 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.462 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -55.53 -50.81 68.99 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.722 0.772 . . . . 0.0 109.803 179.146 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -78.44 -31.74 48.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.859 -0.526 . . . . 0.0 110.168 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.428 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -49.52 -49.17 47.09 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.601 -0.687 . . . . 0.0 109.818 179.413 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.468 ' O ' HG12 ' A' ' 20' ' ' VAL . 6.1 t90 -72.52 -44.58 62.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.624 -0.673 . . . . 0.0 109.297 178.973 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -53.8 -48.9 69.37 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.839 -0.538 . . . . 0.0 110.148 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 5.8 m95 -70.2 -39.45 75.18 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.391 -0.818 . . . . 0.0 109.74 179.391 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 7.7 t-20 -62.45 -55.69 25.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.309 -0.869 . . . . 0.0 110.38 179.595 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.468 HG12 ' O ' ' A' ' 16' ' ' TRP . 8.6 p -66.52 -22.66 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.334 -0.853 . . . . 0.0 111.641 -179.828 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.1 m -90.79 -36.25 14.37 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.002 -1.061 . . . . 0.0 110.921 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 N--CA 1.498 1.95 0 O-C-N 121.333 -0.854 . . . . 0.0 110.594 -179.674 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.514 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.498 1.957 0 CA-C-O 120.661 0.267 . . . . 0.0 110.478 . . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.0 m -56.08 -47.66 77.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.459 -0.775 . . . . 0.0 109.41 179.377 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -70.77 -39.39 73.24 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.725 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.514 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 15.1 mt -57.53 -45.95 84.41 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.562 -0.711 . . . . 0.0 109.847 179.582 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.7 t90 -73.9 -48.14 32.98 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.629 -0.669 . . . . 0.0 109.768 179.335 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -56.74 -40.24 75.4 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.408 -0.808 . . . . 0.0 110.385 -179.817 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.63 -38.05 86.25 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.487 -0.758 . . . . 0.0 110.384 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.409 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -65.37 -47.97 74.56 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.357 -0.84 . . . . 0.0 109.213 179.463 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 3.1 mt-10 -69.52 -31.25 69.37 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.535 -0.728 . . . . 0.0 109.848 179.158 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -55.35 -49.53 72.0 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.424 -0.797 . . . . 0.0 108.866 178.601 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.58 ' NE1' HG21 ' A' ' 20' ' ' VAL . 14.3 t90 -70.1 -42.35 72.82 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.576 -0.702 . . . . 0.0 109.236 178.59 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -54.22 -31.8 54.18 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.624 -0.672 . . . . 0.0 110.874 179.728 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.525 ' HB3' HD12 ' A' ' 22' ' ' LEU . 24.1 m95 -102.91 -43.22 5.59 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.363 -0.835 . . . . 0.0 110.972 -179.601 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -57.51 -37.78 73.56 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.247 -0.908 . . . . 0.0 111.098 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.58 HG21 ' NE1' ' A' ' 16' ' ' TRP . 89.8 t -65.88 -32.86 60.04 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.238 -0.914 . . . . 0.0 110.316 179.907 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.9 m -93.68 -22.58 18.66 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.534 -0.729 . . . . 0.0 111.029 -179.81 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 18' ' ' TRP . 78.2 mt . . . . . 0 N--CA 1.501 2.079 0 O-C-N 121.255 -0.903 . . . . 0.0 111.309 -179.629 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 . . . . . 0 N--CA 1.5 2.063 0 CA-C-O 120.551 0.215 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.6 t -57.98 -42.96 86.19 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.357 -0.839 . . . . 0.0 109.602 179.524 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.421 ' CD2' HD22 ' A' ' 9' ' ' LEU . 35.8 t80 -71.92 -39.52 69.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.372 -0.83 . . . . 0.0 109.495 178.995 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.445 HD13 ' HA ' ' A' ' 9' ' ' LEU . 1.1 mm? -70.77 -23.01 62.33 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.406 -0.809 . . . . 0.0 110.99 179.835 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.454 ' HA ' ' HD1' ' A' ' 13' ' ' TRP . 26.8 t90 -103.88 -53.69 2.71 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.357 -0.839 . . . . 0.0 110.863 -179.405 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -62.44 -49.24 76.23 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.098 -1.001 . . . . 0.0 110.889 -179.508 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -38.53 87.16 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.285 -0.884 . . . . 0.0 110.215 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.497 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -63.45 -43.93 95.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.451 -0.781 . . . . 0.0 109.504 179.48 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.494 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 48.7 mt-10 -69.29 -45.06 70.54 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.354 -0.841 . . . . 0.0 109.968 179.535 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.85 -42.56 65.32 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.384 -0.823 . . . . 0.0 109.586 179.163 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -72.66 -43.86 62.6 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.433 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.497 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 81.8 t80 -56.04 -53.81 52.49 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.72 -0.612 . . . . 0.0 109.62 179.473 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -59.28 -32.56 70.14 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.576 -0.703 . . . . 0.0 109.831 179.189 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -61.31 -35.38 77.19 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.59 -0.693 . . . . 0.0 110.769 179.435 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.7 m -111.03 7.9 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.255 -0.903 . . . . 0.0 111.519 -179.991 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.443 HG21 ' CZ ' ' A' ' 17' ' ' PHE . 97.7 m -119.04 -31.6 4.69 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.977 -1.077 . . . . 0.0 111.087 -179.857 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 22' ' ' LEU . 18.4 mt . . . . . 0 N--CA 1.501 2.121 0 O-C-N 121.315 -0.866 . . . . 0.0 110.988 -179.806 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 120.518 0.199 . . . . 0.0 110.665 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.8 t -52.69 -43.59 65.69 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.142 -0.974 . . . . 0.0 110.168 -179.974 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.492 ' CZ ' ' HG3' ' A' ' 12' ' ' ARG . 33.9 t80 -79.86 -39.07 31.38 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.457 -0.777 . . . . 0.0 110.075 179.423 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.53 -35.87 78.05 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.583 -0.698 . . . . 0.0 111.186 -179.525 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -58.76 -54.56 45.68 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.267 -0.896 . . . . 0.0 110.44 -179.665 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.69 -38.39 86.69 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.39 -0.819 . . . . 0.0 110.322 179.728 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.492 ' HG3' ' CZ ' ' A' ' 8' ' ' TYR . 13.4 mmm180 -65.54 -8.73 21.24 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.198 -0.939 . . . . 0.0 111.198 179.692 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -101.81 -47.36 4.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.223 -0.923 . . . . 0.0 109.981 179.637 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -88.37 -45.86 9.65 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.919 -0.488 . . . . 0.0 110.864 -178.774 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -39.66 95.3 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.264 -0.898 . . . . 0.0 109.972 179.826 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.427 ' O ' HG22 ' A' ' 20' ' ' VAL . 9.8 t90 -72.21 -47.71 48.5 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.427 -0.796 . . . . 0.0 109.668 179.178 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -57.37 -51.71 68.29 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.68 -0.638 . . . . 0.0 110.166 -179.815 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 8.6 m95 -65.8 -33.46 75.9 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.312 -0.867 . . . . 0.0 110.465 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -60.49 -57.05 14.37 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.172 -0.955 . . . . 0.0 110.611 179.966 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 16' ' ' TRP . 27.3 m -67.54 -22.79 29.0 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.287 -0.883 . . . . 0.0 111.252 -179.57 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 86.7 m -87.89 -31.06 19.67 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.086 -1.009 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.1 mt . . . . . 0 N--CA 1.497 1.91 0 O-C-N 121.275 -0.891 . . . . 0.0 110.214 -179.93 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.0 t30 . . . . . 0 N--CA 1.494 1.77 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 71.7 m -54.38 -54.91 34.24 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.442 -0.786 . . . . 0.0 109.67 179.546 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -61.61 -44.25 97.34 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.655 -0.653 . . . . 0.0 109.437 178.915 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 9' ' ' LEU . 9.6 mt -57.05 -41.12 78.12 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.628 -0.67 . . . . 0.0 110.308 179.69 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.472 ' HA ' ' HD1' ' A' ' 13' ' ' TRP . 28.5 t90 -68.47 -39.33 81.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.472 -0.768 . . . . 0.0 109.988 179.395 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -64.33 -36.63 84.76 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.383 -0.823 . . . . 0.0 110.824 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -39.8 61.06 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.297 -0.877 . . . . 0.0 110.658 -179.807 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.472 ' HD1' ' HA ' ' A' ' 10' ' ' TRP . 0.0 OUTLIER -60.05 -45.5 92.65 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.32 -0.862 . . . . 0.0 110.02 179.952 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.431 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 3.0 mt-10 -65.16 -42.94 93.27 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.308 -0.87 . . . . 0.0 110.264 179.836 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.06 -36.19 70.24 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.513 -0.742 . . . . 0.0 110.174 179.483 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -71.33 -47.07 58.83 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.448 -0.782 . . . . 0.0 109.298 179.272 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -55.89 -53.12 60.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.629 -0.669 . . . . 0.0 110.051 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 6.1 m95 -59.86 -31.08 69.43 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.352 -0.843 . . . . 0.0 110.697 179.604 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -31.69 72.33 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.352 -0.843 . . . . 0.0 111.283 179.945 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.2 m -106.28 -25.28 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.072 -1.017 . . . . 0.0 111.387 -179.665 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.8 m -82.11 -35.61 28.4 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.131 -0.981 . . . . 0.0 111.29 -179.278 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 N--CA 1.502 2.142 0 O-C-N 121.307 -0.871 . . . . 0.0 111.562 -179.533 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 . . . . . 0 N--CA 1.498 1.927 0 CA-C-O 120.5 0.19 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.7 t -50.61 -49.76 55.78 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.232 -0.917 . . . . 0.0 110.22 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -71.84 -46.52 57.74 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.475 -0.766 . . . . 0.0 110.024 179.497 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.462 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.1 mm? -57.75 -41.82 82.67 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.458 -0.776 . . . . 0.0 110.202 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.572 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -75.0 -34.76 61.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.529 -0.732 . . . . 0.0 109.72 179.342 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -64.53 -39.36 93.62 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.529 -0.732 . . . . 0.0 110.32 179.544 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.58 -26.57 22.2 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.314 -0.866 . . . . 0.0 110.332 179.278 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.566 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -86.89 -43.59 12.31 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.564 -0.71 . . . . 0.0 110.806 179.923 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -83.62 -38.69 21.25 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.381 -0.824 . . . . 0.0 111.496 -178.507 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -50.04 -43.72 51.12 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.26 -0.9 . . . . 0.0 109.763 179.551 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.542 ' NE1' HG21 ' A' ' 20' ' ' VAL . 18.5 t90 -73.22 -44.05 60.25 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.561 -0.712 . . . . 0.0 109.086 178.622 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -55.43 -44.92 76.72 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.462 -0.774 . . . . 0.0 109.987 179.525 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -71.77 -51.01 24.84 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.42 -0.8 . . . . 0.0 110.553 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.07 -21.61 65.09 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.16 -0.962 . . . . 0.0 111.803 -179.795 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.542 HG21 ' NE1' ' A' ' 16' ' ' TRP . 99.3 t -102.09 -31.64 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 120.961 -1.087 . . . . 0.0 111.288 -179.21 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.6 m -88.59 -34.06 17.45 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.977 -1.077 . . . . 0.0 111.28 -179.446 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.9 mt . . . . . 0 N--CA 1.501 2.102 0 O-C-N 121.175 -0.953 . . . . 0.0 110.841 -179.743 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 120.649 0.262 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.0 t -58.56 -47.71 83.33 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.292 -0.88 . . . . 0.0 109.69 179.363 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -66.79 -41.68 87.22 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.468 -0.77 . . . . 0.0 109.451 179.011 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.9 -40.27 97.04 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.678 -0.639 . . . . 0.0 110.038 179.499 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 28.0 t90 -61.57 -44.63 96.67 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.65 -0.656 . . . . 0.0 110.264 179.695 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -34.66 78.73 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.406 -0.809 . . . . 0.0 110.501 179.863 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -37.96 77.93 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.364 -0.835 . . . . 0.0 110.4 179.707 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.468 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -60.03 -47.22 86.77 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.448 -0.783 . . . . 0.0 109.675 179.985 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.462 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 28.4 mt-10 -69.01 -38.54 79.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.264 -0.897 . . . . 0.0 109.872 179.314 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.48 -49.26 78.47 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.574 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -67.11 -42.04 85.22 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.821 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.468 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 69.3 t80 -55.07 -58.06 9.2 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.599 -0.688 . . . . 0.0 109.684 179.687 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -62.93 -34.71 78.03 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.439 -0.788 . . . . 0.0 110.177 179.484 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -53.92 -36.72 63.07 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.5 -0.75 . . . . 0.0 110.602 179.396 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.6 m -104.42 -23.74 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 121.282 -0.886 . . . . 0.0 110.975 179.839 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 58.0 m -78.09 -27.92 48.58 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.152 -0.968 . . . . 0.0 111.016 -179.874 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 22' ' ' LEU . 51.8 mt . . . . . 0 N--CA 1.5 2.053 0 O-C-N 121.381 -0.824 . . . . 0.0 111.081 -179.941 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.421 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.499 1.993 0 CA-C-O 120.72 0.295 . . . . 0.0 110.378 . . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.6 m -57.69 -44.96 86.22 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.345 -0.847 . . . . 0.0 109.647 179.425 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -70.01 -39.88 75.56 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.513 -0.742 . . . . 0.0 109.216 178.648 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' A' ' 9' ' ' LEU . 12.3 mt -61.68 -49.83 74.93 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.745 -0.597 . . . . 0.0 109.948 179.458 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -64.49 -36.74 85.17 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.569 -0.707 . . . . 0.0 109.645 179.221 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -60.08 -44.0 95.08 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.446 -0.784 . . . . 0.0 110.19 179.441 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 ttp85 -53.57 -36.26 61.71 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.615 -0.678 . . . . 0.0 110.689 179.688 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.461 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -61.44 -59.45 5.24 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.564 -0.71 . . . . 0.0 110.227 179.97 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.569 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 8.9 mt-10 -72.87 -30.97 64.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.681 -0.637 . . . . 0.0 110.942 -179.545 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -50.57 -48.66 57.46 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.378 -0.826 . . . . 0.0 109.864 179.676 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.57 ' NE1' HG21 ' A' ' 20' ' ' VAL . 6.2 t90 -72.5 -42.12 65.2 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.528 -0.732 . . . . 0.0 109.302 178.903 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.569 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 15.9 t80 -57.72 -45.27 86.01 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.593 -0.692 . . . . 0.0 110.459 179.962 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -63.44 -57.62 9.69 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.276 -0.89 . . . . 0.0 110.895 -179.534 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.04 -27.13 68.11 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.043 -1.036 . . . . 0.0 111.716 -179.544 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.57 HG21 ' NE1' ' A' ' 16' ' ' TRP . 71.3 t -91.27 -24.88 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.062 -1.024 . . . . 0.0 111.324 -179.392 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.6 m -101.12 -38.02 8.32 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.085 -1.009 . . . . 0.0 111.338 -179.395 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 77.3 mt . . . . . 0 N--CA 1.502 2.144 0 O-C-N 121.251 -0.906 . . . . 0.0 110.96 -179.571 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.567 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 59.9 t30 . . . . . 0 N--CA 1.497 1.897 0 N-CA-C 111.355 0.131 . . . . 0.0 111.355 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.4 t -52.19 -52.45 52.04 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.102 -0.999 . . . . 0.0 109.929 179.96 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -70.61 -40.88 72.93 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.465 -0.772 . . . . 0.0 109.748 179.121 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 29.7 mt -60.03 -36.52 77.45 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.63 -0.669 . . . . 0.0 110.403 179.691 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -72.4 -40.1 67.46 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.418 -0.801 . . . . 0.0 110.024 179.485 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 5.8 mm-40 -61.44 -40.23 93.7 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.464 -0.773 . . . . 0.0 110.471 179.916 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.96 -38.81 65.36 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.568 -0.708 . . . . 0.0 110.321 179.54 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.493 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -58.92 -61.92 2.27 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.697 -0.627 . . . . 0.0 110.303 179.704 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -66.02 -33.84 76.72 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.546 -0.721 . . . . 0.0 110.661 -179.707 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 9.5 t-20 -51.95 -46.05 64.61 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.471 -0.768 . . . . 0.0 109.193 178.903 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.623 ' O ' HG22 ' A' ' 20' ' ' VAL . 18.1 t90 -70.99 -43.22 68.47 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.518 -0.739 . . . . 0.0 109.407 178.817 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -58.02 -52.02 67.27 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.635 -0.666 . . . . 0.0 109.916 179.818 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.495 ' HB3' HD12 ' A' ' 22' ' ' LEU . 7.8 m95 -64.21 -33.98 77.05 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.425 -0.797 . . . . 0.0 110.202 179.426 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -68.2 -41.95 80.62 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.363 -0.836 . . . . 0.0 111.063 179.837 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 16' ' ' TRP . 26.4 m -89.4 -25.02 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.187 -0.945 . . . . 0.0 111.438 -179.527 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.6 m -84.72 -51.74 6.58 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.106 -0.996 . . . . 0.0 110.653 -179.718 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.495 HD12 ' HB3' ' A' ' 18' ' ' TRP . 59.0 mt . . . . . 0 N--CA 1.497 1.925 0 O-C-N 121.415 -0.803 . . . . 0.0 109.749 179.904 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.499 2.018 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 . . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.7 p -57.43 -50.74 72.03 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.39 -0.819 . . . . 0.0 109.672 179.601 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -62.73 -44.86 95.12 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.651 -0.656 . . . . 0.0 109.437 179.0 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.39 -45.57 92.54 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.816 -0.553 . . . . 0.0 110.334 179.732 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.0 t90 -61.94 -49.36 76.44 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.522 -0.736 . . . . 0.0 109.916 179.589 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.407 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 50.0 tp60 -55.09 -35.98 65.17 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.447 -0.783 . . . . 0.0 110.297 179.918 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.38 -36.82 77.18 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.423 -0.798 . . . . 0.0 110.457 179.729 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.448 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -60.45 -45.91 91.96 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.476 -0.765 . . . . 0.0 109.333 179.564 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.448 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 5.2 mt-10 -73.32 -35.42 66.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.339 -0.851 . . . . 0.0 109.675 178.959 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -51.98 -46.58 64.89 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.393 -0.817 . . . . 0.0 109.921 179.365 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -68.47 -47.29 67.5 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.506 -0.747 . . . . 0.0 109.27 179.244 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -55.09 -42.35 72.74 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.692 -0.63 . . . . 0.0 109.815 179.596 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.569 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -77.65 -27.81 51.06 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.674 -0.641 . . . . 0.0 110.315 179.612 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 14.4 t-20 -65.0 -43.7 91.66 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.408 -0.807 . . . . 0.0 110.947 -179.806 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 m -80.09 -17.32 12.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.268 -0.895 . . . . 0.0 111.705 -179.461 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.5 p -95.93 -55.79 2.87 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.971 -1.081 . . . . 0.0 110.524 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.569 HD12 ' HB3' ' A' ' 18' ' ' TRP . 6.8 mt . . . . . 0 N--CA 1.499 1.975 0 O-C-N 121.59 -0.694 . . . . 0.0 110.805 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.4 t30 . . . . . 0 N--CA 1.496 1.834 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.4 m -57.98 -43.72 86.68 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.318 -0.864 . . . . 0.0 109.312 179.061 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -67.2 -38.48 85.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.789 -0.569 . . . . 0.0 109.614 178.936 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' A' ' 9' ' ' LEU . 0.5 OUTLIER -69.01 -41.25 78.01 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.579 -0.701 . . . . 0.0 110.333 179.715 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -75.67 -43.32 48.08 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.504 -0.748 . . . . 0.0 110.317 179.928 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.03 -57.0 13.96 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.306 -0.871 . . . . 0.0 110.614 -179.564 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.7 -37.89 43.89 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.557 -0.715 . . . . 0.0 110.991 -179.783 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.546 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -57.12 -60.0 4.25 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.658 -0.651 . . . . 0.0 110.482 179.85 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -76.01 -35.97 59.33 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.636 -0.665 . . . . 0.0 110.887 -179.476 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 3.2 t-20 -51.91 -49.21 63.51 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.506 -0.746 . . . . 0.0 109.552 179.565 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -67.2 -45.92 75.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.56 -0.712 . . . . 0.0 109.341 178.944 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -54.94 -52.5 62.82 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.672 -0.642 . . . . 0.0 109.892 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -65.14 -39.75 93.44 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.304 -0.872 . . . . 0.0 110.008 179.566 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 26.8 t30 -66.48 -29.24 69.31 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.459 -0.776 . . . . 0.0 111.336 179.791 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.2 p -101.61 -7.83 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.99 0 O-C-N 121.123 -0.985 . . . . 0.0 111.532 -179.407 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.7 m -109.0 -30.48 8.06 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.958 -1.089 . . . . 0.0 111.174 -179.718 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.0 mt . . . . . 0 N--CA 1.499 1.994 0 O-C-N 121.298 -0.876 . . . . 0.0 110.774 -179.995 . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.5 t30 . . . . . 0 N--CA 1.497 1.886 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -51.11 70.88 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.451 -0.781 . . . . 0.0 109.656 179.524 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -63.68 -40.26 96.36 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.638 -0.664 . . . . 0.0 109.364 178.824 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.422 ' HA ' HD23 ' A' ' 9' ' ' LEU . 6.9 mt -58.1 -41.81 84.33 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.59 -0.694 . . . . 0.0 110.205 179.561 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 33.3 t90 -65.6 -45.88 81.5 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.471 -0.768 . . . . 0.0 109.819 179.231 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -60.42 -35.53 76.02 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.353 -0.842 . . . . 0.0 110.218 179.9 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -40.13 88.14 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.544 -0.722 . . . . 0.0 110.1 179.305 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -46.35 88.16 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.546 -0.721 . . . . 0.0 109.438 179.501 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -74.18 -41.05 62.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.28 -0.887 . . . . 0.0 109.528 179.024 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -54.06 -47.74 71.33 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.634 -0.666 . . . . 0.0 109.38 179.06 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.537 ' O ' HG22 ' A' ' 20' ' ' VAL . 12.3 t90 -62.39 -47.76 82.7 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.531 -0.731 . . . . 0.0 109.282 179.004 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -58.1 -51.37 69.99 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.657 -0.652 . . . . 0.0 110.149 179.704 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.967 ' HE3' HD11 ' A' ' 22' ' ' LEU . 35.6 m95 -64.83 -16.31 62.95 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.463 -0.773 . . . . 0.0 110.73 179.472 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -92.91 -28.38 16.51 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.967 -1.083 . . . . 0.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.537 HG22 ' O ' ' A' ' 16' ' ' TRP . 19.8 m -106.2 0.21 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.112 0 O-C-N 121.097 -1.002 . . . . 0.0 111.737 -179.731 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 86.6 m -110.29 -16.72 13.67 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.917 -1.114 . . . . 0.0 111.179 -179.804 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.967 HD11 ' HE3' ' A' ' 18' ' ' TRP . 6.8 mp . . . . . 0 N--CA 1.495 1.778 0 O-C-N 121.199 -0.938 . . . . 0.0 110.143 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 39.8 ttt-85 . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 121.331 0.586 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.41 156.42 30.39 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.211 -0.93 . . . . 0.0 110.272 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.2 -30.95 71.98 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.519 -0.738 . . . . 0.0 110.964 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.1 pp -100.72 7.96 43.56 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.342 -0.849 . . . . 0.0 111.282 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.9 t -105.48 -58.45 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.128 -0.982 . . . . 0.0 110.102 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -62.65 -40.91 98.52 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.426 -0.797 . . . . 0.0 110.429 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -59.67 -45.68 91.34 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.41 -0.806 . . . . 0.0 109.498 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -65.44 -41.82 93.05 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.567 -0.708 . . . . 0.0 109.192 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.12 -46.45 88.99 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.638 -0.664 . . . . 0.0 109.718 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -67.06 -46.05 75.51 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.607 -0.683 . . . . 0.0 109.618 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -54.61 -39.14 67.58 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.503 -0.748 . . . . 0.0 110.142 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -66.68 -38.59 87.13 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.573 -0.704 . . . . 0.0 110.466 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -44.78 96.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.344 -0.847 . . . . 0.0 109.698 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -72.95 -39.05 66.52 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.288 -0.883 . . . . 0.0 109.693 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.9 -46.89 71.55 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.525 -0.734 . . . . 0.0 109.659 179.216 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -67.09 -45.23 77.89 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.539 -0.726 . . . . 0.0 109.123 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -56.06 -48.45 76.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.726 -0.609 . . . . 0.0 109.488 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -66.18 -39.65 89.87 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.478 -0.764 . . . . 0.0 110.035 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.13 -44.01 67.4 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.455 -0.778 . . . . 0.0 110.786 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.8 m -87.36 -26.74 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 121.311 -0.868 . . . . 0.0 111.048 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.1 m -77.34 -35.48 54.64 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.105 -0.997 . . . . 0.0 110.426 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.3 mt -79.1 -64.72 1.12 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.472 -0.768 . . . . 0.0 109.928 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.0 mmt-85 51.14 80.23 0.31 Allowed Pre-proline 0 N--CA 1.501 2.092 0 O-C-N 121.916 -0.49 . . . . 0.0 110.837 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -76.94 73.86 5.21 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 O-C-N 123.766 1.403 . . . . 0.0 110.684 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -98.97 166.82 11.1 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.377 -0.827 . . . . 0.0 110.496 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.211 0 CA-C-O 118.351 -0.833 . . . . 0.0 111.093 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.7 ttt-85 . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 120.898 0.38 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.09 -178.8 0.13 Allowed 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.806 -0.559 . . . . 0.0 110.857 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.31 -52.58 2.77 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.331 -0.856 . . . . 0.0 110.623 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.76 33.43 1.03 Allowed 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.422 -0.799 . . . . 0.0 110.987 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.9 t -120.01 -53.62 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.238 -0.914 . . . . 0.0 109.873 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -68.89 -34.49 75.51 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.403 -0.811 . . . . 0.0 110.32 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -55.98 -45.34 79.01 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.474 -0.766 . . . . 0.0 109.676 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -37.02 62.96 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.669 -0.645 . . . . 0.0 109.518 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.8 mt -65.74 -43.85 87.73 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.422 -0.799 . . . . 0.0 109.942 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.416 ' CE3' ' HG2' ' A' ' 11' ' ' GLN . 15.4 t90 -69.06 -39.53 79.06 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.477 -0.764 . . . . 0.0 109.82 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.416 ' HG2' ' CE3' ' A' ' 10' ' ' TRP . 2.4 mm100 -58.15 -42.93 86.99 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.386 -0.821 . . . . 0.0 110.071 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.23 -22.04 16.47 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.438 -0.789 . . . . 0.0 110.971 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.558 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -86.73 -57.33 3.02 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.295 -0.878 . . . . 0.0 110.721 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -81.39 -43.74 18.55 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.502 -0.749 . . . . 0.0 111.971 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.06 -38.82 62.8 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.174 -0.954 . . . . 0.0 110.291 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.512 ' O ' HG22 ' A' ' 20' ' ' VAL . 10.3 t90 -70.45 -49.54 47.55 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.483 -0.76 . . . . 0.0 109.206 179.031 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -57.77 -45.96 85.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.689 -0.632 . . . . 0.0 109.919 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.482 ' HB3' HD12 ' A' ' 22' ' ' LEU . 3.7 m95 -65.12 -37.12 86.45 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.431 -0.793 . . . . 0.0 110.187 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -42.56 94.58 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.233 -0.917 . . . . 0.0 110.637 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 16' ' ' TRP . 33.5 m -87.23 -6.03 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.126 -0.984 . . . . 0.0 111.516 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.6 m -107.95 -38.6 5.77 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.931 -1.106 . . . . 0.0 110.829 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.482 HD12 ' HB3' ' A' ' 18' ' ' TRP . 16.9 mt -95.66 -16.02 22.32 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.356 -0.84 . . . . 0.0 111.332 -179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.14 67.18 2.71 Favored Pre-proline 0 N--CA 1.499 1.996 0 O-C-N 121.194 -0.941 . . . . 0.0 110.418 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.59 110.19 2.82 Favored 'Trans proline' 0 C--N 1.312 -1.346 0 O-C-N 123.635 1.334 . . . . 0.0 110.646 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 67.71 160.16 0.16 Allowed 'General case' 0 N--CA 1.504 2.249 0 CA-C-O 121.489 0.662 . . . . 0.0 111.147 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.97 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.42 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.221 0.534 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.465 ' O ' ' HB3' ' A' ' 3' ' ' ALA . 2.4 t -101.94 -3.6 27.54 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.342 -0.849 . . . . 0.0 111.258 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 2' ' ' SER . . . 61.33 9.19 2.44 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.49 -0.757 . . . . 0.0 111.47 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.0 mt -129.88 -0.55 4.77 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.008 -1.057 . . . . 0.0 111.173 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.9 t -89.98 -52.37 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.077 -1.015 . . . . 0.0 109.926 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -64.71 -38.81 92.25 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.459 -0.776 . . . . 0.0 110.468 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.5 p -57.21 -48.09 79.66 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.433 -0.792 . . . . 0.0 109.675 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -65.22 -39.49 92.83 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.675 -0.641 . . . . 0.0 109.341 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 9' ' ' LEU . 1.1 mm? -65.38 -49.21 70.17 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.665 -0.647 . . . . 0.0 109.932 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.5 t90 -62.51 -45.7 91.78 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.703 -0.623 . . . . 0.0 110.132 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.36 -40.61 74.81 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.386 -0.821 . . . . 0.0 109.782 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -39.87 81.56 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.7 -0.625 . . . . 0.0 110.328 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.539 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -57.46 -60.08 4.19 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.728 -0.607 . . . . 0.0 110.417 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.505 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 13.1 mt-10 -71.73 -28.11 63.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.504 -0.747 . . . . 0.0 111.059 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -54.12 -50.71 66.26 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.347 -0.846 . . . . 0.0 109.53 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.503 ' O ' HG22 ' A' ' 20' ' ' VAL . 9.3 t90 -68.81 -41.59 78.45 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.366 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.505 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 34.2 t80 -57.43 -55.38 35.6 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.63 -0.669 . . . . 0.0 109.761 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -64.64 -35.27 80.49 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.431 -0.793 . . . . 0.0 110.059 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -56.02 -48.44 75.96 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.36 -0.838 . . . . 0.0 110.717 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 16' ' ' TRP . 30.6 m -87.06 -25.06 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 O-C-N 121.231 -0.918 . . . . 0.0 111.188 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.3 m -76.23 -39.67 53.96 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.2 -0.937 . . . . 0.0 110.334 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.4 mt -86.6 -8.79 57.2 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.533 -0.73 . . . . 0.0 110.923 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.484 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -59.96 -54.14 58.4 Favored Pre-proline 0 N--CA 1.499 2.019 0 O-C-N 121.252 -0.905 . . . . 0.0 110.873 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.484 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 52.2 Cg_endo -80.83 63.16 8.74 Favored 'Trans proline' 0 C--N 1.319 -1.017 0 O-C-N 123.442 1.233 . . . . 0.0 110.736 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -103.43 -48.2 4.06 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.177 -0.952 . . . . 0.0 110.551 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 118.127 -0.939 . . . . 0.0 110.807 -179.814 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.496 1.861 0 CA-C-O 121.042 0.449 . . . . 0.0 110.359 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.492 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.3 OUTLIER -137.72 166.35 24.18 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.506 -0.746 . . . . 0.0 110.379 179.858 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.84 -46.76 3.31 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.354 -0.841 . . . . 0.0 111.013 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.7 mp -105.02 13.41 30.96 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.28 -0.888 . . . . 0.0 111.215 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.492 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 98.6 t -111.93 -52.11 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.139 -0.976 . . . . 0.0 110.119 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.443 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.1 OUTLIER -69.73 -21.53 63.46 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.425 -0.797 . . . . 0.0 110.828 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.5 p -52.6 -35.63 54.7 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.426 -0.796 . . . . 0.0 110.451 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.4 ' CD2' HD22 ' A' ' 9' ' ' LEU . 8.0 t80 -99.59 -32.36 11.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.558 -0.714 . . . . 0.0 109.862 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 1.3 mm? -69.25 -35.89 76.59 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.428 -0.795 . . . . 0.0 110.743 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 22.8 t90 -57.66 -48.48 79.38 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.497 -0.752 . . . . 0.0 110.404 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -47.89 82.2 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.482 -0.761 . . . . 0.0 110.033 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -37.54 84.56 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.471 -0.768 . . . . 0.0 110.045 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.457 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -58.69 -57.24 13.88 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 121.572 0.701 . . . . 0.0 109.992 179.504 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.406 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 14.2 mt-10 -71.5 -30.32 65.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.843 -0.535 . . . . 0.0 110.873 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -53.35 -49.16 67.71 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.315 -0.866 . . . . 0.0 109.531 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.42 ' O ' HG22 ' A' ' 20' ' ' VAL . 7.9 t90 -69.02 -43.87 73.87 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.553 -0.717 . . . . 0.0 109.202 178.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.406 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 90.3 t80 -57.6 -56.28 23.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.741 -0.599 . . . . 0.0 110.125 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.572 ' HB3' HD12 ' A' ' 22' ' ' LEU . 13.2 m95 -60.88 -34.77 75.13 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.469 -0.77 . . . . 0.0 110.049 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -60.71 -42.36 97.06 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.497 -0.752 . . . . 0.0 110.772 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 16' ' ' TRP . 28.2 m -94.69 -10.04 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.321 -0.862 . . . . 0.0 111.341 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.9 m -95.99 -38.56 10.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.09 -1.006 . . . . 0.0 110.513 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.572 HD12 ' HB3' ' A' ' 18' ' ' TRP . 46.8 mt -84.01 -16.86 42.44 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.469 -0.769 . . . . 0.0 111.084 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.495 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.73 -53.58 42.61 Favored Pre-proline 0 N--CA 1.499 2.023 0 O-C-N 121.304 -0.873 . . . . 0.0 110.631 179.723 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 45.4 Cg_endo -71.77 158.39 53.26 Favored 'Trans proline' 0 N--CA 1.486 1.084 0 O-C-N 123.455 1.239 . . . . 0.0 110.592 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -92.51 -39.15 11.54 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.625 -0.672 . . . . 0.0 110.518 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 . . . . . 0 N--CA 1.497 1.886 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.335 -179.997 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 121.219 0.533 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.496 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.1 OUTLIER -122.83 142.87 50.28 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.249 -0.907 . . . . 0.0 110.458 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -70.34 -32.02 69.55 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.445 -0.784 . . . . 0.0 110.847 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tp -91.17 -0.58 57.73 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.406 -0.809 . . . . 0.0 111.309 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.496 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 93.3 t -123.7 -47.06 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.07 -1.019 . . . . 0.0 110.399 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.633 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 63.7 t30 -69.15 -17.9 63.88 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.437 -0.789 . . . . 0.0 111.271 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -52.07 -51.29 58.58 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.179 -0.95 . . . . 0.0 109.961 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -73.68 -40.9 63.32 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.489 -0.757 . . . . 0.0 109.584 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.633 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 30.0 mt -59.06 -37.8 77.89 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.598 -0.689 . . . . 0.0 110.452 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -67.82 -48.99 64.67 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.498 -0.751 . . . . 0.0 110.16 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -64.11 -42.64 96.8 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.413 -0.804 . . . . 0.0 110.132 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -24.82 67.14 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.446 -0.784 . . . . 0.0 110.248 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.504 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -85.46 -54.5 4.53 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.437 -0.789 . . . . 0.0 110.146 179.826 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.673 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 8.1 mt-10 -69.83 -23.79 63.36 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.627 -0.671 . . . . 0.0 111.529 -179.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -52.26 -55.1 23.47 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.072 -1.018 . . . . 0.0 109.423 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -67.76 -41.28 83.55 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.566 -0.709 . . . . 0.0 109.461 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.673 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 29.9 t80 -56.21 -54.96 39.06 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.784 -0.573 . . . . 0.0 110.439 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.409 ' CD1' ' HB3' ' A' ' 14' ' ' GLU . 21.1 m95 -61.35 -41.06 96.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.372 -0.83 . . . . 0.0 110.478 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -53.92 -42.98 69.35 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.312 -0.868 . . . . 0.0 111.502 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.404 HG22 ' H ' ' A' ' 20' ' ' VAL . 33.4 m -89.79 -22.13 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.136 -0.977 . . . . 0.0 111.018 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 64.5 m -82.08 -26.65 33.46 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.112 -0.992 . . . . 0.0 110.444 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 71.1 mt -82.68 -13.1 57.02 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.359 -0.838 . . . . 0.0 110.844 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.534 ' HB2' ' HD3' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -63.73 -53.06 53.58 Favored Pre-proline 0 N--CA 1.499 1.975 0 O-C-N 121.231 -0.918 . . . . 0.0 110.834 179.802 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.534 ' HD3' ' HB2' ' A' ' 23' ' ' ARG . 46.6 Cg_endo -72.04 179.68 4.68 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 O-C-N 123.5 1.263 . . . . 0.0 110.91 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 168.82 8.01 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.471 -0.768 . . . . 0.0 110.732 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.539 ' CZ ' ' HB2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 117.863 -1.065 . . . . 0.0 110.219 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.9 ptt-85 . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 121.149 0.499 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.0 t -91.16 -177.37 4.87 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.38 -0.825 . . . . 0.0 110.233 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.98 -46.14 2.54 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.483 -0.761 . . . . 0.0 110.702 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 mt -86.9 18.55 3.44 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.287 -0.883 . . . . 0.0 111.374 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.5 t -106.49 -56.28 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.065 -1.022 . . . . 0.0 109.752 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -66.61 -39.53 88.4 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.446 -0.784 . . . . 0.0 110.249 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 t -56.73 -52.75 63.77 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.299 -0.876 . . . . 0.0 109.268 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -60.77 -44.02 97.29 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.657 -0.652 . . . . 0.0 109.283 178.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 9' ' ' LEU . 9.1 mt -59.03 -41.52 88.02 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.883 -0.511 . . . . 0.0 110.225 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 40.2 t90 -62.61 -48.43 79.44 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.479 -0.763 . . . . 0.0 110.226 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -58.16 -36.72 73.43 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.387 -0.821 . . . . 0.0 110.282 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -69.97 -37.94 75.94 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.424 -0.798 . . . . 0.0 110.123 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.511 ' CD1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -58.51 -41.72 86.07 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.546 -0.721 . . . . 0.0 109.326 179.577 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.511 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 45.5 mt-10 -67.24 -48.31 68.17 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.478 -0.764 . . . . 0.0 109.375 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -56.22 -49.21 74.76 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.816 -0.553 . . . . 0.0 109.612 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 8.8 t90 -62.37 -47.11 85.64 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.654 -0.654 . . . . 0.0 109.397 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -57.83 -51.39 69.8 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.7 -0.625 . . . . 0.0 109.827 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.465 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 3.7 m95 -63.52 -30.0 71.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.418 -0.801 . . . . 0.0 110.351 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -40.84 75.58 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.096 -1.003 . . . . 0.0 110.428 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 22.3 m -88.56 -26.97 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.229 -0.92 . . . . 0.0 110.773 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 90.5 m -84.31 -48.33 9.83 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.286 -0.884 . . . . 0.0 110.472 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.433 HD11 ' CE3' ' A' ' 18' ' ' TRP . 50.3 mt -89.59 -44.09 10.32 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.397 -0.814 . . . . 0.0 109.998 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 51.34 67.62 4.05 Favored Pre-proline 0 N--CA 1.5 2.05 0 O-C-N 121.958 -0.464 . . . . 0.0 110.898 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.79 163.47 38.78 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 123.673 1.354 . . . . 0.0 110.714 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -107.94 42.16 1.41 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.424 -0.798 . . . . 0.0 110.355 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? . . . . . 0 N--CA 1.503 2.176 0 CA-C-O 118.083 -0.96 . . . . 0.0 111.065 179.754 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.857 0 CA-C-O 121.125 0.488 . . . . 0.0 110.51 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 t -147.86 175.33 11.04 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.447 -0.783 . . . . 0.0 110.557 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.95 -31.56 72.78 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.648 -0.658 . . . . 0.0 110.595 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 4' ' ' LEU . 3.3 mm? -74.16 -33.6 63.55 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.272 -0.893 . . . . 0.0 110.209 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.3 t -65.63 -49.87 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.586 -0.696 . . . . 0.0 110.274 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -62.82 -37.02 85.11 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.53 -0.731 . . . . 0.0 110.465 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.1 t -58.62 -46.32 87.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.306 -0.871 . . . . 0.0 109.611 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.492 ' CZ ' ' HD2' ' A' ' 12' ' ' ARG . 21.7 t80 -67.5 -43.84 79.91 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.569 -0.707 . . . . 0.0 109.305 178.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.67 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 1.4 mm? -60.86 -44.84 96.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.67 -0.644 . . . . 0.0 110.241 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.415 ' CE3' ' HG2' ' A' ' 11' ' ' GLN . 17.9 t90 -61.17 -40.69 94.83 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.635 -0.666 . . . . 0.0 110.079 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.474 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -57.0 -45.4 83.03 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.438 -0.789 . . . . 0.0 110.155 179.799 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.67 ' HD3' ' HA ' ' A' ' 9' ' ' LEU . 29.5 mtp85 -54.37 -41.83 69.62 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.754 -0.591 . . . . 0.0 110.409 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.485 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -54.37 -60.05 3.86 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.392 0.615 . . . . 0.0 110.051 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -68.51 -31.39 70.61 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.593 -0.692 . . . . 0.0 110.544 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -52.83 -43.83 66.28 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.448 -0.783 . . . . 0.0 109.579 179.197 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.512 ' O ' HG22 ' A' ' 20' ' ' VAL . 10.9 t90 -68.63 -47.09 67.51 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -57.28 -52.14 66.53 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.804 -0.56 . . . . 0.0 109.679 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.436 ' HE3' ' HA ' ' A' ' 18' ' ' TRP . 5.0 m95 -63.19 -33.3 75.18 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.33 -0.856 . . . . 0.0 110.151 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.518 ' HA ' ' HD2' ' A' ' 24' ' ' PRO . 5.0 m-20 -64.12 -41.0 97.4 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.453 -0.78 . . . . 0.0 110.681 179.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 16' ' ' TRP . 35.7 m -93.83 -18.84 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.224 -0.922 . . . . 0.0 111.21 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.1 m -91.84 -53.35 4.32 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.002 -1.061 . . . . 0.0 109.925 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.3 mt -83.56 -16.37 45.64 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.498 -0.751 . . . . 0.0 110.56 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 50.83 60.28 15.0 Favored Pre-proline 0 N--CA 1.501 2.106 0 O-C-N 121.668 -0.645 . . . . 0.0 110.866 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.518 ' HD2' ' HA ' ' A' ' 19' ' ' ASN . 48.5 Cg_endo -73.25 155.36 51.63 Favored 'Trans proline' 0 C--N 1.313 -1.333 0 O-C-N 123.57 1.3 . . . . 0.0 110.556 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -89.47 150.0 22.68 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.569 -0.707 . . . . 0.0 110.267 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.499 1.982 0 CA-C-O 118.55 -0.738 . . . . 0.0 110.85 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.499 1.978 0 CA-C-O 121.075 0.464 . . . . 0.0 110.665 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -165.6 149.77 8.36 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.281 -0.887 . . . . 0.0 110.36 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -94.99 -26.87 15.91 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.509 -0.744 . . . . 0.0 110.906 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.61 21.83 16.13 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.222 -0.924 . . . . 0.0 110.964 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.0 t -111.64 -36.44 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.249 -0.907 . . . . 0.0 110.006 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -98.22 -36.66 9.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.274 -0.891 . . . . 0.0 110.047 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.3 m -57.6 -52.79 63.99 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.602 -0.686 . . . . 0.0 110.747 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.663 ' CZ ' HD13 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -66.11 -27.86 68.37 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.377 -0.827 . . . . 0.0 110.149 179.632 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.663 HD13 ' CZ ' ' A' ' 8' ' ' TYR . 3.0 tp -70.55 -41.44 72.48 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.513 -0.742 . . . . 0.0 109.575 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.5 t90 -60.53 -47.38 86.41 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.506 -0.746 . . . . 0.0 109.371 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -60.05 -37.05 78.68 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.454 -0.779 . . . . 0.0 109.901 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.6 mtp85 -63.09 -39.15 93.87 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.501 -0.749 . . . . 0.0 110.159 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.459 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -63.2 -46.73 85.66 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.608 -0.682 . . . . 0.0 109.495 179.513 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.451 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 4.3 mt-10 -70.19 -36.63 74.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.408 -0.807 . . . . 0.0 109.699 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.43 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.3 OUTLIER -57.36 -48.96 77.67 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 178.628 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.5 t90 -69.76 -41.63 74.92 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.615 -0.678 . . . . 0.0 109.194 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.459 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 57.8 t80 -55.15 -58.93 5.68 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.704 -0.622 . . . . 0.0 109.416 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 23.7 m95 -61.4 -33.2 73.28 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.511 -0.743 . . . . 0.0 110.111 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 2.2 t30 -54.4 -37.51 65.12 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.487 -0.758 . . . . 0.0 110.463 179.306 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -102.91 -27.52 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.49 -0.756 . . . . 0.0 110.782 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 99.9 m -73.2 -39.12 65.82 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.251 -0.906 . . . . 0.0 110.862 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.422 ' HA ' HD23 ' A' ' 22' ' ' LEU . 45.7 mt -62.42 -34.98 77.83 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.511 -0.743 . . . . 0.0 110.929 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -121.02 79.7 33.79 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.286 -0.884 . . . . 0.0 110.278 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -76.87 70.62 6.47 Favored 'Trans proline' 0 C--N 1.315 -1.199 0 O-C-N 123.739 1.389 . . . . 0.0 110.27 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -116.43 -164.72 0.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.354 -0.842 . . . . 0.0 110.34 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 tpt85 . . . . . 0 N--CA 1.496 1.85 0 CA-C-O 118.361 -0.828 . . . . 0.0 110.272 179.888 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 9.2 ttp-105 . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 121.268 0.556 . . . . 0.0 110.075 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.589 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 1.2 m -143.22 130.33 20.74 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.317 -0.865 . . . . 0.0 110.496 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -106.56 -34.64 7.3 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.599 -0.688 . . . . 0.0 110.689 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -106.01 -13.42 15.48 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.395 -0.816 . . . . 0.0 111.438 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.589 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 59.5 t -68.26 -50.44 57.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 121.214 -0.929 . . . . 0.0 110.059 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -65.08 -37.85 88.87 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.469 -0.769 . . . . 0.0 110.087 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.3 m -61.92 -44.41 96.83 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.319 -0.863 . . . . 0.0 109.728 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -60.79 -41.31 95.33 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.551 -0.718 . . . . 0.0 109.308 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.36 -39.41 71.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.699 -0.625 . . . . 0.0 109.996 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -64.63 -47.47 78.43 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.637 -0.665 . . . . 0.0 110.097 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -54.84 -40.42 69.6 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.369 -0.832 . . . . 0.0 110.363 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -41.59 87.08 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.561 -0.712 . . . . 0.0 110.341 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.409 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -59.55 -46.87 87.61 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.343 -0.848 . . . . 0.0 109.557 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 2.8 mt-10 -70.88 -37.77 73.06 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.343 -0.848 . . . . 0.0 110.038 179.316 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -46.84 72.01 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.544 -0.723 . . . . 0.0 109.546 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -64.35 -45.95 85.58 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.524 -0.735 . . . . 0.0 109.335 178.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.41 ' CZ ' HG21 ' A' ' 21' ' ' THR . 82.4 t80 -52.46 -47.49 66.44 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.781 -0.575 . . . . 0.0 109.664 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 22.2 m95 -63.14 -38.05 89.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.579 -0.701 . . . . 0.0 110.147 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -54.79 -35.43 63.85 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.223 -0.923 . . . . 0.0 110.94 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.4 m -106.72 -2.78 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.075 -1.015 . . . . 0.0 111.617 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.41 HG21 ' CZ ' ' A' ' 17' ' ' PHE . 82.2 m -113.37 -16.81 12.41 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.033 -1.042 . . . . 0.0 111.341 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.3 mt -59.61 -34.96 73.43 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.2 -0.937 . . . . 0.0 110.645 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.8 ttm105 58.02 75.8 0.51 Allowed Pre-proline 0 N--CA 1.499 1.993 0 O-C-N 121.865 -0.522 . . . . 0.0 110.554 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.77 171.86 16.48 Favored 'Trans proline' 0 C--N 1.315 -1.23 0 O-C-N 123.841 1.443 . . . . 0.0 110.926 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -78.59 -38.08 40.9 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.571 -0.706 . . . . 0.0 110.544 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 . . . . . 0 N--CA 1.501 2.076 0 CA-C-O 118.188 -0.91 . . . . 0.0 110.949 -179.864 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.8 mtt180 . . . . . 0 N--CA 1.495 1.793 0 CA-C-O 121.074 0.464 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.419 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.4 OUTLIER -73.27 147.97 44.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.408 -0.807 . . . . 0.0 110.359 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -106.47 -40.87 5.45 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.592 -0.693 . . . . 0.0 110.873 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.95 10.7 11.06 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.299 -0.876 . . . . 0.0 111.446 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.525 HG12 HD12 ' A' ' 9' ' ' LEU . 70.9 t -99.35 -50.4 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.098 -1.002 . . . . 0.0 109.586 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.29 -37.67 88.32 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.537 -0.727 . . . . 0.0 110.417 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.6 p -58.15 -53.15 61.47 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.452 -0.78 . . . . 0.0 109.421 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 32.1 t80 -65.39 -39.39 92.16 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.525 HD12 HG12 ' A' ' 5' ' ' VAL . 12.5 mt -60.43 -34.82 74.51 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.712 -0.618 . . . . 0.0 109.851 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -73.55 -40.4 63.99 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.463 -0.773 . . . . 0.0 109.654 178.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.454 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.95 -36.21 78.77 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.556 -0.715 . . . . 0.0 109.945 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -55.29 -39.44 69.88 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.56 -0.713 . . . . 0.0 110.328 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.506 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -56.26 -61.03 2.67 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-O 121.387 0.613 . . . . 0.0 110.506 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.5 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 20.1 mt-10 -69.53 -30.44 68.27 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.578 -0.701 . . . . 0.0 110.823 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -52.38 -49.48 64.34 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.377 -0.827 . . . . 0.0 109.41 179.29 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.475 ' O ' HG22 ' A' ' 20' ' ' VAL . 15.8 t90 -69.2 -43.61 73.81 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.548 -0.72 . . . . 0.0 109.461 178.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.5 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 34.5 t80 -55.92 -55.36 33.52 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.658 -0.651 . . . . 0.0 109.578 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 40.1 m95 -63.05 -33.22 74.98 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.478 -0.764 . . . . 0.0 110.112 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 16.5 t-20 -59.02 -39.45 81.95 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.509 -0.744 . . . . 0.0 110.901 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.475 HG22 ' O ' ' A' ' 16' ' ' TRP . 28.2 m -101.63 2.65 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 O-C-N 121.246 -0.909 . . . . 0.0 111.257 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.6 m -106.2 -38.36 6.28 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.089 -1.007 . . . . 0.0 110.472 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.476 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 80.2 mt -66.17 -58.2 5.94 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.464 -0.772 . . . . 0.0 110.386 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.476 ' HD3' ' HB3' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -165.38 81.51 1.16 Allowed Pre-proline 0 N--CA 1.497 1.913 0 O-C-N 121.485 -0.759 . . . . 0.0 110.236 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.439 ' HB3' ' HA ' ' A' ' 20' ' ' VAL . 47.7 Cg_endo -72.28 175.6 9.76 Favored 'Trans proline' 0 C--N 1.313 -1.316 0 O-C-N 123.932 1.491 . . . . 0.0 110.884 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER 60.99 178.17 0.1 Allowed 'General case' 0 N--CA 1.505 2.275 0 CA-C-O 121.286 0.565 . . . . 0.0 111.002 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.035 0 O-C-N 121.27 -0.894 . . . . 0.0 110.834 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.879 0 CA-C-O 121.061 0.458 . . . . 0.0 110.443 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -119.0 162.22 18.91 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.462 -0.774 . . . . 0.0 109.921 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -90.78 -40.23 11.92 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.42 -0.8 . . . . 0.0 110.556 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.4 tp -91.73 21.83 4.52 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.285 -0.884 . . . . 0.0 110.882 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.9 t -124.12 -46.0 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.207 -0.933 . . . . 0.0 110.356 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.451 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 3.4 p30 -72.91 -23.06 60.66 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.34 -0.85 . . . . 0.0 110.85 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -50.71 -55.77 15.06 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.407 -0.808 . . . . 0.0 110.796 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -74.37 -42.97 58.42 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.463 -0.773 . . . . 0.0 109.858 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 9.0 mt -56.12 -40.08 73.2 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.66 -0.65 . . . . 0.0 110.782 -179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -72.32 -48.82 39.07 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.383 -0.823 . . . . 0.0 110.044 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 6.1 tp60 -63.04 -54.72 33.73 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.416 -0.802 . . . . 0.0 110.652 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.23 -38.23 39.48 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.457 -0.777 . . . . 0.0 110.812 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.534 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -59.89 -57.8 11.32 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.429 -0.794 . . . . 0.0 110.798 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -77.35 -42.52 36.26 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.712 -0.617 . . . . 0.0 111.469 -178.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -53.42 -43.36 67.9 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.18 -0.95 . . . . 0.0 109.588 179.619 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.49 ' CD1' HG21 ' A' ' 20' ' ' VAL . 28.2 t90 -69.17 -46.04 68.51 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.455 -0.778 . . . . 0.0 109.13 178.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -59.18 -43.78 92.17 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.497 -0.752 . . . . 0.0 110.156 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.488 ' O ' HD12 ' A' ' 22' ' ' LEU . 3.9 m95 -75.21 -13.67 60.47 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.409 -0.807 . . . . 0.0 111.064 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -101.68 -24.48 14.09 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.849 -1.157 . . . . 0.0 110.659 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.49 HG21 ' CD1' ' A' ' 16' ' ' TRP . 48.0 t -105.89 -40.9 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.294 -0.879 . . . . 0.0 111.037 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.2 m -77.86 -34.35 51.76 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.196 -0.94 . . . . 0.0 111.141 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.488 HD12 ' O ' ' A' ' 18' ' ' TRP . 31.0 mt -71.56 -63.92 1.03 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.376 -0.827 . . . . 0.0 110.033 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? 48.57 63.45 10.34 Favored Pre-proline 0 N--CA 1.502 2.17 0 O-C-N 121.853 -0.529 . . . . 0.0 110.925 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -77.4 82.96 2.25 Favored 'Trans proline' 0 C--N 1.315 -1.188 0 O-C-N 123.643 1.339 . . . . 0.0 110.489 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 54.3 40.06 31.41 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.548 -0.72 . . . . 0.0 110.744 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.9 mtm-85 . . . . . 0 N--CA 1.496 1.874 0 CA-C-O 117.927 -1.035 . . . . 0.0 110.464 179.945 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 121.299 0.571 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.08 148.61 40.42 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.214 -0.929 . . . . 0.0 110.267 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.79 -10.6 21.63 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.613 -0.679 . . . . 0.0 111.082 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.9 tp -101.31 2.3 39.57 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.221 -0.924 . . . . 0.0 110.972 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.4 t -106.32 -57.1 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.255 -0.903 . . . . 0.0 109.866 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -62.93 -42.5 99.82 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.56 -0.713 . . . . 0.0 110.442 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.3 t -58.42 -47.61 83.37 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.403 -0.81 . . . . 0.0 109.533 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -66.53 -40.37 89.09 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.746 -0.596 . . . . 0.0 109.705 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.458 ' HA ' HD22 ' A' ' 9' ' ' LEU . 0.6 OUTLIER -54.74 -36.98 65.36 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.685 -0.634 . . . . 0.0 110.669 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -83.15 -45.97 13.29 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.376 -0.828 . . . . 0.0 109.925 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.98 -48.09 83.45 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.422 -0.799 . . . . 0.0 110.177 -179.865 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.25 -39.34 69.66 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.46 -0.775 . . . . 0.0 110.008 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.505 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -55.76 -60.82 2.91 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.373 0.606 . . . . 0.0 110.349 179.633 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -70.86 -31.16 67.76 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.84 -0.538 . . . . 0.0 110.856 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.446 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 15.2 t-20 -50.74 -46.36 59.21 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.422 -0.799 . . . . 0.0 109.62 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.636 ' NE1' HG21 ' A' ' 20' ' ' VAL . 6.7 t90 -73.04 -44.57 60.59 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.506 -0.746 . . . . 0.0 109.177 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -55.18 -45.06 75.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.538 -0.726 . . . . 0.0 109.99 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.525 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -73.51 -43.33 60.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.421 -0.799 . . . . 0.0 110.193 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -62.73 -36.14 82.04 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.361 -0.837 . . . . 0.0 110.82 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.636 HG21 ' NE1' ' A' ' 16' ' ' TRP . 90.2 t -84.01 -36.65 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.216 -0.927 . . . . 0.0 110.78 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.3 m -78.91 -42.51 26.96 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.126 -0.984 . . . . 0.0 110.722 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 18' ' ' TRP . 12.4 mt -86.79 -27.56 23.5 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.38 -0.825 . . . . 0.0 110.721 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 6.3 ttt-85 55.74 71.66 1.19 Allowed Pre-proline 0 N--CA 1.5 2.05 0 O-C-N 121.73 -0.606 . . . . 0.0 110.518 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -73.46 149.87 45.26 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 O-C-N 123.726 1.382 . . . . 0.0 110.794 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -96.32 -51.47 4.37 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.685 -0.634 . . . . 0.0 110.223 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.228 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 120.98 0.419 . . . . 0.0 110.473 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.484 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.2 OUTLIER -127.24 172.34 10.67 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.47 -0.769 . . . . 0.0 110.536 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -91.1 -42.12 10.66 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.491 -0.756 . . . . 0.0 110.706 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.44 14.25 31.78 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.423 -0.798 . . . . 0.0 111.112 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.484 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 40.7 t -121.49 -49.09 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.189 -0.944 . . . . 0.0 109.869 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.43 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.9 OUTLIER -64.95 -31.25 72.39 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.397 -0.814 . . . . 0.0 110.68 179.825 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -54.15 -46.64 72.33 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.417 -0.802 . . . . 0.0 109.774 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -71.43 -40.14 70.59 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.548 -0.72 . . . . 0.0 109.578 178.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.451 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.9 mm? -61.69 -48.73 79.47 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.587 -0.696 . . . . 0.0 109.833 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -65.9 -39.57 90.74 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.49 -0.756 . . . . 0.0 109.515 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -60.82 -43.26 98.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.476 -0.765 . . . . 0.0 110.189 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -24.48 53.57 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.579 -0.701 . . . . 0.0 110.974 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.549 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -78.16 -60.6 2.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.256 -0.903 . . . . 0.0 110.236 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -71.36 -28.89 64.37 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.521 -0.737 . . . . 0.0 111.382 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 2.4 t-20 -53.31 -51.52 62.07 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.174 -0.954 . . . . 0.0 109.539 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -65.33 -43.75 89.97 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -55.59 -59.26 5.09 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.709 -0.619 . . . . 0.0 109.808 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 6.9 m95 -60.53 -33.12 72.19 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.368 -0.832 . . . . 0.0 110.346 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -57.04 -39.94 75.8 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.308 -0.87 . . . . 0.0 110.217 179.511 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.547 ' HA ' ' HB3' ' A' ' 24' ' ' PRO . 27.1 m -95.53 -29.44 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.317 -0.865 . . . . 0.0 110.499 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 94.2 m -68.95 -42.41 76.72 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.209 -0.932 . . . . 0.0 109.987 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.4 mt -80.58 -69.37 0.6 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.486 -0.759 . . . . 0.0 110.237 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -154.86 97.41 2.49 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.443 -0.785 . . . . 0.0 109.975 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.547 ' HB3' ' HA ' ' A' ' 20' ' ' VAL . 44.2 Cg_endo -72.38 126.21 11.41 Favored 'Trans proline' 0 C--N 1.313 -1.3 0 O-C-N 123.912 1.48 . . . . 0.0 110.779 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -94.45 -59.37 1.96 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.499 -0.75 . . . . 0.0 110.197 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.292 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 . . . . . 0 N--CA 1.495 1.813 0 CA-C-O 121.24 0.543 . . . . 0.0 110.09 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.635 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.4 OUTLIER -142.6 144.18 32.73 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.459 -0.775 . . . . 0.0 110.33 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -104.2 -44.62 4.92 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.67 -0.643 . . . . 0.0 110.73 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.31 -37.22 15.07 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.403 -0.811 . . . . 0.0 110.754 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.635 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 84.6 t -58.22 -41.62 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.527 -0.733 . . . . 0.0 110.128 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -62.7 -37.43 86.46 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.531 -0.731 . . . . 0.0 110.209 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.9 m -58.94 -49.75 76.64 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.387 -0.821 . . . . 0.0 109.406 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -65.02 -45.87 83.73 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.672 -0.642 . . . . 0.0 109.356 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -58.29 -43.95 88.27 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.718 -0.614 . . . . 0.0 109.875 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -67.54 -42.9 81.96 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.584 -0.698 . . . . 0.0 109.509 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.48 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 19.5 mm-40 -64.67 -50.94 65.06 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.516 -0.74 . . . . 0.0 110.126 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -53.17 -34.96 59.13 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.503 -0.748 . . . . 0.0 110.347 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.498 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -61.3 -55.26 33.78 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.565 -0.709 . . . . 0.0 110.676 179.814 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -78.9 -42.71 26.48 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.699 -0.626 . . . . 0.0 111.363 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -55.6 -38.3 69.24 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.467 -0.771 . . . . 0.0 110.301 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -63.66 -49.0 74.91 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.412 -0.805 . . . . 0.0 109.453 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -56.22 -51.01 69.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.708 -0.62 . . . . 0.0 109.79 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.525 ' HB3' HD12 ' A' ' 22' ' ' LEU . 30.9 m95 -63.41 -31.83 73.09 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.525 -0.735 . . . . 0.0 110.769 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.15 -41.76 97.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.299 -0.876 . . . . 0.0 110.51 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.6 m -89.76 -14.42 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.326 -0.858 . . . . 0.0 110.969 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.2 m -92.76 -35.41 13.45 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.124 -0.985 . . . . 0.0 110.636 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 18' ' ' TRP . 31.7 mt -91.87 -86.82 0.22 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.313 -0.867 . . . . 0.0 110.326 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.8 ttt180 -166.36 116.28 0.77 Allowed Pre-proline 0 N--CA 1.495 1.786 0 O-C-N 121.316 -0.865 . . . . 0.0 110.237 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.51 142.7 49.78 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.865 1.455 . . . . 0.0 110.664 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -96.41 -55.67 2.86 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.686 -0.634 . . . . 0.0 110.202 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.117 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.026 0.441 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.35 147.4 42.22 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.432 -0.793 . . . . 0.0 110.307 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.35 -38.11 5.57 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.469 -0.769 . . . . 0.0 110.835 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.13 13.35 6.35 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.32 -0.863 . . . . 0.0 111.525 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.8 t -100.74 -39.09 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.077 -1.014 . . . . 0.0 110.343 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -90.8 -37.88 13.35 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.238 -0.914 . . . . 0.0 110.584 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.9 t -58.56 -52.51 65.37 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.481 -0.762 . . . . 0.0 110.783 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.579 ' CE1' HD13 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -63.07 -30.84 71.91 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.369 -0.832 . . . . 0.0 110.266 179.907 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.579 HD13 ' CE1' ' A' ' 8' ' ' TYR . 3.6 tp -67.59 -46.94 71.17 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.368 -0.832 . . . . 0.0 109.732 179.092 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.439 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 4.0 t-105 -60.02 -37.24 79.16 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.621 -0.674 . . . . 0.0 109.379 179.101 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.515 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.64 -46.81 88.9 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.568 -0.707 . . . . 0.0 109.592 179.053 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.41 -39.24 56.85 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.74 -0.6 . . . . 0.0 110.483 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.516 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -59.42 -57.46 12.91 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.598 -0.689 . . . . 0.0 110.645 -179.914 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -75.48 -40.0 57.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.598 -0.689 . . . . 0.0 111.603 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -51.86 -43.33 63.21 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.304 -0.873 . . . . 0.0 110.179 -179.825 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.1 t90 -66.61 -48.9 68.06 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.413 -0.804 . . . . 0.0 109.24 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -56.59 -51.76 67.4 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.796 -0.565 . . . . 0.0 109.877 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.405 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.3 m95 -63.87 -30.42 71.51 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.528 -0.732 . . . . 0.0 110.428 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.486 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 8.7 t-20 -65.14 -46.45 80.87 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.268 -0.895 . . . . 0.0 110.65 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.5 m -86.36 -26.05 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.283 -0.885 . . . . 0.0 111.133 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.7 m -78.81 -36.96 41.89 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.215 -0.928 . . . . 0.0 110.648 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.405 HD12 ' HB3' ' A' ' 18' ' ' TRP . 60.9 mt -89.31 -26.24 21.22 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.333 -0.854 . . . . 0.0 110.838 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 12.6 mtt85 57.56 91.1 0.08 OUTLIER Pre-proline 0 N--CA 1.502 2.165 0 O-C-N 121.817 -0.552 . . . . 0.0 111.019 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.76 119.18 6.14 Favored 'Trans proline' 0 C--N 1.314 -1.25 0 O-C-N 123.674 1.355 . . . . 0.0 110.05 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 55.08 64.26 1.85 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.728 -0.608 . . . . 0.0 110.026 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 . . . . . 0 N--CA 1.502 2.149 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.686 -179.721 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.776 0 CA-C-O 121.256 0.551 . . . . 0.0 110.182 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.6 m -144.04 158.26 43.82 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.388 -0.82 . . . . 0.0 110.25 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.27 99.21 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.544 -0.722 . . . . 0.0 110.317 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.67 -35.02 67.61 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.455 -0.778 . . . . 0.0 110.366 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.0 t -70.38 -48.01 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.447 -0.783 . . . . 0.0 110.157 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.509 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 1.3 t-20 -65.47 -36.08 82.82 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.542 -0.724 . . . . 0.0 110.508 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.1 t -57.1 -44.29 83.05 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.47 -0.769 . . . . 0.0 109.968 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -77.96 -37.27 47.88 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.449 -0.782 . . . . 0.0 109.598 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 12.3 mt -56.5 -41.87 77.37 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.677 -0.639 . . . . 0.0 110.281 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.45 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 4.5 t-105 -58.79 -42.95 90.27 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.447 -0.783 . . . . 0.0 109.584 179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -61.5 -44.36 97.2 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.435 -0.79 . . . . 0.0 109.433 179.129 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -54.59 -39.15 67.56 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.712 -0.618 . . . . 0.0 110.144 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.521 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -56.79 -60.05 4.13 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.39 0.614 . . . . 0.0 110.248 179.747 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.66 -33.49 72.66 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.556 -0.715 . . . . 0.0 110.567 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -52.19 -43.74 64.33 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.475 -0.766 . . . . 0.0 109.838 179.437 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.524 ' O ' HG22 ' A' ' 20' ' ' VAL . 7.0 t90 -70.06 -45.53 66.89 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.54 -0.725 . . . . 0.0 109.224 178.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -58.81 -48.76 80.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.826 -0.546 . . . . 0.0 109.748 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.519 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -67.5 -33.84 75.93 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.454 -0.779 . . . . 0.0 110.019 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 19.9 t-20 -64.46 -45.01 89.27 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.335 -0.853 . . . . 0.0 110.549 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 16' ' ' TRP . 29.9 m -85.08 -24.63 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.21 -0.932 . . . . 0.0 111.263 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 65.9 m -84.46 -40.35 17.83 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.065 -1.022 . . . . 0.0 110.469 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.519 HD12 ' HB3' ' A' ' 18' ' ' TRP . 10.9 mt -96.55 -22.19 17.23 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.435 -0.791 . . . . 0.0 110.829 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 52.92 65.88 5.45 Favored Pre-proline 0 N--CA 1.5 2.061 0 O-C-N 121.663 -0.648 . . . . 0.0 110.488 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.8 91.76 0.8 Allowed 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.718 1.378 . . . . 0.0 110.914 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -112.3 139.12 48.12 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 110.217 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.915 0 CA-C-O 118.268 -0.873 . . . . 0.0 110.615 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.0 ttm180 . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 121.033 0.444 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.52 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 0.4 OUTLIER -162.77 175.65 11.08 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.582 -0.699 . . . . 0.0 110.179 -179.947 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.01 -38.98 8.76 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.361 -0.837 . . . . 0.0 110.75 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 mt -106.31 9.32 31.98 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.375 -0.828 . . . . 0.0 111.515 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.52 ' HB ' ' HB2' ' A' ' 2' ' ' SER . 78.5 t -108.83 -56.81 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.04 -1.038 . . . . 0.0 109.644 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -65.2 -38.92 91.99 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.63 -0.669 . . . . 0.0 110.165 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.1 t -58.07 -47.75 82.22 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.459 -0.776 . . . . 0.0 109.654 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -69.26 -41.87 76.32 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.55 -0.718 . . . . 0.0 109.836 179.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.89 -40.41 95.31 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.54 -0.725 . . . . 0.0 110.528 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.7 t90 -66.2 -46.88 75.75 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.337 -0.852 . . . . 0.0 110.154 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -37.58 67.74 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.339 -0.851 . . . . 0.0 110.222 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -32.4 68.87 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.569 -0.707 . . . . 0.0 110.394 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.74 -44.89 88.68 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.458 -0.776 . . . . 0.0 109.983 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -70.2 -39.94 74.89 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.327 -0.858 . . . . 0.0 109.964 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.53 -48.26 77.63 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.498 -0.751 . . . . 0.0 109.282 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -68.74 -42.57 77.39 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.597 -0.689 . . . . 0.0 109.452 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.3 -57.84 10.85 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.711 -0.618 . . . . 0.0 110.207 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.473 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.6 m95 -59.52 -37.12 77.51 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.332 -0.855 . . . . 0.0 110.428 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -56.35 -44.91 80.53 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.505 -0.747 . . . . 0.0 110.821 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.5 m -92.74 -31.78 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.3 -0.875 . . . . 0.0 110.976 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.8 m -69.74 -32.19 70.59 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.184 -0.947 . . . . 0.0 110.264 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.473 HD12 ' HB3' ' A' ' 18' ' ' TRP . 10.4 mt -105.4 -103.3 0.32 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.441 -0.787 . . . . 0.0 109.367 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.741 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER 173.91 -55.48 0.0 OUTLIER Pre-proline 0 N--CA 1.503 2.179 0 O-C-N 121.541 -0.724 . . . . 0.0 110.483 179.346 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.741 ' HD3' ' HB3' ' A' ' 23' ' ' ARG . 53.8 Cg_endo -79.82 -171.77 1.34 Allowed 'Trans proline' 0 N--CA 1.487 1.112 0 O-C-N 123.286 1.15 . . . . 0.0 110.953 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.6 166.85 22.08 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.507 -0.746 . . . . 0.0 110.158 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.304 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 27.2 ttt85 . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 120.979 0.418 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.39 -166.26 0.16 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.686 -0.634 . . . . 0.0 110.7 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -114.58 -50.44 2.79 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.153 -0.967 . . . . 0.0 110.89 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.16 26.64 3.19 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.316 -0.865 . . . . 0.0 111.036 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 52.5 t -106.25 -53.99 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.16 -0.962 . . . . 0.0 109.682 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.422 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.6 OUTLIER -65.88 -35.68 81.33 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.449 -0.782 . . . . 0.0 110.165 179.495 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.9 p -59.68 -48.79 80.27 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.453 -0.78 . . . . 0.0 109.24 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -66.62 -37.73 85.47 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.644 -0.66 . . . . 0.0 109.221 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 9' ' ' LEU . 11.5 mt -58.75 -44.78 90.63 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.717 -0.614 . . . . 0.0 109.963 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.7 t90 -62.85 -45.75 91.1 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.645 -0.659 . . . . 0.0 109.366 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -39.79 74.07 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.514 -0.741 . . . . 0.0 110.011 179.567 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -63.54 -39.75 95.23 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.622 -0.674 . . . . 0.0 110.385 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -45.69 92.73 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.475 -0.766 . . . . 0.0 109.72 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -72.69 -39.05 67.33 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.252 -0.905 . . . . 0.0 109.726 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.63 -42.91 68.29 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.602 -0.686 . . . . 0.0 109.86 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -70.39 -45.12 66.6 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.453 -0.779 . . . . 0.0 109.297 179.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -55.47 -45.88 76.91 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.69 -0.631 . . . . 0.0 109.65 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 25.6 m95 -72.84 -36.52 67.48 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.613 -0.679 . . . . 0.0 109.958 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -53.99 -43.43 69.98 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.547 -0.721 . . . . 0.0 110.651 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.528 ' HA ' ' CD ' ' A' ' 23' ' ' ARG . 28.8 m -84.46 -27.93 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.374 -0.829 . . . . 0.0 110.896 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.8 m -80.54 -24.54 39.22 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.219 -0.926 . . . . 0.0 110.917 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.3 -3.53 47.23 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.305 -0.872 . . . . 0.0 111.366 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.528 ' CD ' ' HA ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -48.47 -55.37 19.48 Favored Pre-proline 0 N--CA 1.504 2.246 0 O-C-N 121.394 -0.816 . . . . 0.0 111.237 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 46.8 Cg_endo -71.95 98.56 0.9 Allowed 'Trans proline' 0 N--CA 1.486 1.04 0 O-C-N 123.468 1.246 . . . . 0.0 110.375 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.21 -167.23 0.98 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.466 -0.771 . . . . 0.0 110.559 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.749 0 O-C-N 121.318 -0.864 . . . . 0.0 110.268 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 28.9 ttp85 . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 120.992 0.425 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.656 ' O ' ' HB3' ' A' ' 3' ' ' ALA . 48.7 m 54.29 -114.09 0.84 Allowed 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.771 -0.581 . . . . 0.0 110.597 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 2' ' ' SER . . . 74.32 -48.53 0.66 Allowed 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.545 -0.722 . . . . 0.0 110.641 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.7 mt -114.3 9.81 17.03 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.28 -0.887 . . . . 0.0 110.596 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.8 t -116.67 -47.64 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.27 -0.894 . . . . 0.0 109.689 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.94 -34.05 30.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.429 -0.794 . . . . 0.0 110.408 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.6 m -52.72 -48.09 66.9 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.462 -0.774 . . . . 0.0 110.232 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -70.03 -43.14 71.93 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.464 -0.773 . . . . 0.0 109.519 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 9' ' ' LEU . 9.1 mt -59.57 -43.46 93.59 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.678 -0.639 . . . . 0.0 110.12 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -62.51 -44.94 95.14 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.637 -0.665 . . . . 0.0 110.032 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -59.08 -41.33 87.76 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.283 -0.886 . . . . 0.0 110.103 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -39.49 94.92 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.607 -0.683 . . . . 0.0 110.364 179.39 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -45.43 93.49 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.471 -0.768 . . . . 0.0 109.94 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -72.59 -34.87 67.72 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.233 -0.917 . . . . 0.0 109.956 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -54.31 -47.74 72.1 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.524 -0.735 . . . . 0.0 109.521 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -74.16 -41.93 60.72 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.519 -0.738 . . . . 0.0 109.582 179.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -55.36 -47.99 74.91 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.544 -0.723 . . . . 0.0 110.427 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 21.1 m95 -72.53 -33.42 66.85 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.447 -0.783 . . . . 0.0 110.379 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -58.96 -30.57 68.0 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.364 -0.835 . . . . 0.0 110.774 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.6 m -100.12 -19.94 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.236 -0.915 . . . . 0.0 110.835 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.4 m -88.91 -27.05 21.24 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.237 -0.914 . . . . 0.0 110.782 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.3 mt -83.96 -22.38 31.47 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.269 -0.894 . . . . 0.0 110.969 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.518 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -59.72 -52.96 70.17 Favored Pre-proline 0 N--CA 1.499 2.001 0 O-C-N 121.454 -0.779 . . . . 0.0 110.841 -179.889 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.518 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 50.8 Cg_endo -87.26 22.38 0.93 Allowed 'Trans proline' 0 C--N 1.32 -0.971 0 O-C-N 123.478 1.251 . . . . 0.0 111.496 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.0 -177.32 0.08 Allowed 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.405 -0.809 . . . . 0.0 111.308 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.627 -179.789 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.122 0.486 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.656 ' HB3' HG23 ' A' ' 5' ' ' VAL . 0.1 OUTLIER -81.25 141.43 34.13 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.405 -0.809 . . . . 0.0 110.621 -179.907 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -72.57 -22.98 60.91 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.551 -0.718 . . . . 0.0 111.044 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -84.87 6.43 24.8 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.201 -0.937 . . . . 0.0 111.408 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.656 HG23 ' HB3' ' A' ' 2' ' ' SER . 95.2 t -101.51 -50.22 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 121.112 -0.993 . . . . 0.0 109.999 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -74.42 -40.78 61.77 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.498 -0.751 . . . . 0.0 110.624 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 m -54.65 -52.32 62.66 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.36 -0.837 . . . . 0.0 109.747 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -62.73 -42.65 99.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.521 -0.737 . . . . 0.0 109.386 178.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.431 ' HA ' HD23 ' A' ' 9' ' ' LEU . 8.6 mt -58.76 -44.76 90.67 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.634 -0.666 . . . . 0.0 109.901 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -64.81 -42.86 94.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.712 -0.617 . . . . 0.0 109.673 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -61.19 -39.58 90.72 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.289 -0.882 . . . . 0.0 110.312 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -37.27 86.95 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.402 -0.811 . . . . 0.0 110.275 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.424 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -65.79 -46.35 79.02 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.369 -0.832 . . . . 0.0 109.596 179.653 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.413 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 3.9 mt-10 -68.62 -35.25 77.06 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.399 -0.813 . . . . 0.0 109.932 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 2.3 t-20 -55.83 -53.22 59.38 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.56 -0.713 . . . . 0.0 109.227 178.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.4 ' O ' HG22 ' A' ' 20' ' ' VAL . 9.2 t90 -65.85 -42.25 90.68 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.676 -0.64 . . . . 0.0 109.396 178.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.424 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 55.4 t80 -54.87 -57.53 11.22 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.715 -0.616 . . . . 0.0 109.828 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.415 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 16.3 m95 -64.52 -32.91 74.75 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.368 -0.832 . . . . 0.0 110.185 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 3.6 t30 -55.92 -35.31 66.45 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.455 -0.778 . . . . 0.0 110.491 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 16' ' ' TRP . 30.1 m -104.33 -9.59 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.283 -0.885 . . . . 0.0 111.002 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.415 ' HB ' ' HA ' ' A' ' 18' ' ' TRP . 67.1 m -93.44 -33.05 13.97 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.188 -0.945 . . . . 0.0 110.496 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.3 mt -82.35 -20.02 38.1 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.407 -0.808 . . . . 0.0 110.911 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.584 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -63.62 -52.86 55.86 Favored Pre-proline 0 N--CA 1.498 1.942 0 O-C-N 121.363 -0.836 . . . . 0.0 111.017 -179.767 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 23' ' ' ARG . 52.5 Cg_endo -78.34 50.85 3.49 Favored 'Trans proline' 0 N--CA 1.488 1.2 0 O-C-N 123.37 1.195 . . . . 0.0 110.627 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -166.05 160.75 16.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.253 -0.905 . . . . 0.0 110.161 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 117.828 -1.082 . . . . 0.0 110.4 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.815 0 CA-C-O 121.05 0.452 . . . . 0.0 110.103 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 t -75.51 148.74 38.72 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.385 -0.822 . . . . 0.0 110.006 179.682 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.46 -4.8 16.06 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.46 -0.775 . . . . 0.0 111.321 -179.775 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.6 mt -117.9 -4.73 11.08 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.002 -1.061 . . . . 0.0 111.303 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 58.9 t -114.96 -53.86 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.082 -1.011 . . . . 0.0 110.175 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -85.65 -13.76 47.62 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.507 -0.745 . . . . 0.0 111.324 -179.726 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.53 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -63.86 -57.56 9.47 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.044 -1.035 . . . . 0.0 110.006 179.636 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -69.68 -14.74 62.96 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.316 -0.865 . . . . 0.0 111.158 179.69 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -95.82 -28.51 14.7 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.15 -0.969 . . . . 0.0 111.217 -179.595 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -99.84 -48.47 4.68 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.165 -0.959 . . . . 0.0 110.917 -179.656 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.53 ' HB2' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -55.02 -32.74 62.05 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.266 -0.896 . . . . 0.0 110.843 -179.542 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -61.09 -38.15 85.24 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.327 -0.858 . . . . 0.0 110.114 179.395 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.412 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -59.78 -45.14 93.22 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.646 -0.659 . . . . 0.0 109.553 179.7 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.412 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 21.7 mt-10 -69.18 -35.76 76.61 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.394 -0.816 . . . . 0.0 109.897 179.485 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -49.5 67.41 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.518 -0.739 . . . . 0.0 109.338 179.109 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -69.67 -43.19 73.02 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.492 -0.755 . . . . 0.0 109.279 178.738 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.76 -53.18 60.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.749 -0.595 . . . . 0.0 110.182 179.848 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -64.42 -36.46 84.23 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.299 -0.876 . . . . 0.0 110.197 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -58.49 -34.24 70.7 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.472 -0.767 . . . . 0.0 111.271 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.4 m -103.17 -27.66 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.206 -0.934 . . . . 0.0 111.115 -179.746 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.7 m -77.42 -41.65 39.09 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.163 -0.96 . . . . 0.0 110.768 -179.632 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.7 mt -67.7 -35.27 78.5 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.427 -0.796 . . . . 0.0 110.47 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -131.86 88.58 41.44 Favored Pre-proline 0 N--CA 1.493 1.677 0 O-C-N 121.51 -0.744 . . . . 0.0 110.08 179.782 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.8 151.63 57.48 Favored 'Trans proline' 0 C--N 1.312 -1.349 0 O-C-N 123.825 1.434 . . . . 0.0 110.721 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.42 155.25 43.03 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.713 -0.617 . . . . 0.0 110.416 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.893 0 CA-C-O 117.774 -1.108 . . . . 0.0 110.688 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 121.255 0.55 . . . . 0.0 110.039 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.515 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.4 OUTLIER -149.33 148.74 29.87 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.282 -0.886 . . . . 0.0 110.321 -179.892 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.06 -32.47 6.56 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.438 -0.789 . . . . 0.0 111.257 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 mp -105.64 14.83 27.85 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.117 -0.989 . . . . 0.0 111.438 -179.536 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 54.2 t -98.12 -33.42 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 O-C-N 121.132 -0.98 . . . . 0.0 109.912 179.345 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -87.27 -26.45 23.45 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.249 -0.907 . . . . 0.0 110.284 179.39 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 57.7 m -61.25 -56.0 25.62 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.526 -0.734 . . . . 0.0 110.718 -179.9 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.485 ' CZ ' HD13 ' A' ' 9' ' ' LEU . 1.2 p90 -67.2 -26.6 66.7 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.259 -0.901 . . . . 0.0 110.388 179.89 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' A' ' 9' ' ' LEU . 1.4 tp -60.32 -42.86 96.48 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.327 -0.858 . . . . 0.0 109.836 178.949 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.605 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -78.06 -36.92 47.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.361 -0.837 . . . . 0.0 109.841 179.378 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -66.66 -47.6 71.99 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.403 -0.811 . . . . 0.0 109.727 179.385 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' A' ' 16' ' ' TRP . 9.1 tmm_? -59.07 -17.23 24.05 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.487 -0.758 . . . . 0.0 110.337 178.982 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.457 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -83.42 -58.42 2.84 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.314 -0.866 . . . . 0.0 109.888 179.431 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -82.31 -47.69 12.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.811 -0.555 . . . . 0.0 111.515 -178.742 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -53.65 -40.12 65.61 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.164 -0.96 . . . . 0.0 110.284 -179.696 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.469 ' HB3' ' O ' ' A' ' 12' ' ' ARG . 9.1 t90 -75.26 -48.51 22.95 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.313 -0.867 . . . . 0.0 109.561 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -57.18 -49.74 75.03 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.597 -0.69 . . . . 0.0 110.309 -179.596 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.709 ' CE3' HD12 ' A' ' 22' ' ' LEU . 4.9 m95 -65.53 -35.43 80.82 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.187 -0.946 . . . . 0.0 110.033 179.664 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.607 ' HA ' ' HD2' ' A' ' 24' ' ' PRO . 5.3 t30 -71.66 -36.49 70.67 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.09 -1.006 . . . . 0.0 110.641 179.546 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.4 p -89.93 -20.65 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.383 -0.823 . . . . 0.0 111.07 -179.732 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.1 m -107.78 -59.21 1.87 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.199 -0.938 . . . . 0.0 110.202 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.709 HD12 ' CE3' ' A' ' 18' ' ' TRP . 3.1 mt -67.61 -31.19 71.06 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.505 -0.747 . . . . 0.0 110.352 179.624 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 53.29 63.11 8.72 Favored Pre-proline 0 N--CA 1.501 2.104 0 O-C-N 121.769 -0.582 . . . . 0.0 111.02 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.607 ' HD2' ' HA ' ' A' ' 19' ' ' ASN . 49.1 Cg_endo -73.52 170.84 19.01 Favored 'Trans proline' 0 C--N 1.315 -1.197 0 O-C-N 123.78 1.41 . . . . 0.0 110.627 179.67 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 57.55 -158.41 0.27 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.746 -0.596 . . . . 0.0 110.835 179.717 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.2 tpt85 . . . . . 0 N--CA 1.494 1.744 0 O-C-N 121.194 -0.941 . . . . 0.0 110.125 -179.924 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.9 mtt85 . . . . . 0 N--CA 1.495 1.798 0 CA-C-O 120.945 0.402 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.8 m -142.67 158.38 43.72 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.487 -0.758 . . . . 0.0 110.503 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -97.36 -35.35 10.73 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.63 -0.669 . . . . 0.0 110.521 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 tp -89.48 15.13 9.8 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.279 -0.888 . . . . 0.0 111.179 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 79.1 t -107.81 -53.66 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.017 -1.052 . . . . 0.0 109.527 179.564 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -69.32 -43.84 72.93 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.648 -0.657 . . . . 0.0 110.078 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.0 m -58.08 -46.84 84.78 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.294 -0.879 . . . . 0.0 109.384 179.057 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -59.67 -44.66 93.51 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.782 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 9' ' ' LEU . 0.3 OUTLIER -67.59 -43.86 79.49 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.738 -0.601 . . . . 0.0 109.975 179.551 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.476 ' CE3' ' HG3' ' A' ' 11' ' ' GLN . 19.1 t90 -61.94 -45.11 95.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.668 -0.645 . . . . 0.0 109.665 179.403 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.476 ' HG3' ' CE3' ' A' ' 10' ' ' TRP . 5.0 mt-30 -58.12 -39.11 77.87 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.486 -0.759 . . . . 0.0 110.244 179.692 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.8 mmt-85 -64.7 -42.96 94.93 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.491 -0.756 . . . . 0.0 110.367 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -44.87 91.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.441 -0.787 . . . . 0.0 109.998 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -74.17 -35.89 64.03 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.225 -0.922 . . . . 0.0 110.223 179.54 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -55.45 -47.78 75.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.39 -0.818 . . . . 0.0 109.781 179.472 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.4 t90 -67.08 -46.07 75.42 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.587 -0.696 . . . . 0.0 109.361 179.043 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -55.14 -52.4 63.42 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.723 -0.61 . . . . 0.0 109.723 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.408 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.3 m95 -66.79 -31.13 71.56 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.484 -0.76 . . . . 0.0 110.065 179.384 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 4.3 t30 -57.98 -46.24 85.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.409 -0.807 . . . . 0.0 110.152 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.432 HG22 ' H ' ' A' ' 20' ' ' VAL . 30.0 m -84.99 -25.89 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.349 -0.845 . . . . 0.0 110.608 179.589 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.408 ' HB ' ' HA ' ' A' ' 18' ' ' TRP . 55.2 m -74.37 -37.64 63.41 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.248 -0.907 . . . . 0.0 110.231 179.713 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.6 mt -84.33 -36.23 22.7 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.501 -0.749 . . . . 0.0 110.373 179.93 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -141.95 82.25 13.76 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.426 -0.796 . . . . 0.0 110.34 179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.66 152.5 69.86 Favored 'Trans proline' 0 C--N 1.314 -1.26 0 O-C-N 123.543 1.286 . . . . 0.0 110.787 179.846 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -94.31 -54.33 3.59 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.688 -0.632 . . . . 0.0 110.429 -179.84 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 117.884 -1.055 . . . . 0.0 110.26 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.0 ptp180 . . . . . 0 N--CA 1.497 1.906 0 CA-C-O 121.074 0.464 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.9 -168.07 2.83 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.544 -0.723 . . . . 0.0 110.234 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -111.26 -53.28 2.72 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.303 -0.873 . . . . 0.0 110.582 -179.755 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.1 pp -107.78 0.02 21.96 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.338 -0.851 . . . . 0.0 111.126 -179.977 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.9 t -101.34 -54.13 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.173 -0.954 . . . . 0.0 109.763 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -68.7 -40.94 79.79 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.579 -0.701 . . . . 0.0 110.365 179.98 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 t -55.39 -48.7 73.93 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.365 -0.834 . . . . 0.0 109.585 179.615 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -60.65 -43.65 97.35 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.606 -0.684 . . . . 0.0 109.488 178.983 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.05 -43.18 88.26 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.561 -0.712 . . . . 0.0 109.822 179.604 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.44 ' CE3' ' HG3' ' A' ' 11' ' ' GLN . 12.3 t90 -65.79 -42.65 90.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.645 -0.659 . . . . 0.0 109.931 179.492 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.44 ' HG3' ' CE3' ' A' ' 10' ' ' TRP . 6.5 mt-30 -54.14 -46.28 72.21 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.385 -0.822 . . . . 0.0 110.352 179.869 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -64.36 -33.49 75.97 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.655 -0.653 . . . . 0.0 110.8 -179.923 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.512 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -66.85 -44.55 80.72 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.31 -0.869 . . . . 0.0 110.402 -179.63 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.512 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 6.3 mt-10 -75.94 -49.97 16.26 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.193 -0.942 . . . . 0.0 110.922 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.1 -39.5 59.87 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.329 -0.857 . . . . 0.0 110.185 179.893 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.1 t90 -77.16 -45.29 27.23 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.385 -0.822 . . . . 0.0 109.534 179.035 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -55.65 -53.99 49.71 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.628 -0.67 . . . . 0.0 110.033 -179.981 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.6 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.1 m95 -59.97 -33.07 71.45 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.22 -0.925 . . . . 0.0 110.075 179.384 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -38.13 80.57 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.424 -0.798 . . . . 0.0 110.995 179.666 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.9 m -103.93 -25.87 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 O-C-N 121.409 -0.807 . . . . 0.0 111.348 -179.391 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.1 m -82.78 -48.37 10.89 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.094 -1.004 . . . . 0.0 110.757 -179.511 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.6 HD12 ' HB3' ' A' ' 18' ' ' TRP . 49.4 mt -79.71 -75.34 0.26 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.427 -0.796 . . . . 0.0 110.207 179.981 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 ttp180 51.33 74.06 0.86 Allowed Pre-proline 0 N--CA 1.501 2.075 0 O-C-N 121.686 -0.634 . . . . 0.0 110.511 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -79.03 68.43 8.28 Favored 'Trans proline' 0 C--N 1.316 -1.17 0 O-C-N 123.805 1.423 . . . . 0.0 110.67 -179.742 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 51.57 58.81 5.09 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.557 -0.714 . . . . 0.0 110.679 179.919 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.501 -179.843 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 120.981 0.42 . . . . 0.0 110.323 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.424 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.1 OUTLIER -148.75 154.26 39.33 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.54 -0.725 . . . . 0.0 110.316 179.934 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.08 -34.8 10.25 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.541 -0.725 . . . . 0.0 110.759 -179.743 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.38 -21.88 35.68 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.262 -0.899 . . . . 0.0 111.128 -179.878 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 75.7 t -70.09 -46.52 72.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.278 -0.889 . . . . 0.0 110.092 179.989 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -61.72 -37.54 84.55 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.461 -0.775 . . . . 0.0 110.203 179.737 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.4 t -62.66 -46.96 85.77 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -0.839 . . . . 0.0 110.059 179.48 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.05 -39.38 83.04 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.444 -0.785 . . . . 0.0 109.806 179.607 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.451 ' HA ' HD22 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -67.33 -44.31 79.41 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.433 -0.792 . . . . 0.0 109.963 179.336 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.502 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 3.5 t-105 -60.81 -37.75 83.05 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.647 -0.658 . . . . 0.0 110.252 179.721 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.1 -49.76 73.2 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.298 -0.877 . . . . 0.0 109.648 179.573 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -35.86 75.99 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.611 -0.681 . . . . 0.0 109.825 179.037 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.462 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -55.53 -50.81 68.99 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.722 0.772 . . . . 0.0 109.803 179.146 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -78.44 -31.74 48.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.859 -0.526 . . . . 0.0 110.168 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.428 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -49.52 -49.17 47.09 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.601 -0.687 . . . . 0.0 109.818 179.413 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.468 ' O ' HG12 ' A' ' 20' ' ' VAL . 6.1 t90 -72.52 -44.58 62.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.624 -0.673 . . . . 0.0 109.297 178.973 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -53.8 -48.9 69.37 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.839 -0.538 . . . . 0.0 110.148 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 5.8 m95 -70.2 -39.45 75.18 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.391 -0.818 . . . . 0.0 109.74 179.391 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 7.7 t-20 -62.45 -55.69 25.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.309 -0.869 . . . . 0.0 110.38 179.595 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.468 HG12 ' O ' ' A' ' 16' ' ' TRP . 8.6 p -66.52 -22.66 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.334 -0.853 . . . . 0.0 111.641 -179.828 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.1 m -90.79 -36.25 14.37 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.002 -1.061 . . . . 0.0 110.921 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.6 mt -88.59 -39.85 13.8 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.333 -0.854 . . . . 0.0 110.594 -179.674 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -152.98 91.49 3.43 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 121.547 -0.721 . . . . 0.0 110.126 -179.766 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -74.51 70.36 4.92 Favored 'Trans proline' 0 C--N 1.315 -1.208 0 O-C-N 123.777 1.409 . . . . 0.0 111.135 -179.595 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -96.88 -42.6 7.86 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.317 -0.864 . . . . 0.0 109.852 179.508 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.174 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 120.913 0.387 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.8 t 55.57 -149.42 0.45 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.671 -0.643 . . . . 0.0 110.627 -179.805 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.93 -53.92 0.16 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.318 -0.864 . . . . 0.0 110.612 -179.807 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.63 4.38 43.27 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.387 -0.821 . . . . 0.0 111.297 -179.775 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 78.8 t -100.28 -56.41 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 121.092 -1.005 . . . . 0.0 109.781 179.773 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.514 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.3 OUTLIER -65.23 -34.85 79.33 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.544 -0.723 . . . . 0.0 110.478 179.727 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.0 m -56.08 -47.66 77.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.459 -0.775 . . . . 0.0 109.41 179.377 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -70.77 -39.39 73.24 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.725 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.514 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 15.1 mt -57.53 -45.95 84.41 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.562 -0.711 . . . . 0.0 109.847 179.582 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.7 t90 -73.9 -48.14 32.98 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.629 -0.669 . . . . 0.0 109.768 179.335 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -56.74 -40.24 75.4 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.408 -0.808 . . . . 0.0 110.385 -179.817 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.63 -38.05 86.25 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.487 -0.758 . . . . 0.0 110.384 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.409 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -65.37 -47.97 74.56 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.357 -0.84 . . . . 0.0 109.213 179.463 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 3.1 mt-10 -69.52 -31.25 69.37 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.535 -0.728 . . . . 0.0 109.848 179.158 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -55.35 -49.53 72.0 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.424 -0.797 . . . . 0.0 108.866 178.601 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.58 ' NE1' HG21 ' A' ' 20' ' ' VAL . 14.3 t90 -70.1 -42.35 72.82 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.576 -0.702 . . . . 0.0 109.236 178.59 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -54.22 -31.8 54.18 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.624 -0.672 . . . . 0.0 110.874 179.728 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.525 ' HB3' HD12 ' A' ' 22' ' ' LEU . 24.1 m95 -102.91 -43.22 5.59 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.363 -0.835 . . . . 0.0 110.972 -179.601 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -57.51 -37.78 73.56 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.247 -0.908 . . . . 0.0 111.098 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.58 HG21 ' NE1' ' A' ' 16' ' ' TRP . 89.8 t -65.88 -32.86 60.04 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.238 -0.914 . . . . 0.0 110.316 179.907 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.9 m -93.68 -22.58 18.66 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.534 -0.729 . . . . 0.0 111.029 -179.81 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 18' ' ' TRP . 78.2 mt -95.78 -2.56 47.42 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.255 -0.903 . . . . 0.0 111.309 -179.629 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.469 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -51.88 -52.0 65.44 Favored Pre-proline 0 N--CA 1.501 2.102 0 O-C-N 121.362 -0.836 . . . . 0.0 111.302 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 47.0 Cg_endo -74.49 82.02 1.96 Allowed 'Trans proline' 0 N--CA 1.486 1.032 0 O-C-N 123.555 1.292 . . . . 0.0 110.51 179.924 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -147.11 75.52 1.38 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.343 -0.848 . . . . 0.0 110.124 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.503 2.215 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 19.7 ttp180 . . . . . 0 N--CA 1.495 1.798 0 CA-C-O 121.246 0.546 . . . . 0.0 110.104 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m -145.34 158.97 43.72 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.351 -0.843 . . . . 0.0 110.492 -179.805 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.43 -34.21 10.37 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.5 -0.75 . . . . 0.0 110.328 179.554 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 tp -88.62 8.76 26.84 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.399 -0.813 . . . . 0.0 111.231 179.998 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 63.3 t -98.15 -46.16 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.061 -1.025 . . . . 0.0 110.149 179.739 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -63.44 -41.27 98.67 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.417 -0.802 . . . . 0.0 110.633 179.842 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.6 t -57.98 -42.96 86.19 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.357 -0.839 . . . . 0.0 109.602 179.524 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.421 ' CD2' HD22 ' A' ' 9' ' ' LEU . 35.8 t80 -71.92 -39.52 69.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.372 -0.83 . . . . 0.0 109.495 178.995 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.445 HD13 ' HA ' ' A' ' 9' ' ' LEU . 1.1 mm? -70.77 -23.01 62.33 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.406 -0.809 . . . . 0.0 110.99 179.835 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.454 ' HA ' ' HD1' ' A' ' 13' ' ' TRP . 26.8 t90 -103.88 -53.69 2.71 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.357 -0.839 . . . . 0.0 110.863 -179.405 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -62.44 -49.24 76.23 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.098 -1.001 . . . . 0.0 110.889 -179.508 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -38.53 87.16 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.285 -0.884 . . . . 0.0 110.215 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.497 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -63.45 -43.93 95.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.451 -0.781 . . . . 0.0 109.504 179.48 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.494 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 48.7 mt-10 -69.29 -45.06 70.54 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.354 -0.841 . . . . 0.0 109.968 179.535 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.85 -42.56 65.32 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.384 -0.823 . . . . 0.0 109.586 179.163 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -72.66 -43.86 62.6 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.433 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.497 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 81.8 t80 -56.04 -53.81 52.49 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.72 -0.612 . . . . 0.0 109.62 179.473 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -59.28 -32.56 70.14 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.576 -0.703 . . . . 0.0 109.831 179.189 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -61.31 -35.38 77.19 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.59 -0.693 . . . . 0.0 110.769 179.435 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.7 m -111.03 7.9 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.255 -0.903 . . . . 0.0 111.519 -179.991 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.443 HG21 ' CZ ' ' A' ' 17' ' ' PHE . 97.7 m -119.04 -31.6 4.69 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.977 -1.077 . . . . 0.0 111.087 -179.857 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 22' ' ' LEU . 18.4 mt -61.17 -38.29 85.94 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.315 -0.866 . . . . 0.0 110.988 -179.806 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.434 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -70.71 -58.61 4.32 Favored Pre-proline 0 N--CA 1.499 1.975 0 O-C-N 121.488 -0.757 . . . . 0.0 111.043 -179.581 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.434 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 48.4 Cg_endo -74.18 100.91 1.35 Allowed 'Trans proline' 0 N--CA 1.487 1.133 0 O-C-N 123.48 1.253 . . . . 0.0 110.738 -179.807 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -133.98 112.06 10.92 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.447 -0.783 . . . . 0.0 109.893 179.764 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.872 0 CA-C-O 117.823 -1.084 . . . . 0.0 110.824 -179.743 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 . . . . . 0 N--CA 1.495 1.785 0 CA-C-O 121.003 0.43 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.3 m -121.77 164.49 17.34 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.586 -0.696 . . . . 0.0 110.422 179.876 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.49 -40.87 9.25 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.53 -0.731 . . . . 0.0 110.413 179.784 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.93 14.57 7.09 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.407 -0.808 . . . . 0.0 111.147 179.928 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.2 t -104.46 -54.03 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.011 -1.056 . . . . 0.0 109.793 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -72.92 -37.91 67.02 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.5 -0.75 . . . . 0.0 110.665 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.8 t -52.69 -43.59 65.69 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.142 -0.974 . . . . 0.0 110.168 -179.974 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.492 ' CZ ' ' HG3' ' A' ' 12' ' ' ARG . 33.9 t80 -79.86 -39.07 31.38 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.457 -0.777 . . . . 0.0 110.075 179.423 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.53 -35.87 78.05 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.583 -0.698 . . . . 0.0 111.186 -179.525 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -58.76 -54.56 45.68 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.267 -0.896 . . . . 0.0 110.44 -179.665 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.69 -38.39 86.69 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.39 -0.819 . . . . 0.0 110.322 179.728 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.492 ' HG3' ' CZ ' ' A' ' 8' ' ' TYR . 13.4 mmm180 -65.54 -8.73 21.24 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.198 -0.939 . . . . 0.0 111.198 179.692 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -101.81 -47.36 4.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.223 -0.923 . . . . 0.0 109.981 179.637 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -88.37 -45.86 9.65 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.919 -0.488 . . . . 0.0 110.864 -178.774 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -39.66 95.3 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.264 -0.898 . . . . 0.0 109.972 179.826 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.427 ' O ' HG22 ' A' ' 20' ' ' VAL . 9.8 t90 -72.21 -47.71 48.5 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.427 -0.796 . . . . 0.0 109.668 179.178 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -57.37 -51.71 68.29 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.68 -0.638 . . . . 0.0 110.166 -179.815 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 8.6 m95 -65.8 -33.46 75.9 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.312 -0.867 . . . . 0.0 110.465 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -60.49 -57.05 14.37 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.172 -0.955 . . . . 0.0 110.611 179.966 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.429 ' HA ' ' HG3' ' A' ' 24' ' ' PRO . 27.3 m -67.54 -22.79 29.0 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.287 -0.883 . . . . 0.0 111.252 -179.57 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 86.7 m -87.89 -31.06 19.67 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.086 -1.009 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.1 mt -81.64 -69.19 0.63 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.275 -0.891 . . . . 0.0 110.214 -179.93 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.33 83.54 0.74 Allowed Pre-proline 0 N--CA 1.498 1.928 0 O-C-N 121.599 -0.688 . . . . 0.0 110.15 -179.759 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.429 ' HG3' ' HA ' ' A' ' 20' ' ' VAL . 49.3 Cg_endo -74.94 179.38 6.12 Favored 'Trans proline' 0 C--N 1.314 -1.258 0 O-C-N 123.872 1.459 . . . . 0.0 110.822 -179.985 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.497 ' O ' ' HB2' ' A' ' 26' ' ' ARG . 1.3 mt-10 -66.32 -37.98 86.62 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.469 -0.769 . . . . 0.0 110.162 179.627 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.497 ' HB2' ' O ' ' A' ' 25' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.504 2.227 0 CA-C-O 117.587 -1.197 . . . . 0.0 110.679 179.972 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 . . . . . 0 N--CA 1.497 1.922 0 CA-C-O 121.073 0.463 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.0 t -129.25 165.39 21.48 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.07 -1.019 . . . . 0.0 110.458 179.844 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -97.69 -45.29 6.42 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.505 -0.747 . . . . 0.0 110.41 -179.951 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 pp -57.36 -25.26 59.17 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.549 -0.72 . . . . 0.0 111.258 -179.924 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.4 t -65.93 -50.15 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.291 -0.881 . . . . 0.0 109.551 179.396 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -66.02 -36.64 83.81 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.515 -0.741 . . . . 0.0 110.021 179.46 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 71.7 m -54.38 -54.91 34.24 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.442 -0.786 . . . . 0.0 109.67 179.546 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -61.61 -44.25 97.34 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.655 -0.653 . . . . 0.0 109.437 178.915 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 9' ' ' LEU . 9.6 mt -57.05 -41.12 78.12 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.628 -0.67 . . . . 0.0 110.308 179.69 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.472 ' HA ' ' HD1' ' A' ' 13' ' ' TRP . 28.5 t90 -68.47 -39.33 81.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.472 -0.768 . . . . 0.0 109.988 179.395 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -64.33 -36.63 84.76 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.383 -0.823 . . . . 0.0 110.824 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -39.8 61.06 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.297 -0.877 . . . . 0.0 110.658 -179.807 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.472 ' HD1' ' HA ' ' A' ' 10' ' ' TRP . 0.0 OUTLIER -60.05 -45.5 92.65 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.32 -0.862 . . . . 0.0 110.02 179.952 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.431 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 3.0 mt-10 -65.16 -42.94 93.27 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.308 -0.87 . . . . 0.0 110.264 179.836 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.06 -36.19 70.24 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.513 -0.742 . . . . 0.0 110.174 179.483 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -71.33 -47.07 58.83 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.448 -0.782 . . . . 0.0 109.298 179.272 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -55.89 -53.12 60.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.629 -0.669 . . . . 0.0 110.051 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 6.1 m95 -59.86 -31.08 69.43 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.352 -0.843 . . . . 0.0 110.697 179.604 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -31.69 72.33 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.352 -0.843 . . . . 0.0 111.283 179.945 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.2 m -106.28 -25.28 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.072 -1.017 . . . . 0.0 111.387 -179.665 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.8 m -82.11 -35.61 28.4 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.131 -0.981 . . . . 0.0 111.29 -179.278 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.68 -17.02 58.1 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.307 -0.871 . . . . 0.0 111.562 -179.533 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.1 ttm-85 57.26 64.53 4.24 Favored Pre-proline 0 N--CA 1.501 2.083 0 O-C-N 121.511 -0.743 . . . . 0.0 110.606 -179.786 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -74.31 65.13 5.41 Favored 'Trans proline' 0 C--N 1.316 -1.142 0 O-C-N 123.831 1.437 . . . . 0.0 110.542 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -158.76 -60.08 0.07 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.294 -0.879 . . . . 0.0 110.29 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.5 mtm105 . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 118.066 -0.968 . . . . 0.0 110.202 -179.828 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 121.06 0.457 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -142.94 134.37 26.25 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.413 -0.804 . . . . 0.0 110.273 179.95 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.54 8.78 19.37 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.624 -0.672 . . . . 0.0 111.136 179.822 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -121.23 4.63 10.3 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.035 -1.041 . . . . 0.0 111.392 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.5 t -90.33 -54.85 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.117 -0.99 . . . . 0.0 110.154 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -66.1 -38.84 89.24 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.451 -0.781 . . . . 0.0 110.737 -179.915 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.7 t -50.61 -49.76 55.78 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.232 -0.917 . . . . 0.0 110.22 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -71.84 -46.52 57.74 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.475 -0.766 . . . . 0.0 110.024 179.497 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.462 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.1 mm? -57.75 -41.82 82.67 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.458 -0.776 . . . . 0.0 110.202 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.572 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -75.0 -34.76 61.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.529 -0.732 . . . . 0.0 109.72 179.342 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -64.53 -39.36 93.62 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.529 -0.732 . . . . 0.0 110.32 179.544 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.58 -26.57 22.2 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.314 -0.866 . . . . 0.0 110.332 179.278 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.566 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -86.89 -43.59 12.31 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.564 -0.71 . . . . 0.0 110.806 179.923 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -83.62 -38.69 21.25 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.381 -0.824 . . . . 0.0 111.496 -178.507 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -50.04 -43.72 51.12 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.26 -0.9 . . . . 0.0 109.763 179.551 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.542 ' NE1' HG21 ' A' ' 20' ' ' VAL . 18.5 t90 -73.22 -44.05 60.25 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.561 -0.712 . . . . 0.0 109.086 178.622 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -55.43 -44.92 76.72 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.462 -0.774 . . . . 0.0 109.987 179.525 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -71.77 -51.01 24.84 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.42 -0.8 . . . . 0.0 110.553 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.07 -21.61 65.09 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.16 -0.962 . . . . 0.0 111.803 -179.795 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.542 HG21 ' NE1' ' A' ' 16' ' ' TRP . 99.3 t -102.09 -31.64 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 120.961 -1.087 . . . . 0.0 111.288 -179.21 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.6 m -88.59 -34.06 17.45 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.977 -1.077 . . . . 0.0 111.28 -179.446 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.9 mt -71.35 -28.64 64.2 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.175 -0.953 . . . . 0.0 110.841 -179.743 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.466 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 9.3 mtt-85 -56.06 -58.88 13.74 Favored Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 121.481 -0.762 . . . . 0.0 110.913 -179.779 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.466 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 51.3 Cg_endo -76.13 54.58 4.23 Favored 'Trans proline' 0 N--CA 1.489 1.222 0 O-C-N 123.422 1.222 . . . . 0.0 110.408 179.53 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -170.55 -47.89 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.408 -0.807 . . . . 0.0 109.818 -179.969 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 ttm180 . . . . . 0 N--CA 1.494 1.757 0 CA-C-O 117.829 -1.082 . . . . 0.0 110.363 179.904 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.766 0 CA-C-O 121.087 0.47 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.35 -175.25 0.11 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.552 -0.718 . . . . 0.0 110.947 179.99 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.25 -45.33 0.17 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.486 -0.759 . . . . 0.0 110.705 -179.729 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.69 -31.95 41.35 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.376 -0.828 . . . . 0.0 110.716 179.95 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 91.9 t -65.63 -51.57 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.503 -0.748 . . . . 0.0 110.142 -179.993 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.59 -39.44 94.4 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.579 -0.701 . . . . 0.0 110.433 179.861 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.0 t -58.56 -47.71 83.33 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.292 -0.88 . . . . 0.0 109.69 179.363 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -66.79 -41.68 87.22 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.468 -0.77 . . . . 0.0 109.451 179.011 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.9 -40.27 97.04 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.678 -0.639 . . . . 0.0 110.038 179.499 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 28.0 t90 -61.57 -44.63 96.67 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.65 -0.656 . . . . 0.0 110.264 179.695 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -34.66 78.73 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.406 -0.809 . . . . 0.0 110.501 179.863 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -37.96 77.93 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.364 -0.835 . . . . 0.0 110.4 179.707 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.468 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -60.03 -47.22 86.77 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.448 -0.783 . . . . 0.0 109.675 179.985 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.462 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 28.4 mt-10 -69.01 -38.54 79.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.264 -0.897 . . . . 0.0 109.872 179.314 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.48 -49.26 78.47 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.574 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -67.11 -42.04 85.22 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.821 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.468 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 69.3 t80 -55.07 -58.06 9.2 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.599 -0.688 . . . . 0.0 109.684 179.687 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -62.93 -34.71 78.03 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.439 -0.788 . . . . 0.0 110.177 179.484 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -53.92 -36.72 63.07 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.5 -0.75 . . . . 0.0 110.602 179.396 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.6 m -104.42 -23.74 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 121.282 -0.886 . . . . 0.0 110.975 179.839 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 58.0 m -78.09 -27.92 48.58 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.152 -0.968 . . . . 0.0 111.016 -179.874 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 22' ' ' LEU . 51.8 mt -74.47 -12.45 60.5 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.381 -0.824 . . . . 0.0 111.081 -179.941 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.2 mtt180 57.65 78.8 0.35 Allowed Pre-proline 0 N--CA 1.501 2.103 0 O-C-N 121.674 -0.641 . . . . 0.0 110.734 179.967 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -76.03 63.66 6.86 Favored 'Trans proline' 0 C--N 1.315 -1.214 0 O-C-N 123.828 1.436 . . . . 0.0 110.395 179.654 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -140.09 141.95 36.13 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.451 -0.781 . . . . 0.0 110.273 -179.899 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.868 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.463 -179.835 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 . . . . . 0 N--CA 1.495 1.778 0 CA-C-O 121.173 0.511 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.488 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 59.3 m -91.93 132.74 36.27 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.383 -0.823 . . . . 0.0 110.114 179.92 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.46 -42.52 3.65 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.516 -0.74 . . . . 0.0 110.645 -179.874 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 mp -105.93 -22.42 12.91 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.445 -0.784 . . . . 0.0 111.065 -179.704 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.488 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 94.7 t -60.75 -52.98 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.403 -0.811 . . . . 0.0 110.313 -179.542 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.421 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.7 OUTLIER -67.34 -32.85 74.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.497 -0.752 . . . . 0.0 110.378 179.741 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.6 m -57.69 -44.96 86.22 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.345 -0.847 . . . . 0.0 109.647 179.425 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -70.01 -39.88 75.56 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.513 -0.742 . . . . 0.0 109.216 178.648 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' A' ' 9' ' ' LEU . 12.3 mt -61.68 -49.83 74.93 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.745 -0.597 . . . . 0.0 109.948 179.458 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -64.49 -36.74 85.17 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.569 -0.707 . . . . 0.0 109.645 179.221 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -60.08 -44.0 95.08 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.446 -0.784 . . . . 0.0 110.19 179.441 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 ttp85 -53.57 -36.26 61.71 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.615 -0.678 . . . . 0.0 110.689 179.688 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.461 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -61.44 -59.45 5.24 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.564 -0.71 . . . . 0.0 110.227 179.97 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.569 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 8.9 mt-10 -72.87 -30.97 64.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.681 -0.637 . . . . 0.0 110.942 -179.545 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -50.57 -48.66 57.46 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.378 -0.826 . . . . 0.0 109.864 179.676 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.57 ' NE1' HG21 ' A' ' 20' ' ' VAL . 6.2 t90 -72.5 -42.12 65.2 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.528 -0.732 . . . . 0.0 109.302 178.903 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.569 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 15.9 t80 -57.72 -45.27 86.01 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.593 -0.692 . . . . 0.0 110.459 179.962 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -63.44 -57.62 9.69 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.276 -0.89 . . . . 0.0 110.895 -179.534 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.04 -27.13 68.11 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.043 -1.036 . . . . 0.0 111.716 -179.544 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.57 HG21 ' NE1' ' A' ' 16' ' ' TRP . 71.3 t -91.27 -24.88 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.062 -1.024 . . . . 0.0 111.324 -179.392 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.6 m -101.12 -38.02 8.32 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.085 -1.009 . . . . 0.0 111.338 -179.395 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 77.3 mt -63.44 -33.79 76.33 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.251 -0.906 . . . . 0.0 110.96 -179.571 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.514 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 3.7 mmm180 -60.76 -60.47 10.54 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 121.424 -0.798 . . . . 0.0 110.331 179.99 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.514 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 51.7 Cg_endo -77.35 72.36 5.99 Favored 'Trans proline' 0 N--CA 1.487 1.089 0 O-C-N 123.565 1.297 . . . . 0.0 110.223 179.169 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.39 100.43 12.2 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.325 -0.86 . . . . 0.0 110.126 -179.887 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.073 0 CA-C-O 117.886 -1.054 . . . . 0.0 110.668 -179.843 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.451 ' HG2' ' HB2' ' A' ' 6' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.864 0 CA-C-O 120.898 0.38 . . . . 0.0 110.182 . . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.659 ' O ' ' HB3' ' A' ' 3' ' ' ALA . 7.5 t -86.39 9.26 18.59 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.213 -0.929 . . . . 0.0 111.534 -179.659 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 2' ' ' SER . . . 75.46 -39.21 0.39 Allowed 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.526 -0.734 . . . . 0.0 111.736 179.912 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' A' ' 4' ' ' LEU . 1.4 mm? -108.29 14.98 24.46 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.017 -1.052 . . . . 0.0 111.402 -179.754 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.445 HG23 ' HB3' ' A' ' 2' ' ' SER . 98.3 t -112.59 -42.77 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.122 -0.986 . . . . 0.0 110.528 179.75 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.567 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 59.9 t30 -83.57 -20.99 32.79 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.207 -0.933 . . . . 0.0 111.355 -179.862 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.4 t -52.19 -52.45 52.04 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.102 -0.999 . . . . 0.0 109.929 179.96 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -70.61 -40.88 72.93 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.465 -0.772 . . . . 0.0 109.748 179.121 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 29.7 mt -60.03 -36.52 77.45 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.63 -0.669 . . . . 0.0 110.403 179.691 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -72.4 -40.1 67.46 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.418 -0.801 . . . . 0.0 110.024 179.485 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 5.8 mm-40 -61.44 -40.23 93.7 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.464 -0.773 . . . . 0.0 110.471 179.916 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.96 -38.81 65.36 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.568 -0.708 . . . . 0.0 110.321 179.54 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.493 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -58.92 -61.92 2.27 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.697 -0.627 . . . . 0.0 110.303 179.704 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -66.02 -33.84 76.72 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.546 -0.721 . . . . 0.0 110.661 -179.707 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 9.5 t-20 -51.95 -46.05 64.61 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.471 -0.768 . . . . 0.0 109.193 178.903 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.623 ' O ' HG22 ' A' ' 20' ' ' VAL . 18.1 t90 -70.99 -43.22 68.47 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.518 -0.739 . . . . 0.0 109.407 178.817 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -58.02 -52.02 67.27 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.635 -0.666 . . . . 0.0 109.916 179.818 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.495 ' HB3' HD12 ' A' ' 22' ' ' LEU . 7.8 m95 -64.21 -33.98 77.05 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.425 -0.797 . . . . 0.0 110.202 179.426 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -68.2 -41.95 80.62 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.363 -0.836 . . . . 0.0 111.063 179.837 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 16' ' ' TRP . 26.4 m -89.4 -25.02 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.187 -0.945 . . . . 0.0 111.438 -179.527 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.6 m -84.72 -51.74 6.58 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.106 -0.996 . . . . 0.0 110.653 -179.718 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.495 HD12 ' HB3' ' A' ' 18' ' ' TRP . 59.0 mt -70.62 -63.4 1.1 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.415 -0.803 . . . . 0.0 109.749 179.904 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.529 ' HD2' ' HG3' ' A' ' 26' ' ' ARG . 1.9 mtm-85 49.1 75.37 0.67 Allowed Pre-proline 0 N--CA 1.5 2.072 0 O-C-N 121.816 -0.552 . . . . 0.0 111.251 179.362 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -77.86 53.21 4.31 Favored 'Trans proline' 0 C--N 1.313 -1.319 0 O-C-N 123.672 1.354 . . . . 0.0 110.483 179.535 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -169.76 -52.33 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.404 -0.81 . . . . 0.0 110.217 -179.75 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.529 ' HG3' ' HD2' ' A' ' 23' ' ' ARG . 1.5 ptt-85 . . . . . 0 N--CA 1.498 1.929 0 CA-C-O 118.374 -0.822 . . . . 0.0 110.524 179.999 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.9 ttt-85 . . . . . 0 N--CA 1.495 1.802 0 CA-C-O 121.117 0.484 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.421 ' O ' ' HB3' ' A' ' 3' ' ' ALA . 1.9 t -99.18 -1.35 39.53 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.427 -0.796 . . . . 0.0 111.188 179.992 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 2' ' ' SER . . . 58.64 10.03 1.3 Allowed 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.466 -0.771 . . . . 0.0 111.59 -179.469 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.6 mt -132.52 3.79 3.91 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.976 -1.077 . . . . 0.0 111.079 179.893 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 37.4 t -98.17 -53.09 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.187 -0.945 . . . . 0.0 109.569 179.74 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -62.16 -41.53 98.39 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.744 -0.597 . . . . 0.0 110.451 179.695 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.7 p -57.43 -50.74 72.03 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.39 -0.819 . . . . 0.0 109.672 179.601 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -62.73 -44.86 95.12 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.651 -0.656 . . . . 0.0 109.437 179.0 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.39 -45.57 92.54 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.816 -0.553 . . . . 0.0 110.334 179.732 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.0 t90 -61.94 -49.36 76.44 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.522 -0.736 . . . . 0.0 109.916 179.589 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.407 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 50.0 tp60 -55.09 -35.98 65.17 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.447 -0.783 . . . . 0.0 110.297 179.918 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.38 -36.82 77.18 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.423 -0.798 . . . . 0.0 110.457 179.729 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.448 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -60.45 -45.91 91.96 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.476 -0.765 . . . . 0.0 109.333 179.564 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.448 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 5.2 mt-10 -73.32 -35.42 66.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.339 -0.851 . . . . 0.0 109.675 178.959 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -51.98 -46.58 64.89 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.393 -0.817 . . . . 0.0 109.921 179.365 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -68.47 -47.29 67.5 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.506 -0.747 . . . . 0.0 109.27 179.244 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -55.09 -42.35 72.74 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.692 -0.63 . . . . 0.0 109.815 179.596 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.569 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -77.65 -27.81 51.06 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.674 -0.641 . . . . 0.0 110.315 179.612 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 14.4 t-20 -65.0 -43.7 91.66 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.408 -0.807 . . . . 0.0 110.947 -179.806 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 m -80.09 -17.32 12.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.268 -0.895 . . . . 0.0 111.705 -179.461 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.5 p -95.93 -55.79 2.87 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.971 -1.081 . . . . 0.0 110.524 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.569 HD12 ' HB3' ' A' ' 18' ' ' TRP . 6.8 mt -76.92 -28.73 55.39 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.59 -0.694 . . . . 0.0 110.805 -179.902 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 59.72 87.77 0.13 Allowed Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.679 -0.638 . . . . 0.0 110.508 -179.979 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 19' ' ' ASN . 43.6 Cg_endo -70.33 169.48 19.54 Favored 'Trans proline' 0 C--N 1.314 -1.266 0 O-C-N 123.705 1.371 . . . . 0.0 111.158 -179.822 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -102.07 -52.07 3.24 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.638 -0.664 . . . . 0.0 110.497 -179.614 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.92 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.449 -179.951 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 121.311 0.577 . . . . 0.0 110.066 . . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.577 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 1.1 m -80.19 141.34 35.75 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.342 -0.849 . . . . 0.0 110.434 -179.864 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.86 -37.53 5.38 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.544 -0.723 . . . . 0.0 110.886 -179.874 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 mp -111.06 15.72 21.51 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.269 -0.894 . . . . 0.0 111.15 -179.693 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.577 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 75.0 t -107.95 -54.18 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.14 -0.975 . . . . 0.0 109.526 179.434 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.79 -41.85 64.55 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.578 -0.701 . . . . 0.0 109.872 179.33 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.4 m -57.98 -43.72 86.68 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.318 -0.864 . . . . 0.0 109.312 179.061 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -67.2 -38.48 85.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.789 -0.569 . . . . 0.0 109.614 178.936 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' A' ' 9' ' ' LEU . 0.5 OUTLIER -69.01 -41.25 78.01 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.579 -0.701 . . . . 0.0 110.333 179.715 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -75.67 -43.32 48.08 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.504 -0.748 . . . . 0.0 110.317 179.928 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.03 -57.0 13.96 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.306 -0.871 . . . . 0.0 110.614 -179.564 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.7 -37.89 43.89 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.557 -0.715 . . . . 0.0 110.991 -179.783 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.546 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -57.12 -60.0 4.25 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.658 -0.651 . . . . 0.0 110.482 179.85 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -76.01 -35.97 59.33 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.636 -0.665 . . . . 0.0 110.887 -179.476 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 3.2 t-20 -51.91 -49.21 63.51 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.506 -0.746 . . . . 0.0 109.552 179.565 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -67.2 -45.92 75.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.56 -0.712 . . . . 0.0 109.341 178.944 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -54.94 -52.5 62.82 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.672 -0.642 . . . . 0.0 109.892 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -65.14 -39.75 93.44 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.304 -0.872 . . . . 0.0 110.008 179.566 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 26.8 t30 -66.48 -29.24 69.31 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.459 -0.776 . . . . 0.0 111.336 179.791 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.2 p -101.61 -7.83 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.99 0 O-C-N 121.123 -0.985 . . . . 0.0 111.532 -179.407 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.7 m -109.0 -30.48 8.06 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.958 -1.089 . . . . 0.0 111.174 -179.718 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.0 mt -75.14 -35.79 61.63 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.298 -0.876 . . . . 0.0 110.774 -179.995 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.464 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -58.57 -55.17 48.69 Favored Pre-proline 0 N--CA 1.499 1.988 0 O-C-N 121.509 -0.744 . . . . 0.0 110.692 179.962 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.464 ' HD3' ' HB3' ' A' ' 23' ' ' ARG . 50.5 Cg_endo -74.24 -170.05 0.67 Allowed 'Trans proline' 0 N--CA 1.487 1.143 0 O-C-N 123.527 1.278 . . . . 0.0 110.598 179.591 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.59 -157.14 0.34 Allowed 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.624 -0.673 . . . . 0.0 110.59 179.983 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.935 0 CA-C-O 118.173 -0.918 . . . . 0.0 110.689 -179.947 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 121.135 0.493 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.409 ' N ' ' HB ' ' A' ' 5' ' ' VAL . 0.3 OUTLIER -166.48 -175.81 3.35 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.526 -0.734 . . . . 0.0 110.118 179.985 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.52 -45.6 93.23 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.536 -0.728 . . . . 0.0 110.834 179.928 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.53 9.86 31.41 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.434 -0.791 . . . . 0.0 111.064 179.897 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.409 ' HB ' ' N ' ' A' ' 2' ' ' SER . 69.4 t -102.76 -40.96 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.119 -0.988 . . . . 0.0 110.361 179.931 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -84.45 -35.01 23.33 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.257 -0.902 . . . . 0.0 110.315 179.814 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -51.11 70.88 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.451 -0.781 . . . . 0.0 109.656 179.524 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -63.68 -40.26 96.36 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.638 -0.664 . . . . 0.0 109.364 178.824 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.422 ' HA ' HD23 ' A' ' 9' ' ' LEU . 6.9 mt -58.1 -41.81 84.33 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.59 -0.694 . . . . 0.0 110.205 179.561 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 33.3 t90 -65.6 -45.88 81.5 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.471 -0.768 . . . . 0.0 109.819 179.231 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -60.42 -35.53 76.02 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.353 -0.842 . . . . 0.0 110.218 179.9 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -40.13 88.14 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.544 -0.722 . . . . 0.0 110.1 179.305 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -46.35 88.16 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.546 -0.721 . . . . 0.0 109.438 179.501 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -74.18 -41.05 62.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.28 -0.887 . . . . 0.0 109.528 179.024 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -54.06 -47.74 71.33 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.634 -0.666 . . . . 0.0 109.38 179.06 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.537 ' O ' HG22 ' A' ' 20' ' ' VAL . 12.3 t90 -62.39 -47.76 82.7 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.531 -0.731 . . . . 0.0 109.282 179.004 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -58.1 -51.37 69.99 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.657 -0.652 . . . . 0.0 110.149 179.704 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.967 ' HE3' HD11 ' A' ' 22' ' ' LEU . 35.6 m95 -64.83 -16.31 62.95 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.463 -0.773 . . . . 0.0 110.73 179.472 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -92.91 -28.38 16.51 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.967 -1.083 . . . . 0.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.537 HG22 ' O ' ' A' ' 16' ' ' TRP . 19.8 m -106.2 0.21 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.112 0 O-C-N 121.097 -1.002 . . . . 0.0 111.737 -179.731 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 86.6 m -110.29 -16.72 13.67 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.917 -1.114 . . . . 0.0 111.179 -179.804 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.967 HD11 ' HE3' ' A' ' 18' ' ' TRP . 6.8 mp -95.38 -35.79 11.61 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.199 -0.938 . . . . 0.0 110.143 -179.889 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 mmt85 -130.26 65.9 76.79 Favored Pre-proline 0 N--CA 1.496 1.835 0 O-C-N 121.495 -0.753 . . . . 0.0 110.148 179.502 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -79.17 67.56 8.55 Favored 'Trans proline' 0 C--N 1.316 -1.158 0 O-C-N 123.674 1.355 . . . . 0.0 110.584 -179.933 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 50.33 59.51 4.51 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.519 -0.738 . . . . 0.0 110.663 -179.897 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 118.336 -0.84 . . . . 0.0 110.35 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 . . . . . 0 N--CA 1.499 1.992 0 CA-C-O 120.711 0.291 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -59.67 -45.68 91.34 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.41 -0.806 . . . . 0.0 109.498 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -65.44 -41.82 93.05 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.567 -0.708 . . . . 0.0 109.192 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.12 -46.45 88.99 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.638 -0.664 . . . . 0.0 109.718 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -67.06 -46.05 75.51 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.607 -0.683 . . . . 0.0 109.618 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -54.61 -39.14 67.58 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.503 -0.748 . . . . 0.0 110.142 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -66.68 -38.59 87.13 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.573 -0.704 . . . . 0.0 110.466 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -44.78 96.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.344 -0.847 . . . . 0.0 109.698 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -72.95 -39.05 66.52 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.288 -0.883 . . . . 0.0 109.693 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.9 -46.89 71.55 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.525 -0.734 . . . . 0.0 109.659 179.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -67.09 -45.23 77.89 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.539 -0.726 . . . . 0.0 109.123 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -56.06 -48.45 76.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.726 -0.609 . . . . 0.0 109.488 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -66.18 -39.65 89.87 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.478 -0.764 . . . . 0.0 110.035 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.13 -44.01 67.4 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.455 -0.778 . . . . 0.0 110.786 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.8 m -87.36 -26.74 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 121.311 -0.868 . . . . 0.0 111.048 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.1 m -77.34 -35.48 54.64 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.105 -0.997 . . . . 0.0 110.426 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.3 mt . . . . . 0 N--CA 1.495 1.809 0 O-C-N 121.472 -0.768 . . . . 0.0 109.928 179.887 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.496 1.845 0 CA-C-O 120.722 0.296 . . . . 0.0 110.32 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -55.98 -45.34 79.01 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.474 -0.766 . . . . 0.0 109.676 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -37.02 62.96 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.669 -0.645 . . . . 0.0 109.518 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.8 mt -65.74 -43.85 87.73 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.422 -0.799 . . . . 0.0 109.942 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.416 ' CE3' ' HG2' ' A' ' 11' ' ' GLN . 15.4 t90 -69.06 -39.53 79.06 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.477 -0.764 . . . . 0.0 109.82 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.416 ' HG2' ' CE3' ' A' ' 10' ' ' TRP . 2.4 mm100 -58.15 -42.93 86.99 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.386 -0.821 . . . . 0.0 110.071 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.23 -22.04 16.47 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.438 -0.789 . . . . 0.0 110.971 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.558 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -86.73 -57.33 3.02 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.295 -0.878 . . . . 0.0 110.721 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -81.39 -43.74 18.55 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.502 -0.749 . . . . 0.0 111.971 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.06 -38.82 62.8 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.174 -0.954 . . . . 0.0 110.291 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.512 ' O ' HG22 ' A' ' 20' ' ' VAL . 10.3 t90 -70.45 -49.54 47.55 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.483 -0.76 . . . . 0.0 109.206 179.031 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -57.77 -45.96 85.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.689 -0.632 . . . . 0.0 109.919 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.482 ' HB3' HD12 ' A' ' 22' ' ' LEU . 3.7 m95 -65.12 -37.12 86.45 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.431 -0.793 . . . . 0.0 110.187 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -42.56 94.58 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.233 -0.917 . . . . 0.0 110.637 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 16' ' ' TRP . 33.5 m -87.23 -6.03 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.126 -0.984 . . . . 0.0 111.516 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.6 m -107.95 -38.6 5.77 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.931 -1.106 . . . . 0.0 110.829 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.482 HD12 ' HB3' ' A' ' 18' ' ' TRP . 16.9 mt . . . . . 0 N--CA 1.499 1.991 0 O-C-N 121.356 -0.84 . . . . 0.0 111.332 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 . . . . . 0 N--CA 1.496 1.861 0 N-CA-C 110.468 -0.197 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.5 p -57.21 -48.09 79.66 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.433 -0.792 . . . . 0.0 109.675 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -65.22 -39.49 92.83 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.675 -0.641 . . . . 0.0 109.341 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 9' ' ' LEU . 1.1 mm? -65.38 -49.21 70.17 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.665 -0.647 . . . . 0.0 109.932 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.5 t90 -62.51 -45.7 91.78 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.703 -0.623 . . . . 0.0 110.132 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.36 -40.61 74.81 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.386 -0.821 . . . . 0.0 109.782 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -39.87 81.56 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.7 -0.625 . . . . 0.0 110.328 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.539 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -57.46 -60.08 4.19 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.728 -0.607 . . . . 0.0 110.417 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.505 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 13.1 mt-10 -71.73 -28.11 63.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.504 -0.747 . . . . 0.0 111.059 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -54.12 -50.71 66.26 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.347 -0.846 . . . . 0.0 109.53 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.503 ' O ' HG22 ' A' ' 20' ' ' VAL . 9.3 t90 -68.81 -41.59 78.45 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.366 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.505 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 34.2 t80 -57.43 -55.38 35.6 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.63 -0.669 . . . . 0.0 109.761 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -64.64 -35.27 80.49 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.431 -0.793 . . . . 0.0 110.059 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -56.02 -48.44 75.96 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.36 -0.838 . . . . 0.0 110.717 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 16' ' ' TRP . 30.6 m -87.06 -25.06 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 O-C-N 121.231 -0.918 . . . . 0.0 111.188 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.3 m -76.23 -39.67 53.96 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.2 -0.937 . . . . 0.0 110.334 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.4 mt . . . . . 0 N--CA 1.498 1.963 0 O-C-N 121.533 -0.73 . . . . 0.0 110.923 179.853 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.443 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 120.493 0.187 . . . . 0.0 110.828 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.5 p -52.6 -35.63 54.7 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.426 -0.796 . . . . 0.0 110.451 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.4 ' CD2' HD22 ' A' ' 9' ' ' LEU . 8.0 t80 -99.59 -32.36 11.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.558 -0.714 . . . . 0.0 109.862 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 1.3 mm? -69.25 -35.89 76.59 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.428 -0.795 . . . . 0.0 110.743 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 22.8 t90 -57.66 -48.48 79.38 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.497 -0.752 . . . . 0.0 110.404 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -47.89 82.2 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.482 -0.761 . . . . 0.0 110.033 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -37.54 84.56 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.471 -0.768 . . . . 0.0 110.045 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.457 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -58.69 -57.24 13.88 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 121.572 0.701 . . . . 0.0 109.992 179.504 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.406 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 14.2 mt-10 -71.5 -30.32 65.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.843 -0.535 . . . . 0.0 110.873 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -53.35 -49.16 67.71 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.315 -0.866 . . . . 0.0 109.531 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.42 ' O ' HG22 ' A' ' 20' ' ' VAL . 7.9 t90 -69.02 -43.87 73.87 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.553 -0.717 . . . . 0.0 109.202 178.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.406 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 90.3 t80 -57.6 -56.28 23.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.741 -0.599 . . . . 0.0 110.125 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.572 ' HB3' HD12 ' A' ' 22' ' ' LEU . 13.2 m95 -60.88 -34.77 75.13 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.469 -0.77 . . . . 0.0 110.049 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -60.71 -42.36 97.06 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.497 -0.752 . . . . 0.0 110.772 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 16' ' ' TRP . 28.2 m -94.69 -10.04 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.321 -0.862 . . . . 0.0 111.341 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.9 m -95.99 -38.56 10.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.09 -1.006 . . . . 0.0 110.513 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.572 HD12 ' HB3' ' A' ' 18' ' ' TRP . 46.8 mt . . . . . 0 N--CA 1.499 1.983 0 O-C-N 121.469 -0.769 . . . . 0.0 111.084 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.633 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 63.7 t30 . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 111.271 0.1 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -52.07 -51.29 58.58 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.179 -0.95 . . . . 0.0 109.961 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -73.68 -40.9 63.32 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.489 -0.757 . . . . 0.0 109.584 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.633 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 30.0 mt -59.06 -37.8 77.89 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.598 -0.689 . . . . 0.0 110.452 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -67.82 -48.99 64.67 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.498 -0.751 . . . . 0.0 110.16 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -64.11 -42.64 96.8 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.413 -0.804 . . . . 0.0 110.132 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -24.82 67.14 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.446 -0.784 . . . . 0.0 110.248 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.504 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -85.46 -54.5 4.53 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.437 -0.789 . . . . 0.0 110.146 179.826 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.673 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 8.1 mt-10 -69.83 -23.79 63.36 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.627 -0.671 . . . . 0.0 111.529 -179.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -52.26 -55.1 23.47 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.072 -1.018 . . . . 0.0 109.423 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -67.76 -41.28 83.55 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.566 -0.709 . . . . 0.0 109.461 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.673 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 29.9 t80 -56.21 -54.96 39.06 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.784 -0.573 . . . . 0.0 110.439 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.409 ' CD1' ' HB3' ' A' ' 14' ' ' GLU . 21.1 m95 -61.35 -41.06 96.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.372 -0.83 . . . . 0.0 110.478 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -53.92 -42.98 69.35 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.312 -0.868 . . . . 0.0 111.502 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.404 HG22 ' H ' ' A' ' 20' ' ' VAL . 33.4 m -89.79 -22.13 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.136 -0.977 . . . . 0.0 111.018 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 64.5 m -82.08 -26.65 33.46 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.112 -0.992 . . . . 0.0 110.444 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 71.1 mt . . . . . 0 N--CA 1.498 1.953 0 O-C-N 121.359 -0.838 . . . . 0.0 110.844 179.741 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 . . . . . 0 N--CA 1.497 1.876 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 t -56.73 -52.75 63.77 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.299 -0.876 . . . . 0.0 109.268 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -60.77 -44.02 97.29 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.657 -0.652 . . . . 0.0 109.283 178.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 9' ' ' LEU . 9.1 mt -59.03 -41.52 88.02 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.883 -0.511 . . . . 0.0 110.225 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 40.2 t90 -62.61 -48.43 79.44 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.479 -0.763 . . . . 0.0 110.226 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -58.16 -36.72 73.43 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.387 -0.821 . . . . 0.0 110.282 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -69.97 -37.94 75.94 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.424 -0.798 . . . . 0.0 110.123 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.511 ' CD1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -58.51 -41.72 86.07 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.546 -0.721 . . . . 0.0 109.326 179.577 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.511 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 45.5 mt-10 -67.24 -48.31 68.17 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.478 -0.764 . . . . 0.0 109.375 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -56.22 -49.21 74.76 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.816 -0.553 . . . . 0.0 109.612 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 8.8 t90 -62.37 -47.11 85.64 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.654 -0.654 . . . . 0.0 109.397 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -57.83 -51.39 69.8 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.7 -0.625 . . . . 0.0 109.827 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.465 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 3.7 m95 -63.52 -30.0 71.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.418 -0.801 . . . . 0.0 110.351 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -40.84 75.58 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.096 -1.003 . . . . 0.0 110.428 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 22.3 m -88.56 -26.97 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.229 -0.92 . . . . 0.0 110.773 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 90.5 m -84.31 -48.33 9.83 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.286 -0.884 . . . . 0.0 110.472 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.433 HD11 ' CE3' ' A' ' 18' ' ' TRP . 50.3 mt . . . . . 0 N--CA 1.497 1.901 0 O-C-N 121.397 -0.814 . . . . 0.0 109.998 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.501 2.081 0 CA-C-O 120.604 0.24 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.1 t -58.62 -46.32 87.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.306 -0.871 . . . . 0.0 109.611 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.492 ' CZ ' ' HD2' ' A' ' 12' ' ' ARG . 21.7 t80 -67.5 -43.84 79.91 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.569 -0.707 . . . . 0.0 109.305 178.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.67 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 1.4 mm? -60.86 -44.84 96.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.67 -0.644 . . . . 0.0 110.241 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.415 ' CE3' ' HG2' ' A' ' 11' ' ' GLN . 17.9 t90 -61.17 -40.69 94.83 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.635 -0.666 . . . . 0.0 110.079 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.474 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -57.0 -45.4 83.03 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.438 -0.789 . . . . 0.0 110.155 179.799 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.67 ' HD3' ' HA ' ' A' ' 9' ' ' LEU . 29.5 mtp85 -54.37 -41.83 69.62 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.754 -0.591 . . . . 0.0 110.409 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.485 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -54.37 -60.05 3.86 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.392 0.615 . . . . 0.0 110.051 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -68.51 -31.39 70.61 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.593 -0.692 . . . . 0.0 110.544 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -52.83 -43.83 66.28 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.448 -0.783 . . . . 0.0 109.579 179.197 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.512 ' O ' HG22 ' A' ' 20' ' ' VAL . 10.9 t90 -68.63 -47.09 67.51 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -57.28 -52.14 66.53 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.804 -0.56 . . . . 0.0 109.679 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.436 ' HE3' ' HA ' ' A' ' 18' ' ' TRP . 5.0 m95 -63.19 -33.3 75.18 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.33 -0.856 . . . . 0.0 110.151 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -64.12 -41.0 97.4 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.453 -0.78 . . . . 0.0 110.681 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 16' ' ' TRP . 35.7 m -93.83 -18.84 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.224 -0.922 . . . . 0.0 111.21 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.1 m -91.84 -53.35 4.32 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.002 -1.061 . . . . 0.0 109.925 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.3 mt . . . . . 0 N--CA 1.496 1.827 0 O-C-N 121.498 -0.751 . . . . 0.0 110.56 179.54 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 120.89 0.376 . . . . 0.0 110.047 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.3 m -57.6 -52.79 63.99 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.602 -0.686 . . . . 0.0 110.747 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.663 ' CZ ' HD13 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -66.11 -27.86 68.37 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.377 -0.827 . . . . 0.0 110.149 179.632 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.663 HD13 ' CZ ' ' A' ' 8' ' ' TYR . 3.0 tp -70.55 -41.44 72.48 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.513 -0.742 . . . . 0.0 109.575 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.5 t90 -60.53 -47.38 86.41 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.506 -0.746 . . . . 0.0 109.371 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -60.05 -37.05 78.68 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.454 -0.779 . . . . 0.0 109.901 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.6 mtp85 -63.09 -39.15 93.87 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.501 -0.749 . . . . 0.0 110.159 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.459 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -63.2 -46.73 85.66 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.608 -0.682 . . . . 0.0 109.495 179.513 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.451 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 4.3 mt-10 -70.19 -36.63 74.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.408 -0.807 . . . . 0.0 109.699 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.43 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.3 OUTLIER -57.36 -48.96 77.67 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 178.628 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.5 t90 -69.76 -41.63 74.92 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.615 -0.678 . . . . 0.0 109.194 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.459 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 57.8 t80 -55.15 -58.93 5.68 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.704 -0.622 . . . . 0.0 109.416 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 23.7 m95 -61.4 -33.2 73.28 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.511 -0.743 . . . . 0.0 110.111 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 2.2 t30 -54.4 -37.51 65.12 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.487 -0.758 . . . . 0.0 110.463 179.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -102.91 -27.52 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.49 -0.756 . . . . 0.0 110.782 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 99.9 m -73.2 -39.12 65.82 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.251 -0.906 . . . . 0.0 110.862 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.422 ' HA ' HD23 ' A' ' 22' ' ' LEU . 45.7 mt . . . . . 0 N--CA 1.501 2.104 0 O-C-N 121.511 -0.743 . . . . 0.0 110.929 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 . . . . . 0 N--CA 1.498 1.95 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.3 m -61.92 -44.41 96.83 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.319 -0.863 . . . . 0.0 109.728 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -60.79 -41.31 95.33 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.551 -0.718 . . . . 0.0 109.308 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.36 -39.41 71.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.699 -0.625 . . . . 0.0 109.996 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -64.63 -47.47 78.43 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.637 -0.665 . . . . 0.0 110.097 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -54.84 -40.42 69.6 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.369 -0.832 . . . . 0.0 110.363 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -41.59 87.08 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.561 -0.712 . . . . 0.0 110.341 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.409 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -59.55 -46.87 87.61 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.343 -0.848 . . . . 0.0 109.557 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 2.8 mt-10 -70.88 -37.77 73.06 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.343 -0.848 . . . . 0.0 110.038 179.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -46.84 72.01 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.544 -0.723 . . . . 0.0 109.546 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -64.35 -45.95 85.58 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.524 -0.735 . . . . 0.0 109.335 178.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.41 ' CZ ' HG21 ' A' ' 21' ' ' THR . 82.4 t80 -52.46 -47.49 66.44 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.781 -0.575 . . . . 0.0 109.664 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 22.2 m95 -63.14 -38.05 89.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.579 -0.701 . . . . 0.0 110.147 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -54.79 -35.43 63.85 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.223 -0.923 . . . . 0.0 110.94 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.4 m -106.72 -2.78 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.075 -1.015 . . . . 0.0 111.617 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.41 HG21 ' CZ ' ' A' ' 17' ' ' PHE . 82.2 m -113.37 -16.81 12.41 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.033 -1.042 . . . . 0.0 111.341 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.3 mt . . . . . 0 N--CA 1.501 2.117 0 O-C-N 121.2 -0.937 . . . . 0.0 110.645 -179.962 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 CA-C-O 120.631 0.253 . . . . 0.0 110.417 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.6 p -58.15 -53.15 61.47 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.452 -0.78 . . . . 0.0 109.421 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 32.1 t80 -65.39 -39.39 92.16 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 9' ' ' LEU . 12.5 mt -60.43 -34.82 74.51 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.712 -0.618 . . . . 0.0 109.851 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -73.55 -40.4 63.99 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.463 -0.773 . . . . 0.0 109.654 178.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.454 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.95 -36.21 78.77 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.556 -0.715 . . . . 0.0 109.945 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -55.29 -39.44 69.88 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.56 -0.713 . . . . 0.0 110.328 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.506 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -56.26 -61.03 2.67 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-O 121.387 0.613 . . . . 0.0 110.506 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.5 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 20.1 mt-10 -69.53 -30.44 68.27 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.578 -0.701 . . . . 0.0 110.823 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -52.38 -49.48 64.34 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.377 -0.827 . . . . 0.0 109.41 179.29 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.475 ' O ' HG22 ' A' ' 20' ' ' VAL . 15.8 t90 -69.2 -43.61 73.81 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.548 -0.72 . . . . 0.0 109.461 178.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.5 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 34.5 t80 -55.92 -55.36 33.52 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.658 -0.651 . . . . 0.0 109.578 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 40.1 m95 -63.05 -33.22 74.98 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.478 -0.764 . . . . 0.0 110.112 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 16.5 t-20 -59.02 -39.45 81.95 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.509 -0.744 . . . . 0.0 110.901 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.475 HG22 ' O ' ' A' ' 16' ' ' TRP . 28.2 m -101.63 2.65 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 O-C-N 121.246 -0.909 . . . . 0.0 111.257 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.6 m -106.2 -38.36 6.28 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.089 -1.007 . . . . 0.0 110.472 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 80.2 mt . . . . . 0 N--CA 1.497 1.918 0 O-C-N 121.464 -0.772 . . . . 0.0 110.386 -179.841 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.451 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.947 0 CA-C-O 120.57 0.224 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -50.71 -55.77 15.06 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.407 -0.808 . . . . 0.0 110.796 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -74.37 -42.97 58.42 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.463 -0.773 . . . . 0.0 109.858 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 9.0 mt -56.12 -40.08 73.2 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.66 -0.65 . . . . 0.0 110.782 -179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -72.32 -48.82 39.07 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.383 -0.823 . . . . 0.0 110.044 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 6.1 tp60 -63.04 -54.72 33.73 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.416 -0.802 . . . . 0.0 110.652 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.23 -38.23 39.48 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.457 -0.777 . . . . 0.0 110.812 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.534 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -59.89 -57.8 11.32 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.429 -0.794 . . . . 0.0 110.798 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -77.35 -42.52 36.26 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.712 -0.617 . . . . 0.0 111.469 -178.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -53.42 -43.36 67.9 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.18 -0.95 . . . . 0.0 109.588 179.619 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.49 ' CD1' HG21 ' A' ' 20' ' ' VAL . 28.2 t90 -69.17 -46.04 68.51 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.455 -0.778 . . . . 0.0 109.13 178.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -59.18 -43.78 92.17 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.497 -0.752 . . . . 0.0 110.156 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.488 ' O ' HD12 ' A' ' 22' ' ' LEU . 3.9 m95 -75.21 -13.67 60.47 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.409 -0.807 . . . . 0.0 111.064 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -101.68 -24.48 14.09 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.849 -1.157 . . . . 0.0 110.659 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.49 HG21 ' CD1' ' A' ' 16' ' ' TRP . 48.0 t -105.89 -40.9 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.294 -0.879 . . . . 0.0 111.037 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.2 m -77.86 -34.35 51.76 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.196 -0.94 . . . . 0.0 111.141 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.488 HD12 ' O ' ' A' ' 18' ' ' TRP . 31.0 mt . . . . . 0 N--CA 1.498 1.936 0 O-C-N 121.376 -0.827 . . . . 0.0 110.033 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 33.6 m120 . . . . . 0 N--CA 1.499 1.978 0 CA-C-O 120.742 0.306 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.3 t -58.42 -47.61 83.37 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.403 -0.81 . . . . 0.0 109.533 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -66.53 -40.37 89.09 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.746 -0.596 . . . . 0.0 109.705 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.458 ' HA ' HD22 ' A' ' 9' ' ' LEU . 0.6 OUTLIER -54.74 -36.98 65.36 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.685 -0.634 . . . . 0.0 110.669 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -83.15 -45.97 13.29 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.376 -0.828 . . . . 0.0 109.925 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.98 -48.09 83.45 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.422 -0.799 . . . . 0.0 110.177 -179.865 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.25 -39.34 69.66 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.46 -0.775 . . . . 0.0 110.008 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.505 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -55.76 -60.82 2.91 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.373 0.606 . . . . 0.0 110.349 179.633 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -70.86 -31.16 67.76 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.84 -0.538 . . . . 0.0 110.856 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.446 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.7 OUTLIER -50.74 -46.36 59.21 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.422 -0.799 . . . . 0.0 109.62 179.237 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.636 ' NE1' HG21 ' A' ' 20' ' ' VAL . 6.7 t90 -73.04 -44.57 60.59 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.506 -0.746 . . . . 0.0 109.177 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -55.18 -45.06 75.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.538 -0.726 . . . . 0.0 109.99 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.525 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -73.51 -43.33 60.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.421 -0.799 . . . . 0.0 110.193 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -62.73 -36.14 82.04 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.361 -0.837 . . . . 0.0 110.82 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.636 HG21 ' NE1' ' A' ' 16' ' ' TRP . 90.2 t -84.01 -36.65 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.216 -0.927 . . . . 0.0 110.78 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.3 m -78.91 -42.51 26.96 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.126 -0.984 . . . . 0.0 110.722 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 18' ' ' TRP . 12.4 mt . . . . . 0 N--CA 1.498 1.944 0 O-C-N 121.38 -0.825 . . . . 0.0 110.721 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.43 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.498 1.967 0 CA-C-O 120.505 0.193 . . . . 0.0 110.68 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -54.15 -46.64 72.33 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.417 -0.802 . . . . 0.0 109.774 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -71.43 -40.14 70.59 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.548 -0.72 . . . . 0.0 109.578 178.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.451 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.9 mm? -61.69 -48.73 79.47 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.587 -0.696 . . . . 0.0 109.833 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -65.9 -39.57 90.74 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.49 -0.756 . . . . 0.0 109.515 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -60.82 -43.26 98.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.476 -0.765 . . . . 0.0 110.189 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -24.48 53.57 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.579 -0.701 . . . . 0.0 110.974 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.549 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -78.16 -60.6 2.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.256 -0.903 . . . . 0.0 110.236 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -71.36 -28.89 64.37 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.521 -0.737 . . . . 0.0 111.382 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 2.4 t-20 -53.31 -51.52 62.07 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.174 -0.954 . . . . 0.0 109.539 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -65.33 -43.75 89.97 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -55.59 -59.26 5.09 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.709 -0.619 . . . . 0.0 109.808 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 6.9 m95 -60.53 -33.12 72.19 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.368 -0.832 . . . . 0.0 110.346 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -57.04 -39.94 75.8 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.308 -0.87 . . . . 0.0 110.217 179.511 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.406 HG22 ' H ' ' A' ' 20' ' ' VAL . 27.1 m -95.53 -29.44 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.317 -0.865 . . . . 0.0 110.499 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 94.2 m -68.95 -42.41 76.72 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.209 -0.932 . . . . 0.0 109.987 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.4 mt . . . . . 0 N--CA 1.495 1.812 0 O-C-N 121.486 -0.759 . . . . 0.0 110.237 -179.975 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 . . . . . 0 N--CA 1.498 1.944 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.9 m -58.94 -49.75 76.64 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.387 -0.821 . . . . 0.0 109.406 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -65.02 -45.87 83.73 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.672 -0.642 . . . . 0.0 109.356 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -58.29 -43.95 88.27 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.718 -0.614 . . . . 0.0 109.875 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -67.54 -42.9 81.96 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.584 -0.698 . . . . 0.0 109.509 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.48 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 19.5 mm-40 -64.67 -50.94 65.06 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.516 -0.74 . . . . 0.0 110.126 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -53.17 -34.96 59.13 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.503 -0.748 . . . . 0.0 110.347 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.498 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -61.3 -55.26 33.78 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.565 -0.709 . . . . 0.0 110.676 179.814 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -78.9 -42.71 26.48 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.699 -0.626 . . . . 0.0 111.363 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -55.6 -38.3 69.24 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.467 -0.771 . . . . 0.0 110.301 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -63.66 -49.0 74.91 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.412 -0.805 . . . . 0.0 109.453 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -56.22 -51.01 69.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.708 -0.62 . . . . 0.0 109.79 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.525 ' HB3' HD12 ' A' ' 22' ' ' LEU . 30.9 m95 -63.41 -31.83 73.09 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.525 -0.735 . . . . 0.0 110.769 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.15 -41.76 97.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.299 -0.876 . . . . 0.0 110.51 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.6 m -89.76 -14.42 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.326 -0.858 . . . . 0.0 110.969 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.2 m -92.76 -35.41 13.45 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.124 -0.985 . . . . 0.0 110.636 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 18' ' ' TRP . 31.7 mt . . . . . 0 N--CA 1.496 1.857 0 O-C-N 121.313 -0.867 . . . . 0.0 110.326 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.6 m120 . . . . . 0 N--CA 1.497 1.885 0 CA-C-O 120.721 0.296 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.9 t -58.56 -52.51 65.37 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.481 -0.762 . . . . 0.0 110.783 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.579 ' CE1' HD13 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -63.07 -30.84 71.91 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.369 -0.832 . . . . 0.0 110.266 179.907 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.579 HD13 ' CE1' ' A' ' 8' ' ' TYR . 3.6 tp -67.59 -46.94 71.17 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.368 -0.832 . . . . 0.0 109.732 179.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.439 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 4.0 t-105 -60.02 -37.24 79.16 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.621 -0.674 . . . . 0.0 109.379 179.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.515 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.64 -46.81 88.9 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.568 -0.707 . . . . 0.0 109.592 179.053 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.41 -39.24 56.85 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.74 -0.6 . . . . 0.0 110.483 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.516 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -59.42 -57.46 12.91 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.598 -0.689 . . . . 0.0 110.645 -179.914 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -75.48 -40.0 57.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.598 -0.689 . . . . 0.0 111.603 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -51.86 -43.33 63.21 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.304 -0.873 . . . . 0.0 110.179 -179.825 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.1 t90 -66.61 -48.9 68.06 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.413 -0.804 . . . . 0.0 109.24 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -56.59 -51.76 67.4 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.796 -0.565 . . . . 0.0 109.877 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.405 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.3 m95 -63.87 -30.42 71.51 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.528 -0.732 . . . . 0.0 110.428 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.486 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 8.7 t-20 -65.14 -46.45 80.87 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.268 -0.895 . . . . 0.0 110.65 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.5 m -86.36 -26.05 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.283 -0.885 . . . . 0.0 111.133 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.7 m -78.81 -36.96 41.89 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.215 -0.928 . . . . 0.0 110.648 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.405 HD12 ' HB3' ' A' ' 18' ' ' TRP . 60.9 mt . . . . . 0 N--CA 1.499 1.977 0 O-C-N 121.333 -0.854 . . . . 0.0 110.838 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.509 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 1.3 t-20 . . . . . 0 N--CA 1.497 1.887 0 CA-C-O 120.61 0.243 . . . . 0.0 110.508 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.1 t -57.1 -44.29 83.05 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.47 -0.769 . . . . 0.0 109.968 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -77.96 -37.27 47.88 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.449 -0.782 . . . . 0.0 109.598 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 12.3 mt -56.5 -41.87 77.37 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.677 -0.639 . . . . 0.0 110.281 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.45 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 4.5 t-105 -58.79 -42.95 90.27 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.447 -0.783 . . . . 0.0 109.584 179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -61.5 -44.36 97.2 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.435 -0.79 . . . . 0.0 109.433 179.129 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -54.59 -39.15 67.56 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.712 -0.618 . . . . 0.0 110.144 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.521 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -56.79 -60.05 4.13 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.39 0.614 . . . . 0.0 110.248 179.747 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.66 -33.49 72.66 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.556 -0.715 . . . . 0.0 110.567 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -52.19 -43.74 64.33 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.475 -0.766 . . . . 0.0 109.838 179.437 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.524 ' O ' HG22 ' A' ' 20' ' ' VAL . 7.0 t90 -70.06 -45.53 66.89 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.54 -0.725 . . . . 0.0 109.224 178.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -58.81 -48.76 80.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.826 -0.546 . . . . 0.0 109.748 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.519 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -67.5 -33.84 75.93 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.454 -0.779 . . . . 0.0 110.019 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 19.9 t-20 -64.46 -45.01 89.27 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.335 -0.853 . . . . 0.0 110.549 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 16' ' ' TRP . 29.9 m -85.08 -24.63 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.21 -0.932 . . . . 0.0 111.263 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 65.9 m -84.46 -40.35 17.83 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.065 -1.022 . . . . 0.0 110.469 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.519 HD12 ' HB3' ' A' ' 18' ' ' TRP . 10.9 mt . . . . . 0 N--CA 1.499 2.019 0 O-C-N 121.435 -0.791 . . . . 0.0 110.829 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.5 m120 . . . . . 0 N--CA 1.496 1.856 0 CA-C-O 120.778 0.323 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.1 t -58.07 -47.75 82.22 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.459 -0.776 . . . . 0.0 109.654 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -69.26 -41.87 76.32 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.55 -0.718 . . . . 0.0 109.836 179.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.89 -40.41 95.31 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.54 -0.725 . . . . 0.0 110.528 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.7 t90 -66.2 -46.88 75.75 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.337 -0.852 . . . . 0.0 110.154 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -37.58 67.74 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.339 -0.851 . . . . 0.0 110.222 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -32.4 68.87 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.569 -0.707 . . . . 0.0 110.394 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.74 -44.89 88.68 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.458 -0.776 . . . . 0.0 109.983 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -70.2 -39.94 74.89 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.327 -0.858 . . . . 0.0 109.964 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.53 -48.26 77.63 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.498 -0.751 . . . . 0.0 109.282 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -68.74 -42.57 77.39 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.597 -0.689 . . . . 0.0 109.452 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.3 -57.84 10.85 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.711 -0.618 . . . . 0.0 110.207 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.473 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.6 m95 -59.52 -37.12 77.51 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.332 -0.855 . . . . 0.0 110.428 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -56.35 -44.91 80.53 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.505 -0.747 . . . . 0.0 110.821 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.5 m -92.74 -31.78 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.3 -0.875 . . . . 0.0 110.976 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.8 m -69.74 -32.19 70.59 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.184 -0.947 . . . . 0.0 110.264 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.473 HD12 ' HB3' ' A' ' 18' ' ' TRP . 10.4 mt . . . . . 0 N--CA 1.491 1.617 0 O-C-N 121.441 -0.787 . . . . 0.0 109.367 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.422 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.897 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.9 p -59.68 -48.79 80.27 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.453 -0.78 . . . . 0.0 109.24 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -66.62 -37.73 85.47 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.644 -0.66 . . . . 0.0 109.221 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 9' ' ' LEU . 11.5 mt -58.75 -44.78 90.63 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.717 -0.614 . . . . 0.0 109.963 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.7 t90 -62.85 -45.75 91.1 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.645 -0.659 . . . . 0.0 109.366 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -39.79 74.07 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.514 -0.741 . . . . 0.0 110.011 179.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -63.54 -39.75 95.23 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.622 -0.674 . . . . 0.0 110.385 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -45.69 92.73 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.475 -0.766 . . . . 0.0 109.72 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -72.69 -39.05 67.33 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.252 -0.905 . . . . 0.0 109.726 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.63 -42.91 68.29 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.602 -0.686 . . . . 0.0 109.86 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -70.39 -45.12 66.6 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.453 -0.779 . . . . 0.0 109.297 179.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -55.47 -45.88 76.91 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.69 -0.631 . . . . 0.0 109.65 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 25.6 m95 -72.84 -36.52 67.48 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.613 -0.679 . . . . 0.0 109.958 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -53.99 -43.43 69.98 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.547 -0.721 . . . . 0.0 110.651 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.8 m -84.46 -27.93 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.374 -0.829 . . . . 0.0 110.896 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.8 m -80.54 -24.54 39.22 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.219 -0.926 . . . . 0.0 110.917 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.8 mt . . . . . 0 N--CA 1.499 1.999 0 O-C-N 121.305 -0.872 . . . . 0.0 111.366 -179.692 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 120.599 0.238 . . . . 0.0 110.408 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.6 m -52.72 -48.09 66.9 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.462 -0.774 . . . . 0.0 110.232 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -70.03 -43.14 71.93 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.464 -0.773 . . . . 0.0 109.519 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 9' ' ' LEU . 9.1 mt -59.57 -43.46 93.59 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.678 -0.639 . . . . 0.0 110.12 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -62.51 -44.94 95.14 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.637 -0.665 . . . . 0.0 110.032 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -59.08 -41.33 87.76 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.283 -0.886 . . . . 0.0 110.103 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -39.49 94.92 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.607 -0.683 . . . . 0.0 110.364 179.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -45.43 93.49 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.471 -0.768 . . . . 0.0 109.94 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -72.59 -34.87 67.72 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.233 -0.917 . . . . 0.0 109.956 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.31 -47.74 72.1 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.524 -0.735 . . . . 0.0 109.521 178.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -74.16 -41.93 60.72 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.519 -0.738 . . . . 0.0 109.582 179.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -55.36 -47.99 74.91 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.544 -0.723 . . . . 0.0 110.427 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 21.1 m95 -72.53 -33.42 66.85 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.447 -0.783 . . . . 0.0 110.379 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -58.96 -30.57 68.0 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.364 -0.835 . . . . 0.0 110.774 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.6 m -100.12 -19.94 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.236 -0.915 . . . . 0.0 110.835 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.4 m -88.91 -27.05 21.24 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.237 -0.914 . . . . 0.0 110.782 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.3 mt . . . . . 0 N--CA 1.5 2.042 0 O-C-N 121.269 -0.894 . . . . 0.0 110.969 -179.955 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 . . . . . 0 N--CA 1.497 1.92 0 CA-C-O 120.43 0.157 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 m -54.65 -52.32 62.66 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.36 -0.837 . . . . 0.0 109.747 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -62.73 -42.65 99.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.521 -0.737 . . . . 0.0 109.386 178.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.431 ' HA ' HD23 ' A' ' 9' ' ' LEU . 8.6 mt -58.76 -44.76 90.67 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.634 -0.666 . . . . 0.0 109.901 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -64.81 -42.86 94.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.712 -0.617 . . . . 0.0 109.673 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -61.19 -39.58 90.72 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.289 -0.882 . . . . 0.0 110.312 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -37.27 86.95 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.402 -0.811 . . . . 0.0 110.275 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.424 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -65.79 -46.35 79.02 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.369 -0.832 . . . . 0.0 109.596 179.653 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.413 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 3.9 mt-10 -68.62 -35.25 77.06 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.399 -0.813 . . . . 0.0 109.932 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 2.3 t-20 -55.83 -53.22 59.38 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.56 -0.713 . . . . 0.0 109.227 178.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.4 ' O ' HG22 ' A' ' 20' ' ' VAL . 9.2 t90 -65.85 -42.25 90.68 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.676 -0.64 . . . . 0.0 109.396 178.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.424 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 55.4 t80 -54.87 -57.53 11.22 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.715 -0.616 . . . . 0.0 109.828 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.415 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 16.3 m95 -64.52 -32.91 74.75 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.368 -0.832 . . . . 0.0 110.185 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 3.6 t30 -55.92 -35.31 66.45 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.455 -0.778 . . . . 0.0 110.491 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 16' ' ' TRP . 30.1 m -104.33 -9.59 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.283 -0.885 . . . . 0.0 111.002 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.415 ' HB ' ' HA ' ' A' ' 18' ' ' TRP . 67.1 m -93.44 -33.05 13.97 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.188 -0.945 . . . . 0.0 110.496 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 N--CA 1.499 2.002 0 O-C-N 121.407 -0.808 . . . . 0.0 110.911 179.861 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.8 m120 . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 120.452 0.168 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.53 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -63.86 -57.56 9.47 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.044 -1.035 . . . . 0.0 110.006 179.636 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -69.68 -14.74 62.96 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.316 -0.865 . . . . 0.0 111.158 179.69 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -95.82 -28.51 14.7 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.15 -0.969 . . . . 0.0 111.217 -179.595 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -99.84 -48.47 4.68 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.165 -0.959 . . . . 0.0 110.917 -179.656 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.53 ' HB2' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -55.02 -32.74 62.05 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.266 -0.896 . . . . 0.0 110.843 -179.542 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -61.09 -38.15 85.24 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.327 -0.858 . . . . 0.0 110.114 179.395 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.412 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -59.78 -45.14 93.22 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.646 -0.659 . . . . 0.0 109.553 179.7 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.412 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 21.7 mt-10 -69.18 -35.76 76.61 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.394 -0.816 . . . . 0.0 109.897 179.485 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -49.5 67.41 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.518 -0.739 . . . . 0.0 109.338 179.109 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -69.67 -43.19 73.02 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.492 -0.755 . . . . 0.0 109.279 178.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.76 -53.18 60.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.749 -0.595 . . . . 0.0 110.182 179.848 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -64.42 -36.46 84.23 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.299 -0.876 . . . . 0.0 110.197 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -58.49 -34.24 70.7 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.472 -0.767 . . . . 0.0 111.271 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.4 m -103.17 -27.66 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.206 -0.934 . . . . 0.0 111.115 -179.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.7 m -77.42 -41.65 39.09 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.163 -0.96 . . . . 0.0 110.768 -179.632 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 N--CA 1.501 2.083 0 O-C-N 121.427 -0.796 . . . . 0.0 110.47 179.971 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.7 m120 . . . . . 0 N--CA 1.495 1.806 0 CA-C-O 120.799 0.333 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 57.7 m -61.25 -56.0 25.62 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.526 -0.734 . . . . 0.0 110.718 -179.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.485 ' CZ ' HD13 ' A' ' 9' ' ' LEU . 1.2 p90 -67.2 -26.6 66.7 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.259 -0.901 . . . . 0.0 110.388 179.89 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' A' ' 9' ' ' LEU . 1.4 tp -60.32 -42.86 96.48 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.327 -0.858 . . . . 0.0 109.836 178.949 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.605 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -78.06 -36.92 47.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.361 -0.837 . . . . 0.0 109.841 179.378 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -66.66 -47.6 71.99 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.403 -0.811 . . . . 0.0 109.727 179.385 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' A' ' 16' ' ' TRP . 9.1 tmm_? -59.07 -17.23 24.05 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.487 -0.758 . . . . 0.0 110.337 178.982 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.457 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -83.42 -58.42 2.84 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.314 -0.866 . . . . 0.0 109.888 179.431 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -82.31 -47.69 12.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.811 -0.555 . . . . 0.0 111.515 -178.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -53.65 -40.12 65.61 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.164 -0.96 . . . . 0.0 110.284 -179.696 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.469 ' HB3' ' O ' ' A' ' 12' ' ' ARG . 9.1 t90 -75.26 -48.51 22.95 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.313 -0.867 . . . . 0.0 109.561 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -57.18 -49.74 75.03 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.597 -0.69 . . . . 0.0 110.309 -179.596 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.709 ' CE3' HD12 ' A' ' 22' ' ' LEU . 4.9 m95 -65.53 -35.43 80.82 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.187 -0.946 . . . . 0.0 110.033 179.664 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 5.3 t30 -71.66 -36.49 70.67 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.09 -1.006 . . . . 0.0 110.641 179.546 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.4 p -89.93 -20.65 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.383 -0.823 . . . . 0.0 111.07 -179.732 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.1 m -107.78 -59.21 1.87 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.199 -0.938 . . . . 0.0 110.202 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.709 HD12 ' CE3' ' A' ' 18' ' ' TRP . 3.1 mt . . . . . 0 N--CA 1.5 2.031 0 O-C-N 121.505 -0.747 . . . . 0.0 110.352 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 31.3 m120 . . . . . 0 N--CA 1.496 1.837 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.0 m -58.08 -46.84 84.78 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.294 -0.879 . . . . 0.0 109.384 179.057 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -59.67 -44.66 93.51 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.782 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 9' ' ' LEU . 0.3 OUTLIER -67.59 -43.86 79.49 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.738 -0.601 . . . . 0.0 109.975 179.551 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.476 ' CE3' ' HG3' ' A' ' 11' ' ' GLN . 19.1 t90 -61.94 -45.11 95.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.668 -0.645 . . . . 0.0 109.665 179.403 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.476 ' HG3' ' CE3' ' A' ' 10' ' ' TRP . 5.0 mt-30 -58.12 -39.11 77.87 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.486 -0.759 . . . . 0.0 110.244 179.692 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.8 mmt-85 -64.7 -42.96 94.93 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.491 -0.756 . . . . 0.0 110.367 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -44.87 91.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.441 -0.787 . . . . 0.0 109.998 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -74.17 -35.89 64.03 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.225 -0.922 . . . . 0.0 110.223 179.54 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -55.45 -47.78 75.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.39 -0.818 . . . . 0.0 109.781 179.472 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.4 t90 -67.08 -46.07 75.42 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.587 -0.696 . . . . 0.0 109.361 179.043 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -55.14 -52.4 63.42 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.723 -0.61 . . . . 0.0 109.723 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.408 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.3 m95 -66.79 -31.13 71.56 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.484 -0.76 . . . . 0.0 110.065 179.384 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 4.3 t30 -57.98 -46.24 85.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.409 -0.807 . . . . 0.0 110.152 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.432 HG22 ' H ' ' A' ' 20' ' ' VAL . 30.0 m -84.99 -25.89 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.349 -0.845 . . . . 0.0 110.608 179.589 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.408 ' HB ' ' HA ' ' A' ' 18' ' ' TRP . 55.2 m -74.37 -37.64 63.41 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.248 -0.907 . . . . 0.0 110.231 179.713 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.6 mt . . . . . 0 N--CA 1.497 1.897 0 O-C-N 121.501 -0.749 . . . . 0.0 110.373 179.93 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 . . . . . 0 N--CA 1.497 1.879 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 t -55.39 -48.7 73.93 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.365 -0.834 . . . . 0.0 109.585 179.615 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -60.65 -43.65 97.35 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.606 -0.684 . . . . 0.0 109.488 178.983 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.05 -43.18 88.26 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.561 -0.712 . . . . 0.0 109.822 179.604 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.44 ' CE3' ' HG3' ' A' ' 11' ' ' GLN . 12.3 t90 -65.79 -42.65 90.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.645 -0.659 . . . . 0.0 109.931 179.492 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.44 ' HG3' ' CE3' ' A' ' 10' ' ' TRP . 10.0 mt-30 -54.14 -46.28 72.21 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.385 -0.822 . . . . 0.0 110.352 179.869 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -64.36 -33.49 75.97 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.655 -0.653 . . . . 0.0 110.8 -179.923 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.512 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -66.85 -44.55 80.72 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.31 -0.869 . . . . 0.0 110.402 -179.63 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.512 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 6.3 mt-10 -75.94 -49.97 16.26 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.193 -0.942 . . . . 0.0 110.922 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.1 -39.5 59.87 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.329 -0.857 . . . . 0.0 110.185 179.893 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.1 t90 -77.16 -45.29 27.23 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.385 -0.822 . . . . 0.0 109.534 179.035 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -55.65 -53.99 49.71 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.628 -0.67 . . . . 0.0 110.033 -179.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.6 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.1 m95 -59.97 -33.07 71.45 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.22 -0.925 . . . . 0.0 110.075 179.384 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -38.13 80.57 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.424 -0.798 . . . . 0.0 110.995 179.666 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.9 m -103.93 -25.87 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 O-C-N 121.409 -0.807 . . . . 0.0 111.348 -179.391 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.1 m -82.78 -48.37 10.89 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.094 -1.004 . . . . 0.0 110.757 -179.511 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.6 HD12 ' HB3' ' A' ' 18' ' ' TRP . 49.4 mt . . . . . 0 N--CA 1.497 1.892 0 O-C-N 121.427 -0.796 . . . . 0.0 110.207 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 120.897 0.38 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.4 t -62.66 -46.96 85.77 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -0.839 . . . . 0.0 110.059 179.48 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.05 -39.38 83.04 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.444 -0.785 . . . . 0.0 109.806 179.607 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.451 ' HA ' HD22 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -67.33 -44.31 79.41 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.433 -0.792 . . . . 0.0 109.963 179.336 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.502 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 3.5 t-105 -60.81 -37.75 83.05 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.647 -0.658 . . . . 0.0 110.252 179.721 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.1 -49.76 73.2 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.298 -0.877 . . . . 0.0 109.648 179.573 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -35.86 75.99 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.611 -0.681 . . . . 0.0 109.825 179.037 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.462 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -55.53 -50.81 68.99 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.722 0.772 . . . . 0.0 109.803 179.146 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -78.44 -31.74 48.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.859 -0.526 . . . . 0.0 110.168 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.428 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -49.52 -49.17 47.09 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.601 -0.687 . . . . 0.0 109.818 179.413 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.468 ' O ' HG12 ' A' ' 20' ' ' VAL . 6.1 t90 -72.52 -44.58 62.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.624 -0.673 . . . . 0.0 109.297 178.973 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -53.8 -48.9 69.37 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.839 -0.538 . . . . 0.0 110.148 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 5.8 m95 -70.2 -39.45 75.18 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.391 -0.818 . . . . 0.0 109.74 179.391 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 7.7 t-20 -62.45 -55.69 25.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.309 -0.869 . . . . 0.0 110.38 179.595 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.468 HG12 ' O ' ' A' ' 16' ' ' TRP . 8.6 p -66.52 -22.66 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.334 -0.853 . . . . 0.0 111.641 -179.828 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.1 m -90.79 -36.25 14.37 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.002 -1.061 . . . . 0.0 110.921 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 N--CA 1.498 1.95 0 O-C-N 121.333 -0.854 . . . . 0.0 110.594 -179.674 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.514 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.498 1.957 0 CA-C-O 120.661 0.267 . . . . 0.0 110.478 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.0 m -56.08 -47.66 77.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.459 -0.775 . . . . 0.0 109.41 179.377 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -70.77 -39.39 73.24 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.725 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.514 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 15.1 mt -57.53 -45.95 84.41 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.562 -0.711 . . . . 0.0 109.847 179.582 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.7 t90 -73.9 -48.14 32.98 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.629 -0.669 . . . . 0.0 109.768 179.335 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -56.74 -40.24 75.4 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.408 -0.808 . . . . 0.0 110.385 -179.817 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.63 -38.05 86.25 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.487 -0.758 . . . . 0.0 110.384 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.409 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -65.37 -47.97 74.56 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.357 -0.84 . . . . 0.0 109.213 179.463 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 3.1 mt-10 -69.52 -31.25 69.37 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.535 -0.728 . . . . 0.0 109.848 179.158 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -55.35 -49.53 72.0 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.424 -0.797 . . . . 0.0 108.866 178.601 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.58 ' NE1' HG21 ' A' ' 20' ' ' VAL . 14.3 t90 -70.1 -42.35 72.82 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.576 -0.702 . . . . 0.0 109.236 178.59 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -54.22 -31.8 54.18 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.624 -0.672 . . . . 0.0 110.874 179.728 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.525 ' HB3' HD12 ' A' ' 22' ' ' LEU . 24.1 m95 -102.91 -43.22 5.59 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.363 -0.835 . . . . 0.0 110.972 -179.601 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -57.51 -37.78 73.56 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.247 -0.908 . . . . 0.0 111.098 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.58 HG21 ' NE1' ' A' ' 16' ' ' TRP . 89.8 t -65.88 -32.86 60.04 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.238 -0.914 . . . . 0.0 110.316 179.907 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.9 m -93.68 -22.58 18.66 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.534 -0.729 . . . . 0.0 111.029 -179.81 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 18' ' ' TRP . 78.2 mt . . . . . 0 N--CA 1.501 2.079 0 O-C-N 121.255 -0.903 . . . . 0.0 111.309 -179.629 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 . . . . . 0 N--CA 1.5 2.063 0 CA-C-O 120.551 0.215 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.6 t -57.98 -42.96 86.19 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.357 -0.839 . . . . 0.0 109.602 179.524 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.421 ' CD2' HD22 ' A' ' 9' ' ' LEU . 35.8 t80 -71.92 -39.52 69.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.372 -0.83 . . . . 0.0 109.495 178.995 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.445 HD13 ' HA ' ' A' ' 9' ' ' LEU . 1.1 mm? -70.77 -23.01 62.33 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.406 -0.809 . . . . 0.0 110.99 179.835 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.454 ' HA ' ' HD1' ' A' ' 13' ' ' TRP . 26.8 t90 -103.88 -53.69 2.71 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.357 -0.839 . . . . 0.0 110.863 -179.405 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -62.44 -49.24 76.23 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.098 -1.001 . . . . 0.0 110.889 -179.508 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -38.53 87.16 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.285 -0.884 . . . . 0.0 110.215 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.497 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -63.45 -43.93 95.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.451 -0.781 . . . . 0.0 109.504 179.48 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.494 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 48.7 mt-10 -69.29 -45.06 70.54 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.354 -0.841 . . . . 0.0 109.968 179.535 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.85 -42.56 65.32 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.384 -0.823 . . . . 0.0 109.586 179.163 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -72.66 -43.86 62.6 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.433 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.497 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 81.8 t80 -56.04 -53.81 52.49 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.72 -0.612 . . . . 0.0 109.62 179.473 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -59.28 -32.56 70.14 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.576 -0.703 . . . . 0.0 109.831 179.189 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -61.31 -35.38 77.19 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.59 -0.693 . . . . 0.0 110.769 179.435 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.7 m -111.03 7.9 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.255 -0.903 . . . . 0.0 111.519 -179.991 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.443 HG21 ' CZ ' ' A' ' 17' ' ' PHE . 97.7 m -119.04 -31.6 4.69 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.977 -1.077 . . . . 0.0 111.087 -179.857 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 22' ' ' LEU . 18.4 mt . . . . . 0 N--CA 1.501 2.121 0 O-C-N 121.315 -0.866 . . . . 0.0 110.988 -179.806 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 120.518 0.199 . . . . 0.0 110.665 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.8 t -52.69 -43.59 65.69 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.142 -0.974 . . . . 0.0 110.168 -179.974 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.492 ' CZ ' ' HG3' ' A' ' 12' ' ' ARG . 33.9 t80 -79.86 -39.07 31.38 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.457 -0.777 . . . . 0.0 110.075 179.423 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.53 -35.87 78.05 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.583 -0.698 . . . . 0.0 111.186 -179.525 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -58.76 -54.56 45.68 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.267 -0.896 . . . . 0.0 110.44 -179.665 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.69 -38.39 86.69 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.39 -0.819 . . . . 0.0 110.322 179.728 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.492 ' HG3' ' CZ ' ' A' ' 8' ' ' TYR . 13.4 mmm180 -65.54 -8.73 21.24 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.198 -0.939 . . . . 0.0 111.198 179.692 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -101.81 -47.36 4.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.223 -0.923 . . . . 0.0 109.981 179.637 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -88.37 -45.86 9.65 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.919 -0.488 . . . . 0.0 110.864 -178.774 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -39.66 95.3 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.264 -0.898 . . . . 0.0 109.972 179.826 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.427 ' O ' HG22 ' A' ' 20' ' ' VAL . 9.8 t90 -72.21 -47.71 48.5 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.427 -0.796 . . . . 0.0 109.668 179.178 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -57.37 -51.71 68.29 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.68 -0.638 . . . . 0.0 110.166 -179.815 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 8.6 m95 -65.8 -33.46 75.9 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.312 -0.867 . . . . 0.0 110.465 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -60.49 -57.05 14.37 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.172 -0.955 . . . . 0.0 110.611 179.966 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 16' ' ' TRP . 27.3 m -67.54 -22.79 29.0 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.287 -0.883 . . . . 0.0 111.252 -179.57 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 86.7 m -87.89 -31.06 19.67 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.086 -1.009 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.1 mt . . . . . 0 N--CA 1.497 1.91 0 O-C-N 121.275 -0.891 . . . . 0.0 110.214 -179.93 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.0 t30 . . . . . 0 N--CA 1.494 1.77 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 71.7 m -54.38 -54.91 34.24 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.442 -0.786 . . . . 0.0 109.67 179.546 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -61.61 -44.25 97.34 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.655 -0.653 . . . . 0.0 109.437 178.915 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 9' ' ' LEU . 9.6 mt -57.05 -41.12 78.12 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.628 -0.67 . . . . 0.0 110.308 179.69 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.472 ' HA ' ' HD1' ' A' ' 13' ' ' TRP . 28.5 t90 -68.47 -39.33 81.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.472 -0.768 . . . . 0.0 109.988 179.395 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -64.33 -36.63 84.76 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.383 -0.823 . . . . 0.0 110.824 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -39.8 61.06 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.297 -0.877 . . . . 0.0 110.658 -179.807 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.472 ' HD1' ' HA ' ' A' ' 10' ' ' TRP . 0.0 OUTLIER -60.05 -45.5 92.65 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.32 -0.862 . . . . 0.0 110.02 179.952 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.431 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 3.0 mt-10 -65.16 -42.94 93.27 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.308 -0.87 . . . . 0.0 110.264 179.836 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.06 -36.19 70.24 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.513 -0.742 . . . . 0.0 110.174 179.483 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -71.33 -47.07 58.83 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.448 -0.782 . . . . 0.0 109.298 179.272 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -55.89 -53.12 60.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.629 -0.669 . . . . 0.0 110.051 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 6.1 m95 -59.86 -31.08 69.43 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.352 -0.843 . . . . 0.0 110.697 179.604 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -31.69 72.33 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.352 -0.843 . . . . 0.0 111.283 179.945 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.2 m -106.28 -25.28 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.072 -1.017 . . . . 0.0 111.387 -179.665 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.8 m -82.11 -35.61 28.4 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.131 -0.981 . . . . 0.0 111.29 -179.278 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 N--CA 1.502 2.142 0 O-C-N 121.307 -0.871 . . . . 0.0 111.562 -179.533 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 . . . . . 0 N--CA 1.498 1.927 0 CA-C-O 120.5 0.19 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.7 t -50.61 -49.76 55.78 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.232 -0.917 . . . . 0.0 110.22 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -71.84 -46.52 57.74 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.475 -0.766 . . . . 0.0 110.024 179.497 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.462 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.1 mm? -57.75 -41.82 82.67 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.458 -0.776 . . . . 0.0 110.202 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.572 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -75.0 -34.76 61.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.529 -0.732 . . . . 0.0 109.72 179.342 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -64.53 -39.36 93.62 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.529 -0.732 . . . . 0.0 110.32 179.544 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.58 -26.57 22.2 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.314 -0.866 . . . . 0.0 110.332 179.278 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.566 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -86.89 -43.59 12.31 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.564 -0.71 . . . . 0.0 110.806 179.923 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -83.62 -38.69 21.25 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.381 -0.824 . . . . 0.0 111.496 -178.507 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -50.04 -43.72 51.12 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.26 -0.9 . . . . 0.0 109.763 179.551 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.542 ' NE1' HG21 ' A' ' 20' ' ' VAL . 18.5 t90 -73.22 -44.05 60.25 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.561 -0.712 . . . . 0.0 109.086 178.622 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -55.43 -44.92 76.72 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.462 -0.774 . . . . 0.0 109.987 179.525 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -71.77 -51.01 24.84 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.42 -0.8 . . . . 0.0 110.553 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.07 -21.61 65.09 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.16 -0.962 . . . . 0.0 111.803 -179.795 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.542 HG21 ' NE1' ' A' ' 16' ' ' TRP . 99.3 t -102.09 -31.64 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 120.961 -1.087 . . . . 0.0 111.288 -179.21 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.6 m -88.59 -34.06 17.45 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.977 -1.077 . . . . 0.0 111.28 -179.446 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.9 mt . . . . . 0 N--CA 1.501 2.102 0 O-C-N 121.175 -0.953 . . . . 0.0 110.841 -179.743 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 . . . . . 0 N--CA 1.497 1.891 0 CA-C-O 120.649 0.262 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.0 t -58.56 -47.71 83.33 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.292 -0.88 . . . . 0.0 109.69 179.363 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -66.79 -41.68 87.22 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.468 -0.77 . . . . 0.0 109.451 179.011 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.9 -40.27 97.04 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.678 -0.639 . . . . 0.0 110.038 179.499 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 28.0 t90 -61.57 -44.63 96.67 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.65 -0.656 . . . . 0.0 110.264 179.695 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -34.66 78.73 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.406 -0.809 . . . . 0.0 110.501 179.863 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -37.96 77.93 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.364 -0.835 . . . . 0.0 110.4 179.707 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.468 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -60.03 -47.22 86.77 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.448 -0.783 . . . . 0.0 109.675 179.985 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.462 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 28.4 mt-10 -69.01 -38.54 79.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.264 -0.897 . . . . 0.0 109.872 179.314 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.48 -49.26 78.47 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.574 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -67.11 -42.04 85.22 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.821 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.468 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 69.3 t80 -55.07 -58.06 9.2 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.599 -0.688 . . . . 0.0 109.684 179.687 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -62.93 -34.71 78.03 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.439 -0.788 . . . . 0.0 110.177 179.484 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -53.92 -36.72 63.07 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.5 -0.75 . . . . 0.0 110.602 179.396 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.6 m -104.42 -23.74 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 121.282 -0.886 . . . . 0.0 110.975 179.839 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 58.0 m -78.09 -27.92 48.58 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.152 -0.968 . . . . 0.0 111.016 -179.874 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 22' ' ' LEU . 51.8 mt . . . . . 0 N--CA 1.5 2.053 0 O-C-N 121.381 -0.824 . . . . 0.0 111.081 -179.941 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.421 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.499 1.993 0 CA-C-O 120.72 0.295 . . . . 0.0 110.378 . . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.6 m -57.69 -44.96 86.22 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.345 -0.847 . . . . 0.0 109.647 179.425 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -70.01 -39.88 75.56 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.513 -0.742 . . . . 0.0 109.216 178.648 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' A' ' 9' ' ' LEU . 12.3 mt -61.68 -49.83 74.93 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.745 -0.597 . . . . 0.0 109.948 179.458 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -64.49 -36.74 85.17 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.569 -0.707 . . . . 0.0 109.645 179.221 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -60.08 -44.0 95.08 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.446 -0.784 . . . . 0.0 110.19 179.441 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 ttp85 -53.57 -36.26 61.71 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.615 -0.678 . . . . 0.0 110.689 179.688 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.461 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -61.44 -59.45 5.24 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.564 -0.71 . . . . 0.0 110.227 179.97 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.569 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 8.9 mt-10 -72.87 -30.97 64.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.681 -0.637 . . . . 0.0 110.942 -179.545 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -50.57 -48.66 57.46 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.378 -0.826 . . . . 0.0 109.864 179.676 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.57 ' NE1' HG21 ' A' ' 20' ' ' VAL . 6.2 t90 -72.5 -42.12 65.2 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.528 -0.732 . . . . 0.0 109.302 178.903 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.569 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 15.9 t80 -57.72 -45.27 86.01 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.593 -0.692 . . . . 0.0 110.459 179.962 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -63.44 -57.62 9.69 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.276 -0.89 . . . . 0.0 110.895 -179.534 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.04 -27.13 68.11 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.043 -1.036 . . . . 0.0 111.716 -179.544 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.57 HG21 ' NE1' ' A' ' 16' ' ' TRP . 71.3 t -91.27 -24.88 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.062 -1.024 . . . . 0.0 111.324 -179.392 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.6 m -101.12 -38.02 8.32 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.085 -1.009 . . . . 0.0 111.338 -179.395 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 77.3 mt . . . . . 0 N--CA 1.502 2.144 0 O-C-N 121.251 -0.906 . . . . 0.0 110.96 -179.571 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.567 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 59.9 t30 . . . . . 0 N--CA 1.497 1.897 0 N-CA-C 111.355 0.131 . . . . 0.0 111.355 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.4 t -52.19 -52.45 52.04 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.102 -0.999 . . . . 0.0 109.929 179.96 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -70.61 -40.88 72.93 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.465 -0.772 . . . . 0.0 109.748 179.121 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 29.7 mt -60.03 -36.52 77.45 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.63 -0.669 . . . . 0.0 110.403 179.691 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -72.4 -40.1 67.46 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.418 -0.801 . . . . 0.0 110.024 179.485 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 5.8 mm-40 -61.44 -40.23 93.7 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.464 -0.773 . . . . 0.0 110.471 179.916 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.96 -38.81 65.36 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.568 -0.708 . . . . 0.0 110.321 179.54 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.493 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -58.92 -61.92 2.27 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.697 -0.627 . . . . 0.0 110.303 179.704 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -66.02 -33.84 76.72 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.546 -0.721 . . . . 0.0 110.661 -179.707 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -51.95 -46.05 64.61 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.471 -0.768 . . . . 0.0 109.193 178.903 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.623 ' O ' HG22 ' A' ' 20' ' ' VAL . 18.1 t90 -70.99 -43.22 68.47 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.518 -0.739 . . . . 0.0 109.407 178.817 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -58.02 -52.02 67.27 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.635 -0.666 . . . . 0.0 109.916 179.818 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.495 ' HB3' HD12 ' A' ' 22' ' ' LEU . 7.8 m95 -64.21 -33.98 77.05 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.425 -0.797 . . . . 0.0 110.202 179.426 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -68.2 -41.95 80.62 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.363 -0.836 . . . . 0.0 111.063 179.837 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 16' ' ' TRP . 26.4 m -89.4 -25.02 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.187 -0.945 . . . . 0.0 111.438 -179.527 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.6 m -84.72 -51.74 6.58 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.106 -0.996 . . . . 0.0 110.653 -179.718 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.495 HD12 ' HB3' ' A' ' 18' ' ' TRP . 59.0 mt . . . . . 0 N--CA 1.497 1.925 0 O-C-N 121.415 -0.803 . . . . 0.0 109.749 179.904 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.499 2.018 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.7 p -57.43 -50.74 72.03 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.39 -0.819 . . . . 0.0 109.672 179.601 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -62.73 -44.86 95.12 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.651 -0.656 . . . . 0.0 109.437 179.0 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.39 -45.57 92.54 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.816 -0.553 . . . . 0.0 110.334 179.732 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.0 t90 -61.94 -49.36 76.44 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.522 -0.736 . . . . 0.0 109.916 179.589 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.407 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 50.0 tp60 -55.09 -35.98 65.17 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.447 -0.783 . . . . 0.0 110.297 179.918 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.38 -36.82 77.18 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.423 -0.798 . . . . 0.0 110.457 179.729 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.448 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -60.45 -45.91 91.96 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.476 -0.765 . . . . 0.0 109.333 179.564 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.448 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 5.2 mt-10 -73.32 -35.42 66.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.339 -0.851 . . . . 0.0 109.675 178.959 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -51.98 -46.58 64.89 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.393 -0.817 . . . . 0.0 109.921 179.365 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -68.47 -47.29 67.5 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.506 -0.747 . . . . 0.0 109.27 179.244 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -55.09 -42.35 72.74 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.692 -0.63 . . . . 0.0 109.815 179.596 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.569 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -77.65 -27.81 51.06 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.674 -0.641 . . . . 0.0 110.315 179.612 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 14.4 t-20 -65.0 -43.7 91.66 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.408 -0.807 . . . . 0.0 110.947 -179.806 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 m -80.09 -17.32 12.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.268 -0.895 . . . . 0.0 111.705 -179.461 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.5 p -95.93 -55.79 2.87 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.971 -1.081 . . . . 0.0 110.524 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.569 HD12 ' HB3' ' A' ' 18' ' ' TRP . 6.8 mt . . . . . 0 N--CA 1.499 1.975 0 O-C-N 121.59 -0.694 . . . . 0.0 110.805 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.4 t30 . . . . . 0 N--CA 1.496 1.834 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.4 m -57.98 -43.72 86.68 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.318 -0.864 . . . . 0.0 109.312 179.061 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -67.2 -38.48 85.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.789 -0.569 . . . . 0.0 109.614 178.936 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' A' ' 9' ' ' LEU . 0.5 OUTLIER -69.01 -41.25 78.01 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.579 -0.701 . . . . 0.0 110.333 179.715 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -75.67 -43.32 48.08 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.504 -0.748 . . . . 0.0 110.317 179.928 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.03 -57.0 13.96 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.306 -0.871 . . . . 0.0 110.614 -179.564 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.7 -37.89 43.89 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.557 -0.715 . . . . 0.0 110.991 -179.783 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.546 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -57.12 -60.0 4.25 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.658 -0.651 . . . . 0.0 110.482 179.85 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -76.01 -35.97 59.33 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.636 -0.665 . . . . 0.0 110.887 -179.476 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 3.2 t-20 -51.91 -49.21 63.51 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.506 -0.746 . . . . 0.0 109.552 179.565 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -67.2 -45.92 75.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.56 -0.712 . . . . 0.0 109.341 178.944 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -54.94 -52.5 62.82 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.672 -0.642 . . . . 0.0 109.892 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -65.14 -39.75 93.44 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.304 -0.872 . . . . 0.0 110.008 179.566 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 26.8 t30 -66.48 -29.24 69.31 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.459 -0.776 . . . . 0.0 111.336 179.791 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.2 p -101.61 -7.83 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.99 0 O-C-N 121.123 -0.985 . . . . 0.0 111.532 -179.407 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.7 m -109.0 -30.48 8.06 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.958 -1.089 . . . . 0.0 111.174 -179.718 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.0 mt . . . . . 0 N--CA 1.499 1.994 0 O-C-N 121.298 -0.876 . . . . 0.0 110.774 -179.995 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.5 t30 . . . . . 0 N--CA 1.497 1.886 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -51.11 70.88 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.451 -0.781 . . . . 0.0 109.656 179.524 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -63.68 -40.26 96.36 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.638 -0.664 . . . . 0.0 109.364 178.824 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.422 ' HA ' HD23 ' A' ' 9' ' ' LEU . 6.9 mt -58.1 -41.81 84.33 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.59 -0.694 . . . . 0.0 110.205 179.561 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 33.3 t90 -65.6 -45.88 81.5 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.471 -0.768 . . . . 0.0 109.819 179.231 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -60.42 -35.53 76.02 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.353 -0.842 . . . . 0.0 110.218 179.9 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -40.13 88.14 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.544 -0.722 . . . . 0.0 110.1 179.305 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -46.35 88.16 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.546 -0.721 . . . . 0.0 109.438 179.501 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -74.18 -41.05 62.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.28 -0.887 . . . . 0.0 109.528 179.024 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -54.06 -47.74 71.33 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.634 -0.666 . . . . 0.0 109.38 179.06 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.537 ' O ' HG22 ' A' ' 20' ' ' VAL . 12.3 t90 -62.39 -47.76 82.7 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.531 -0.731 . . . . 0.0 109.282 179.004 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -58.1 -51.37 69.99 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.657 -0.652 . . . . 0.0 110.149 179.704 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.967 ' HE3' HD11 ' A' ' 22' ' ' LEU . 35.6 m95 -64.83 -16.31 62.95 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.463 -0.773 . . . . 0.0 110.73 179.472 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -92.91 -28.38 16.51 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.967 -1.083 . . . . 0.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.537 HG22 ' O ' ' A' ' 16' ' ' TRP . 19.8 m -106.2 0.21 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.112 0 O-C-N 121.097 -1.002 . . . . 0.0 111.737 -179.731 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 86.6 m -110.29 -16.72 13.67 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.917 -1.114 . . . . 0.0 111.179 -179.804 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.967 HD11 ' HE3' ' A' ' 18' ' ' TRP . 6.8 mp . . . . . 0 N--CA 1.495 1.778 0 O-C-N 121.199 -0.938 . . . . 0.0 110.143 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 39.8 ttt-85 . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 121.331 0.586 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.41 156.42 30.39 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.211 -0.93 . . . . 0.0 110.272 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.2 -30.95 71.98 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.519 -0.738 . . . . 0.0 110.964 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.1 pp -100.72 7.96 43.56 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.342 -0.849 . . . . 0.0 111.282 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.9 t -105.48 -58.45 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.128 -0.982 . . . . 0.0 110.102 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -62.65 -40.91 98.52 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.426 -0.797 . . . . 0.0 110.429 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -59.67 -45.68 91.34 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.41 -0.806 . . . . 0.0 109.498 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -65.44 -41.82 93.05 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.567 -0.708 . . . . 0.0 109.192 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.12 -46.45 88.99 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.638 -0.664 . . . . 0.0 109.718 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -67.06 -46.05 75.51 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.607 -0.683 . . . . 0.0 109.618 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -54.61 -39.14 67.58 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.503 -0.748 . . . . 0.0 110.142 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -66.68 -38.59 87.13 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.573 -0.704 . . . . 0.0 110.466 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -44.78 96.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.344 -0.847 . . . . 0.0 109.698 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -72.95 -39.05 66.52 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.288 -0.883 . . . . 0.0 109.693 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.9 -46.89 71.55 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.525 -0.734 . . . . 0.0 109.659 179.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.2 t90 -67.09 -45.23 77.89 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.539 -0.726 . . . . 0.0 109.123 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -56.06 -48.45 76.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.726 -0.609 . . . . 0.0 109.488 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -66.18 -39.65 89.87 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.478 -0.764 . . . . 0.0 110.035 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.13 -44.01 67.4 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.455 -0.778 . . . . 0.0 110.786 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.8 m -87.36 -26.74 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 121.311 -0.868 . . . . 0.0 111.048 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.1 m -77.34 -35.48 54.64 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.105 -0.997 . . . . 0.0 110.426 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.3 mt -79.1 -64.72 1.12 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.472 -0.768 . . . . 0.0 109.928 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.0 mmt-85 51.14 80.23 0.31 Allowed Pre-proline 0 N--CA 1.501 2.092 0 O-C-N 121.916 -0.49 . . . . 0.0 110.837 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -76.94 73.86 5.21 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 O-C-N 123.766 1.403 . . . . 0.0 110.684 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -98.97 166.82 11.1 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.377 -0.827 . . . . 0.0 110.496 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.211 0 CA-C-O 118.351 -0.833 . . . . 0.0 111.093 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.7 ttt-85 . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 120.898 0.38 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.09 -178.8 0.13 Allowed 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.806 -0.559 . . . . 0.0 110.857 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.31 -52.58 2.77 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.331 -0.856 . . . . 0.0 110.623 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.76 33.43 1.03 Allowed 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.422 -0.799 . . . . 0.0 110.987 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.9 t -120.01 -53.62 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.238 -0.914 . . . . 0.0 109.873 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -68.89 -34.49 75.51 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.403 -0.811 . . . . 0.0 110.32 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -55.98 -45.34 79.01 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.474 -0.766 . . . . 0.0 109.676 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -37.02 62.96 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.669 -0.645 . . . . 0.0 109.518 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.8 mt -65.74 -43.85 87.73 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.422 -0.799 . . . . 0.0 109.942 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.416 ' CE3' ' HG2' ' A' ' 11' ' ' GLN . 15.4 t90 -69.06 -39.53 79.06 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.477 -0.764 . . . . 0.0 109.82 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.416 ' HG2' ' CE3' ' A' ' 10' ' ' TRP . 2.4 mm100 -58.15 -42.93 86.99 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.386 -0.821 . . . . 0.0 110.071 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.23 -22.04 16.47 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.438 -0.789 . . . . 0.0 110.971 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.558 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -86.73 -57.33 3.02 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.295 -0.878 . . . . 0.0 110.721 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -81.39 -43.74 18.55 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.502 -0.749 . . . . 0.0 111.971 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.06 -38.82 62.8 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.174 -0.954 . . . . 0.0 110.291 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.512 ' O ' HG22 ' A' ' 20' ' ' VAL . 10.3 t90 -70.45 -49.54 47.55 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.483 -0.76 . . . . 0.0 109.206 179.031 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -57.77 -45.96 85.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.689 -0.632 . . . . 0.0 109.919 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.482 ' HB3' HD12 ' A' ' 22' ' ' LEU . 3.7 m95 -65.12 -37.12 86.45 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.431 -0.793 . . . . 0.0 110.187 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -42.56 94.58 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.233 -0.917 . . . . 0.0 110.637 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 16' ' ' TRP . 33.5 m -87.23 -6.03 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.126 -0.984 . . . . 0.0 111.516 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.6 m -107.95 -38.6 5.77 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.931 -1.106 . . . . 0.0 110.829 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.482 HD12 ' HB3' ' A' ' 18' ' ' TRP . 16.9 mt -95.66 -16.02 22.32 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.356 -0.84 . . . . 0.0 111.332 -179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.14 67.18 2.71 Favored Pre-proline 0 N--CA 1.499 1.996 0 O-C-N 121.194 -0.941 . . . . 0.0 110.418 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.59 110.19 2.82 Favored 'Trans proline' 0 C--N 1.312 -1.346 0 O-C-N 123.635 1.334 . . . . 0.0 110.646 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 67.71 160.16 0.16 Allowed 'General case' 0 N--CA 1.504 2.249 0 CA-C-O 121.489 0.662 . . . . 0.0 111.147 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.97 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.42 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.221 0.534 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.465 ' O ' ' HB3' ' A' ' 3' ' ' ALA . 2.4 t -101.94 -3.6 27.54 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.342 -0.849 . . . . 0.0 111.258 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 2' ' ' SER . . . 61.33 9.19 2.44 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.49 -0.757 . . . . 0.0 111.47 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.0 mt -129.88 -0.55 4.77 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.008 -1.057 . . . . 0.0 111.173 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.9 t -89.98 -52.37 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.077 -1.015 . . . . 0.0 109.926 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -64.71 -38.81 92.25 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.459 -0.776 . . . . 0.0 110.468 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.5 p -57.21 -48.09 79.66 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.433 -0.792 . . . . 0.0 109.675 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -65.22 -39.49 92.83 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.675 -0.641 . . . . 0.0 109.341 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 9' ' ' LEU . 1.1 mm? -65.38 -49.21 70.17 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.665 -0.647 . . . . 0.0 109.932 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.5 t90 -62.51 -45.7 91.78 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.703 -0.623 . . . . 0.0 110.132 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.36 -40.61 74.81 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.386 -0.821 . . . . 0.0 109.782 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -39.87 81.56 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.7 -0.625 . . . . 0.0 110.328 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.539 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -57.46 -60.08 4.19 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.728 -0.607 . . . . 0.0 110.417 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.505 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 13.1 mt-10 -71.73 -28.11 63.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.504 -0.747 . . . . 0.0 111.059 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -54.12 -50.71 66.26 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.347 -0.846 . . . . 0.0 109.53 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.503 ' O ' HG22 ' A' ' 20' ' ' VAL . 9.3 t90 -68.81 -41.59 78.45 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.366 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.505 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 34.2 t80 -57.43 -55.38 35.6 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.63 -0.669 . . . . 0.0 109.761 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -64.64 -35.27 80.49 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.431 -0.793 . . . . 0.0 110.059 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -56.02 -48.44 75.96 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.36 -0.838 . . . . 0.0 110.717 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 16' ' ' TRP . 30.6 m -87.06 -25.06 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 O-C-N 121.231 -0.918 . . . . 0.0 111.188 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.3 m -76.23 -39.67 53.96 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.2 -0.937 . . . . 0.0 110.334 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.4 mt -86.6 -8.79 57.2 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.533 -0.73 . . . . 0.0 110.923 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.484 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -59.96 -54.14 58.4 Favored Pre-proline 0 N--CA 1.499 2.019 0 O-C-N 121.252 -0.905 . . . . 0.0 110.873 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.484 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 52.2 Cg_endo -80.83 63.16 8.74 Favored 'Trans proline' 0 C--N 1.319 -1.017 0 O-C-N 123.442 1.233 . . . . 0.0 110.736 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -103.43 -48.2 4.06 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.177 -0.952 . . . . 0.0 110.551 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 118.127 -0.939 . . . . 0.0 110.807 -179.814 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.496 1.861 0 CA-C-O 121.042 0.449 . . . . 0.0 110.359 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.492 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.3 OUTLIER -137.72 166.35 24.18 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.506 -0.746 . . . . 0.0 110.379 179.858 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.84 -46.76 3.31 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.354 -0.841 . . . . 0.0 111.013 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.7 mp -105.02 13.41 30.96 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.28 -0.888 . . . . 0.0 111.215 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.492 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 98.6 t -111.93 -52.11 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.139 -0.976 . . . . 0.0 110.119 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.443 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.1 OUTLIER -69.73 -21.53 63.46 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.425 -0.797 . . . . 0.0 110.828 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.5 p -52.6 -35.63 54.7 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.426 -0.796 . . . . 0.0 110.451 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.4 ' CD2' HD22 ' A' ' 9' ' ' LEU . 8.0 t80 -99.59 -32.36 11.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.558 -0.714 . . . . 0.0 109.862 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 1.3 mm? -69.25 -35.89 76.59 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.428 -0.795 . . . . 0.0 110.743 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 22.8 t90 -57.66 -48.48 79.38 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.497 -0.752 . . . . 0.0 110.404 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -47.89 82.2 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.482 -0.761 . . . . 0.0 110.033 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -37.54 84.56 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.471 -0.768 . . . . 0.0 110.045 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.457 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -58.69 -57.24 13.88 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 121.572 0.701 . . . . 0.0 109.992 179.504 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.406 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 14.2 mt-10 -71.5 -30.32 65.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.843 -0.535 . . . . 0.0 110.873 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -53.35 -49.16 67.71 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.315 -0.866 . . . . 0.0 109.531 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.42 ' O ' HG22 ' A' ' 20' ' ' VAL . 7.9 t90 -69.02 -43.87 73.87 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.553 -0.717 . . . . 0.0 109.202 178.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.406 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 90.3 t80 -57.6 -56.28 23.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.741 -0.599 . . . . 0.0 110.125 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.572 ' HB3' HD12 ' A' ' 22' ' ' LEU . 13.2 m95 -60.88 -34.77 75.13 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.469 -0.77 . . . . 0.0 110.049 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -60.71 -42.36 97.06 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.497 -0.752 . . . . 0.0 110.772 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 16' ' ' TRP . 28.2 m -94.69 -10.04 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.321 -0.862 . . . . 0.0 111.341 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.9 m -95.99 -38.56 10.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.09 -1.006 . . . . 0.0 110.513 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.572 HD12 ' HB3' ' A' ' 18' ' ' TRP . 46.8 mt -84.01 -16.86 42.44 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.469 -0.769 . . . . 0.0 111.084 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.495 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.73 -53.58 42.61 Favored Pre-proline 0 N--CA 1.499 2.023 0 O-C-N 121.304 -0.873 . . . . 0.0 110.631 179.723 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 45.4 Cg_endo -71.77 158.39 53.26 Favored 'Trans proline' 0 N--CA 1.486 1.084 0 O-C-N 123.455 1.239 . . . . 0.0 110.592 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -92.51 -39.15 11.54 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.625 -0.672 . . . . 0.0 110.518 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 . . . . . 0 N--CA 1.497 1.886 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.335 -179.997 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 121.219 0.533 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.496 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.1 OUTLIER -122.83 142.87 50.28 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.249 -0.907 . . . . 0.0 110.458 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -70.34 -32.02 69.55 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.445 -0.784 . . . . 0.0 110.847 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tp -91.17 -0.58 57.73 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.406 -0.809 . . . . 0.0 111.309 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.496 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 93.3 t -123.7 -47.06 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.07 -1.019 . . . . 0.0 110.399 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.633 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 63.7 t30 -69.15 -17.9 63.88 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.437 -0.789 . . . . 0.0 111.271 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -52.07 -51.29 58.58 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.179 -0.95 . . . . 0.0 109.961 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -73.68 -40.9 63.32 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.489 -0.757 . . . . 0.0 109.584 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.633 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 30.0 mt -59.06 -37.8 77.89 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.598 -0.689 . . . . 0.0 110.452 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -67.82 -48.99 64.67 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.498 -0.751 . . . . 0.0 110.16 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -64.11 -42.64 96.8 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.413 -0.804 . . . . 0.0 110.132 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -24.82 67.14 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.446 -0.784 . . . . 0.0 110.248 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.504 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -85.46 -54.5 4.53 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.437 -0.789 . . . . 0.0 110.146 179.826 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.673 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 8.1 mt-10 -69.83 -23.79 63.36 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.627 -0.671 . . . . 0.0 111.529 -179.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -52.26 -55.1 23.47 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.072 -1.018 . . . . 0.0 109.423 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -67.76 -41.28 83.55 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.566 -0.709 . . . . 0.0 109.461 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.673 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 29.9 t80 -56.21 -54.96 39.06 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.784 -0.573 . . . . 0.0 110.439 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.409 ' CD1' ' HB3' ' A' ' 14' ' ' GLU . 21.1 m95 -61.35 -41.06 96.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.372 -0.83 . . . . 0.0 110.478 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -53.92 -42.98 69.35 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.312 -0.868 . . . . 0.0 111.502 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.404 HG22 ' H ' ' A' ' 20' ' ' VAL . 33.4 m -89.79 -22.13 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.136 -0.977 . . . . 0.0 111.018 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 64.5 m -82.08 -26.65 33.46 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.112 -0.992 . . . . 0.0 110.444 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 71.1 mt -82.68 -13.1 57.02 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.359 -0.838 . . . . 0.0 110.844 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.534 ' HB2' ' HD3' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -63.73 -53.06 53.58 Favored Pre-proline 0 N--CA 1.499 1.975 0 O-C-N 121.231 -0.918 . . . . 0.0 110.834 179.802 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.534 ' HD3' ' HB2' ' A' ' 23' ' ' ARG . 46.6 Cg_endo -72.04 179.68 4.68 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 O-C-N 123.5 1.263 . . . . 0.0 110.91 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 168.82 8.01 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.471 -0.768 . . . . 0.0 110.732 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.539 ' CZ ' ' HB2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 117.863 -1.065 . . . . 0.0 110.219 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.9 ptt-85 . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 121.149 0.499 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.0 t -91.16 -177.37 4.87 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.38 -0.825 . . . . 0.0 110.233 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.98 -46.14 2.54 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.483 -0.761 . . . . 0.0 110.702 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 mt -86.9 18.55 3.44 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.287 -0.883 . . . . 0.0 111.374 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.5 t -106.49 -56.28 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.065 -1.022 . . . . 0.0 109.752 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -66.61 -39.53 88.4 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.446 -0.784 . . . . 0.0 110.249 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 t -56.73 -52.75 63.77 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.299 -0.876 . . . . 0.0 109.268 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -60.77 -44.02 97.29 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.657 -0.652 . . . . 0.0 109.283 178.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 9' ' ' LEU . 9.1 mt -59.03 -41.52 88.02 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.883 -0.511 . . . . 0.0 110.225 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 40.2 t90 -62.61 -48.43 79.44 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.479 -0.763 . . . . 0.0 110.226 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -58.16 -36.72 73.43 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.387 -0.821 . . . . 0.0 110.282 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -69.97 -37.94 75.94 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.424 -0.798 . . . . 0.0 110.123 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.511 ' CD1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -58.51 -41.72 86.07 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.546 -0.721 . . . . 0.0 109.326 179.577 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.511 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 45.5 mt-10 -67.24 -48.31 68.17 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.478 -0.764 . . . . 0.0 109.375 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -56.22 -49.21 74.76 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.816 -0.553 . . . . 0.0 109.612 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 8.8 t90 -62.37 -47.11 85.64 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.654 -0.654 . . . . 0.0 109.397 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -57.83 -51.39 69.8 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.7 -0.625 . . . . 0.0 109.827 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.465 ' HA ' ' CE3' ' A' ' 18' ' ' TRP . 3.7 m95 -63.52 -30.0 71.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.418 -0.801 . . . . 0.0 110.351 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -40.84 75.58 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.096 -1.003 . . . . 0.0 110.428 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 22.3 m -88.56 -26.97 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.229 -0.92 . . . . 0.0 110.773 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 90.5 m -84.31 -48.33 9.83 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.286 -0.884 . . . . 0.0 110.472 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.433 HD11 ' CE3' ' A' ' 18' ' ' TRP . 50.3 mt -89.59 -44.09 10.32 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.397 -0.814 . . . . 0.0 109.998 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 51.34 67.62 4.05 Favored Pre-proline 0 N--CA 1.5 2.05 0 O-C-N 121.958 -0.464 . . . . 0.0 110.898 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.79 163.47 38.78 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 123.673 1.354 . . . . 0.0 110.714 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -107.94 42.16 1.41 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.424 -0.798 . . . . 0.0 110.355 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? . . . . . 0 N--CA 1.503 2.176 0 CA-C-O 118.083 -0.96 . . . . 0.0 111.065 179.754 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.857 0 CA-C-O 121.125 0.488 . . . . 0.0 110.51 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 t -147.86 175.33 11.04 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.447 -0.783 . . . . 0.0 110.557 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.95 -31.56 72.78 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.648 -0.658 . . . . 0.0 110.595 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 4' ' ' LEU . 3.3 mm? -74.16 -33.6 63.55 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.272 -0.893 . . . . 0.0 110.209 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.3 t -65.63 -49.87 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.586 -0.696 . . . . 0.0 110.274 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -62.82 -37.02 85.11 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.53 -0.731 . . . . 0.0 110.465 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.1 t -58.62 -46.32 87.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.306 -0.871 . . . . 0.0 109.611 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.492 ' CZ ' ' HD2' ' A' ' 12' ' ' ARG . 21.7 t80 -67.5 -43.84 79.91 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.569 -0.707 . . . . 0.0 109.305 178.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.67 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 1.4 mm? -60.86 -44.84 96.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.67 -0.644 . . . . 0.0 110.241 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.415 ' CE3' ' HG2' ' A' ' 11' ' ' GLN . 17.9 t90 -61.17 -40.69 94.83 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.635 -0.666 . . . . 0.0 110.079 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.474 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -57.0 -45.4 83.03 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.438 -0.789 . . . . 0.0 110.155 179.799 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.67 ' HD3' ' HA ' ' A' ' 9' ' ' LEU . 29.5 mtp85 -54.37 -41.83 69.62 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.754 -0.591 . . . . 0.0 110.409 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.485 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -54.37 -60.05 3.86 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.392 0.615 . . . . 0.0 110.051 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -68.51 -31.39 70.61 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.593 -0.692 . . . . 0.0 110.544 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -52.83 -43.83 66.28 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.448 -0.783 . . . . 0.0 109.579 179.197 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.512 ' O ' HG22 ' A' ' 20' ' ' VAL . 10.9 t90 -68.63 -47.09 67.51 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -57.28 -52.14 66.53 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.804 -0.56 . . . . 0.0 109.679 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.436 ' HE3' ' HA ' ' A' ' 18' ' ' TRP . 5.0 m95 -63.19 -33.3 75.18 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.33 -0.856 . . . . 0.0 110.151 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.518 ' HA ' ' HD2' ' A' ' 24' ' ' PRO . 5.0 m-20 -64.12 -41.0 97.4 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.453 -0.78 . . . . 0.0 110.681 179.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 16' ' ' TRP . 35.7 m -93.83 -18.84 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.224 -0.922 . . . . 0.0 111.21 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.1 m -91.84 -53.35 4.32 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.002 -1.061 . . . . 0.0 109.925 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.3 mt -83.56 -16.37 45.64 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.498 -0.751 . . . . 0.0 110.56 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 50.83 60.28 15.0 Favored Pre-proline 0 N--CA 1.501 2.106 0 O-C-N 121.668 -0.645 . . . . 0.0 110.866 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.518 ' HD2' ' HA ' ' A' ' 19' ' ' ASN . 48.5 Cg_endo -73.25 155.36 51.63 Favored 'Trans proline' 0 C--N 1.313 -1.333 0 O-C-N 123.57 1.3 . . . . 0.0 110.556 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -89.47 150.0 22.68 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.569 -0.707 . . . . 0.0 110.267 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.499 1.982 0 CA-C-O 118.55 -0.738 . . . . 0.0 110.85 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.499 1.978 0 CA-C-O 121.075 0.464 . . . . 0.0 110.665 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -165.6 149.77 8.36 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.281 -0.887 . . . . 0.0 110.36 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -94.99 -26.87 15.91 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.509 -0.744 . . . . 0.0 110.906 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.61 21.83 16.13 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.222 -0.924 . . . . 0.0 110.964 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.0 t -111.64 -36.44 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.249 -0.907 . . . . 0.0 110.006 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -98.22 -36.66 9.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.274 -0.891 . . . . 0.0 110.047 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.3 m -57.6 -52.79 63.99 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.602 -0.686 . . . . 0.0 110.747 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.663 ' CZ ' HD13 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -66.11 -27.86 68.37 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.377 -0.827 . . . . 0.0 110.149 179.632 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.663 HD13 ' CZ ' ' A' ' 8' ' ' TYR . 3.0 tp -70.55 -41.44 72.48 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.513 -0.742 . . . . 0.0 109.575 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.5 t90 -60.53 -47.38 86.41 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.506 -0.746 . . . . 0.0 109.371 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -60.05 -37.05 78.68 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.454 -0.779 . . . . 0.0 109.901 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.6 mtp85 -63.09 -39.15 93.87 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.501 -0.749 . . . . 0.0 110.159 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.459 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -63.2 -46.73 85.66 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.608 -0.682 . . . . 0.0 109.495 179.513 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.451 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 4.3 mt-10 -70.19 -36.63 74.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.408 -0.807 . . . . 0.0 109.699 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.43 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.3 OUTLIER -57.36 -48.96 77.67 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 178.628 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.5 t90 -69.76 -41.63 74.92 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.615 -0.678 . . . . 0.0 109.194 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.459 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 57.8 t80 -55.15 -58.93 5.68 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.704 -0.622 . . . . 0.0 109.416 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 23.7 m95 -61.4 -33.2 73.28 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.511 -0.743 . . . . 0.0 110.111 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 2.2 t30 -54.4 -37.51 65.12 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.487 -0.758 . . . . 0.0 110.463 179.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -102.91 -27.52 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.49 -0.756 . . . . 0.0 110.782 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 99.9 m -73.2 -39.12 65.82 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.251 -0.906 . . . . 0.0 110.862 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.422 ' HA ' HD23 ' A' ' 22' ' ' LEU . 45.7 mt -62.42 -34.98 77.83 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.511 -0.743 . . . . 0.0 110.929 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -121.02 79.7 33.79 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.286 -0.884 . . . . 0.0 110.278 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -76.87 70.62 6.47 Favored 'Trans proline' 0 C--N 1.315 -1.199 0 O-C-N 123.739 1.389 . . . . 0.0 110.27 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -116.43 -164.72 0.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.354 -0.842 . . . . 0.0 110.34 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 tpt85 . . . . . 0 N--CA 1.496 1.85 0 CA-C-O 118.361 -0.828 . . . . 0.0 110.272 179.888 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 9.2 ttp-105 . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 121.268 0.556 . . . . 0.0 110.075 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.589 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 1.2 m -143.22 130.33 20.74 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.317 -0.865 . . . . 0.0 110.496 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -106.56 -34.64 7.3 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.599 -0.688 . . . . 0.0 110.689 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -106.01 -13.42 15.48 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.395 -0.816 . . . . 0.0 111.438 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.589 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 59.5 t -68.26 -50.44 57.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 121.214 -0.929 . . . . 0.0 110.059 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -65.08 -37.85 88.87 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.469 -0.769 . . . . 0.0 110.087 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.3 m -61.92 -44.41 96.83 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.319 -0.863 . . . . 0.0 109.728 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -60.79 -41.31 95.33 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.551 -0.718 . . . . 0.0 109.308 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.36 -39.41 71.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.699 -0.625 . . . . 0.0 109.996 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -64.63 -47.47 78.43 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.637 -0.665 . . . . 0.0 110.097 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -54.84 -40.42 69.6 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.369 -0.832 . . . . 0.0 110.363 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -41.59 87.08 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.561 -0.712 . . . . 0.0 110.341 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.409 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -59.55 -46.87 87.61 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.343 -0.848 . . . . 0.0 109.557 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 2.8 mt-10 -70.88 -37.77 73.06 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.343 -0.848 . . . . 0.0 110.038 179.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -46.84 72.01 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.544 -0.723 . . . . 0.0 109.546 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -64.35 -45.95 85.58 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.524 -0.735 . . . . 0.0 109.335 178.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.41 ' CZ ' HG21 ' A' ' 21' ' ' THR . 82.4 t80 -52.46 -47.49 66.44 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.781 -0.575 . . . . 0.0 109.664 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 22.2 m95 -63.14 -38.05 89.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.579 -0.701 . . . . 0.0 110.147 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -54.79 -35.43 63.85 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.223 -0.923 . . . . 0.0 110.94 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.4 m -106.72 -2.78 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.075 -1.015 . . . . 0.0 111.617 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.41 HG21 ' CZ ' ' A' ' 17' ' ' PHE . 82.2 m -113.37 -16.81 12.41 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.033 -1.042 . . . . 0.0 111.341 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.3 mt -59.61 -34.96 73.43 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.2 -0.937 . . . . 0.0 110.645 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.8 ttm105 58.02 75.8 0.51 Allowed Pre-proline 0 N--CA 1.499 1.993 0 O-C-N 121.865 -0.522 . . . . 0.0 110.554 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.77 171.86 16.48 Favored 'Trans proline' 0 C--N 1.315 -1.23 0 O-C-N 123.841 1.443 . . . . 0.0 110.926 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -78.59 -38.08 40.9 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.571 -0.706 . . . . 0.0 110.544 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 . . . . . 0 N--CA 1.501 2.076 0 CA-C-O 118.188 -0.91 . . . . 0.0 110.949 -179.864 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.8 mtt180 . . . . . 0 N--CA 1.495 1.793 0 CA-C-O 121.074 0.464 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.419 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.4 OUTLIER -73.27 147.97 44.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.408 -0.807 . . . . 0.0 110.359 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -106.47 -40.87 5.45 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.592 -0.693 . . . . 0.0 110.873 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.95 10.7 11.06 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.299 -0.876 . . . . 0.0 111.446 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.525 HG12 HD12 ' A' ' 9' ' ' LEU . 70.9 t -99.35 -50.4 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.098 -1.002 . . . . 0.0 109.586 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.29 -37.67 88.32 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.537 -0.727 . . . . 0.0 110.417 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.6 p -58.15 -53.15 61.47 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.452 -0.78 . . . . 0.0 109.421 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 32.1 t80 -65.39 -39.39 92.16 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.525 HD12 HG12 ' A' ' 5' ' ' VAL . 12.5 mt -60.43 -34.82 74.51 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.712 -0.618 . . . . 0.0 109.851 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -73.55 -40.4 63.99 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.463 -0.773 . . . . 0.0 109.654 178.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.454 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.95 -36.21 78.77 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.556 -0.715 . . . . 0.0 109.945 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -55.29 -39.44 69.88 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.56 -0.713 . . . . 0.0 110.328 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.506 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -56.26 -61.03 2.67 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-O 121.387 0.613 . . . . 0.0 110.506 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.5 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 20.1 mt-10 -69.53 -30.44 68.27 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.578 -0.701 . . . . 0.0 110.823 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -52.38 -49.48 64.34 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.377 -0.827 . . . . 0.0 109.41 179.29 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.475 ' O ' HG22 ' A' ' 20' ' ' VAL . 15.8 t90 -69.2 -43.61 73.81 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.548 -0.72 . . . . 0.0 109.461 178.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.5 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 34.5 t80 -55.92 -55.36 33.52 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.658 -0.651 . . . . 0.0 109.578 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 40.1 m95 -63.05 -33.22 74.98 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.478 -0.764 . . . . 0.0 110.112 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 16.5 t-20 -59.02 -39.45 81.95 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.509 -0.744 . . . . 0.0 110.901 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.475 HG22 ' O ' ' A' ' 16' ' ' TRP . 28.2 m -101.63 2.65 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 O-C-N 121.246 -0.909 . . . . 0.0 111.257 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.6 m -106.2 -38.36 6.28 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.089 -1.007 . . . . 0.0 110.472 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.476 ' HB3' ' HD3' ' A' ' 23' ' ' ARG . 80.2 mt -66.17 -58.2 5.94 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.464 -0.772 . . . . 0.0 110.386 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.476 ' HD3' ' HB3' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -165.38 81.51 1.16 Allowed Pre-proline 0 N--CA 1.497 1.913 0 O-C-N 121.485 -0.759 . . . . 0.0 110.236 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.439 ' HB3' ' HA ' ' A' ' 20' ' ' VAL . 47.7 Cg_endo -72.28 175.6 9.76 Favored 'Trans proline' 0 C--N 1.313 -1.316 0 O-C-N 123.932 1.491 . . . . 0.0 110.884 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER 60.99 178.17 0.1 Allowed 'General case' 0 N--CA 1.505 2.275 0 CA-C-O 121.286 0.565 . . . . 0.0 111.002 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.035 0 O-C-N 121.27 -0.894 . . . . 0.0 110.834 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.879 0 CA-C-O 121.061 0.458 . . . . 0.0 110.443 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -119.0 162.22 18.91 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.462 -0.774 . . . . 0.0 109.921 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -90.78 -40.23 11.92 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.42 -0.8 . . . . 0.0 110.556 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.4 tp -91.73 21.83 4.52 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.285 -0.884 . . . . 0.0 110.882 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.9 t -124.12 -46.0 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.207 -0.933 . . . . 0.0 110.356 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.451 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.7 OUTLIER -72.91 -23.06 60.66 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.34 -0.85 . . . . 0.0 110.85 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -50.71 -55.77 15.06 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.407 -0.808 . . . . 0.0 110.796 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -74.37 -42.97 58.42 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.463 -0.773 . . . . 0.0 109.858 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 9.0 mt -56.12 -40.08 73.2 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.66 -0.65 . . . . 0.0 110.782 -179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -72.32 -48.82 39.07 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.383 -0.823 . . . . 0.0 110.044 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 6.1 tp60 -63.04 -54.72 33.73 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.416 -0.802 . . . . 0.0 110.652 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.23 -38.23 39.48 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.457 -0.777 . . . . 0.0 110.812 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.534 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -59.89 -57.8 11.32 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.429 -0.794 . . . . 0.0 110.798 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -77.35 -42.52 36.26 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.712 -0.617 . . . . 0.0 111.469 -178.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -53.42 -43.36 67.9 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.18 -0.95 . . . . 0.0 109.588 179.619 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.49 ' CD1' HG21 ' A' ' 20' ' ' VAL . 28.2 t90 -69.17 -46.04 68.51 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.455 -0.778 . . . . 0.0 109.13 178.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -59.18 -43.78 92.17 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.497 -0.752 . . . . 0.0 110.156 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.488 ' O ' HD12 ' A' ' 22' ' ' LEU . 3.9 m95 -75.21 -13.67 60.47 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.409 -0.807 . . . . 0.0 111.064 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -101.68 -24.48 14.09 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.849 -1.157 . . . . 0.0 110.659 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.49 HG21 ' CD1' ' A' ' 16' ' ' TRP . 48.0 t -105.89 -40.9 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.294 -0.879 . . . . 0.0 111.037 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.2 m -77.86 -34.35 51.76 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.196 -0.94 . . . . 0.0 111.141 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.488 HD12 ' O ' ' A' ' 18' ' ' TRP . 31.0 mt -71.56 -63.92 1.03 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.376 -0.827 . . . . 0.0 110.033 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? 48.57 63.45 10.34 Favored Pre-proline 0 N--CA 1.502 2.17 0 O-C-N 121.853 -0.529 . . . . 0.0 110.925 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -77.4 82.96 2.25 Favored 'Trans proline' 0 C--N 1.315 -1.188 0 O-C-N 123.643 1.339 . . . . 0.0 110.489 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 54.3 40.06 31.41 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.548 -0.72 . . . . 0.0 110.744 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.9 mtm-85 . . . . . 0 N--CA 1.496 1.874 0 CA-C-O 117.927 -1.035 . . . . 0.0 110.464 179.945 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 121.299 0.571 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.08 148.61 40.42 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.214 -0.929 . . . . 0.0 110.267 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.79 -10.6 21.63 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.613 -0.679 . . . . 0.0 111.082 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.9 tp -101.31 2.3 39.57 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.221 -0.924 . . . . 0.0 110.972 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.4 t -106.32 -57.1 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.255 -0.903 . . . . 0.0 109.866 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -62.93 -42.5 99.82 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.56 -0.713 . . . . 0.0 110.442 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.3 t -58.42 -47.61 83.37 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.403 -0.81 . . . . 0.0 109.533 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -66.53 -40.37 89.09 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.746 -0.596 . . . . 0.0 109.705 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.458 ' HA ' HD22 ' A' ' 9' ' ' LEU . 0.6 OUTLIER -54.74 -36.98 65.36 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.685 -0.634 . . . . 0.0 110.669 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -83.15 -45.97 13.29 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.376 -0.828 . . . . 0.0 109.925 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.98 -48.09 83.45 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.422 -0.799 . . . . 0.0 110.177 -179.865 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.25 -39.34 69.66 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.46 -0.775 . . . . 0.0 110.008 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.505 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -55.76 -60.82 2.91 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.373 0.606 . . . . 0.0 110.349 179.633 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -70.86 -31.16 67.76 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.84 -0.538 . . . . 0.0 110.856 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.446 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.7 OUTLIER -50.74 -46.36 59.21 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.422 -0.799 . . . . 0.0 109.62 179.237 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.636 ' NE1' HG21 ' A' ' 20' ' ' VAL . 6.7 t90 -73.04 -44.57 60.59 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.506 -0.746 . . . . 0.0 109.177 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -55.18 -45.06 75.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.538 -0.726 . . . . 0.0 109.99 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.525 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -73.51 -43.33 60.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.421 -0.799 . . . . 0.0 110.193 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -62.73 -36.14 82.04 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.361 -0.837 . . . . 0.0 110.82 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.636 HG21 ' NE1' ' A' ' 16' ' ' TRP . 90.2 t -84.01 -36.65 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.216 -0.927 . . . . 0.0 110.78 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.3 m -78.91 -42.51 26.96 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.126 -0.984 . . . . 0.0 110.722 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 18' ' ' TRP . 12.4 mt -86.79 -27.56 23.5 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.38 -0.825 . . . . 0.0 110.721 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 6.3 ttt-85 55.74 71.66 1.19 Allowed Pre-proline 0 N--CA 1.5 2.05 0 O-C-N 121.73 -0.606 . . . . 0.0 110.518 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -73.46 149.87 45.26 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 O-C-N 123.726 1.382 . . . . 0.0 110.794 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -96.32 -51.47 4.37 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.685 -0.634 . . . . 0.0 110.223 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.228 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 120.98 0.419 . . . . 0.0 110.473 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.484 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.2 OUTLIER -127.24 172.34 10.67 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.47 -0.769 . . . . 0.0 110.536 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -91.1 -42.12 10.66 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.491 -0.756 . . . . 0.0 110.706 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.44 14.25 31.78 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.423 -0.798 . . . . 0.0 111.112 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.484 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 40.7 t -121.49 -49.09 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.189 -0.944 . . . . 0.0 109.869 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.43 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.9 OUTLIER -64.95 -31.25 72.39 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.397 -0.814 . . . . 0.0 110.68 179.825 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -54.15 -46.64 72.33 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.417 -0.802 . . . . 0.0 109.774 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -71.43 -40.14 70.59 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.548 -0.72 . . . . 0.0 109.578 178.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.451 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.9 mm? -61.69 -48.73 79.47 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.587 -0.696 . . . . 0.0 109.833 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -65.9 -39.57 90.74 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.49 -0.756 . . . . 0.0 109.515 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -60.82 -43.26 98.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.476 -0.765 . . . . 0.0 110.189 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -24.48 53.57 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.579 -0.701 . . . . 0.0 110.974 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.549 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -78.16 -60.6 2.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.256 -0.903 . . . . 0.0 110.236 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -71.36 -28.89 64.37 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.521 -0.737 . . . . 0.0 111.382 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 2.4 t-20 -53.31 -51.52 62.07 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.174 -0.954 . . . . 0.0 109.539 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -65.33 -43.75 89.97 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -55.59 -59.26 5.09 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.709 -0.619 . . . . 0.0 109.808 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 6.9 m95 -60.53 -33.12 72.19 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.368 -0.832 . . . . 0.0 110.346 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -57.04 -39.94 75.8 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.308 -0.87 . . . . 0.0 110.217 179.511 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.547 ' HA ' ' HB3' ' A' ' 24' ' ' PRO . 27.1 m -95.53 -29.44 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.317 -0.865 . . . . 0.0 110.499 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 94.2 m -68.95 -42.41 76.72 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.209 -0.932 . . . . 0.0 109.987 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.4 mt -80.58 -69.37 0.6 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.486 -0.759 . . . . 0.0 110.237 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -154.86 97.41 2.49 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.443 -0.785 . . . . 0.0 109.975 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.547 ' HB3' ' HA ' ' A' ' 20' ' ' VAL . 44.2 Cg_endo -72.38 126.21 11.41 Favored 'Trans proline' 0 C--N 1.313 -1.3 0 O-C-N 123.912 1.48 . . . . 0.0 110.779 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -94.45 -59.37 1.96 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.499 -0.75 . . . . 0.0 110.197 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.292 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 . . . . . 0 N--CA 1.495 1.813 0 CA-C-O 121.24 0.543 . . . . 0.0 110.09 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.635 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.4 OUTLIER -142.6 144.18 32.73 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.459 -0.775 . . . . 0.0 110.33 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -104.2 -44.62 4.92 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.67 -0.643 . . . . 0.0 110.73 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.31 -37.22 15.07 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.403 -0.811 . . . . 0.0 110.754 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.635 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 84.6 t -58.22 -41.62 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.527 -0.733 . . . . 0.0 110.128 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -62.7 -37.43 86.46 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.531 -0.731 . . . . 0.0 110.209 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.9 m -58.94 -49.75 76.64 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.387 -0.821 . . . . 0.0 109.406 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -65.02 -45.87 83.73 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.672 -0.642 . . . . 0.0 109.356 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -58.29 -43.95 88.27 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.718 -0.614 . . . . 0.0 109.875 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -67.54 -42.9 81.96 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.584 -0.698 . . . . 0.0 109.509 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.48 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 19.5 mm-40 -64.67 -50.94 65.06 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.516 -0.74 . . . . 0.0 110.126 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -53.17 -34.96 59.13 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.503 -0.748 . . . . 0.0 110.347 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.498 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -61.3 -55.26 33.78 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.565 -0.709 . . . . 0.0 110.676 179.814 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -78.9 -42.71 26.48 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.699 -0.626 . . . . 0.0 111.363 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -55.6 -38.3 69.24 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.467 -0.771 . . . . 0.0 110.301 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -63.66 -49.0 74.91 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.412 -0.805 . . . . 0.0 109.453 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -56.22 -51.01 69.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.708 -0.62 . . . . 0.0 109.79 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.525 ' HB3' HD12 ' A' ' 22' ' ' LEU . 30.9 m95 -63.41 -31.83 73.09 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.525 -0.735 . . . . 0.0 110.769 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.15 -41.76 97.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.299 -0.876 . . . . 0.0 110.51 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.6 m -89.76 -14.42 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.326 -0.858 . . . . 0.0 110.969 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.2 m -92.76 -35.41 13.45 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.124 -0.985 . . . . 0.0 110.636 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 18' ' ' TRP . 31.7 mt -91.87 -86.82 0.22 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.313 -0.867 . . . . 0.0 110.326 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.8 ttt180 -166.36 116.28 0.77 Allowed Pre-proline 0 N--CA 1.495 1.786 0 O-C-N 121.316 -0.865 . . . . 0.0 110.237 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.51 142.7 49.78 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.865 1.455 . . . . 0.0 110.664 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -96.41 -55.67 2.86 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.686 -0.634 . . . . 0.0 110.202 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.117 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.026 0.441 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.35 147.4 42.22 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.432 -0.793 . . . . 0.0 110.307 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.35 -38.11 5.57 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.469 -0.769 . . . . 0.0 110.835 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.13 13.35 6.35 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.32 -0.863 . . . . 0.0 111.525 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.8 t -100.74 -39.09 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.077 -1.014 . . . . 0.0 110.343 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -90.8 -37.88 13.35 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.238 -0.914 . . . . 0.0 110.584 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.9 t -58.56 -52.51 65.37 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.481 -0.762 . . . . 0.0 110.783 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.579 ' CE1' HD13 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -63.07 -30.84 71.91 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.369 -0.832 . . . . 0.0 110.266 179.907 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.579 HD13 ' CE1' ' A' ' 8' ' ' TYR . 3.6 tp -67.59 -46.94 71.17 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.368 -0.832 . . . . 0.0 109.732 179.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.439 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 4.0 t-105 -60.02 -37.24 79.16 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.621 -0.674 . . . . 0.0 109.379 179.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.515 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -60.64 -46.81 88.9 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.568 -0.707 . . . . 0.0 109.592 179.053 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.41 -39.24 56.85 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.74 -0.6 . . . . 0.0 110.483 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.516 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -59.42 -57.46 12.91 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.598 -0.689 . . . . 0.0 110.645 -179.914 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -75.48 -40.0 57.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.598 -0.689 . . . . 0.0 111.603 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -51.86 -43.33 63.21 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.304 -0.873 . . . . 0.0 110.179 -179.825 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.1 t90 -66.61 -48.9 68.06 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.413 -0.804 . . . . 0.0 109.24 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -56.59 -51.76 67.4 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.796 -0.565 . . . . 0.0 109.877 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.405 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.3 m95 -63.87 -30.42 71.51 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.528 -0.732 . . . . 0.0 110.428 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.486 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 8.7 t-20 -65.14 -46.45 80.87 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.268 -0.895 . . . . 0.0 110.65 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.5 m -86.36 -26.05 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.283 -0.885 . . . . 0.0 111.133 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.7 m -78.81 -36.96 41.89 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.215 -0.928 . . . . 0.0 110.648 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.405 HD12 ' HB3' ' A' ' 18' ' ' TRP . 60.9 mt -89.31 -26.24 21.22 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.333 -0.854 . . . . 0.0 110.838 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 12.6 mtt85 57.56 91.1 0.08 OUTLIER Pre-proline 0 N--CA 1.502 2.165 0 O-C-N 121.817 -0.552 . . . . 0.0 111.019 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.76 119.18 6.14 Favored 'Trans proline' 0 C--N 1.314 -1.25 0 O-C-N 123.674 1.355 . . . . 0.0 110.05 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 55.08 64.26 1.85 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.728 -0.608 . . . . 0.0 110.026 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 . . . . . 0 N--CA 1.502 2.149 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.686 -179.721 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.776 0 CA-C-O 121.256 0.551 . . . . 0.0 110.182 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.6 m -144.04 158.26 43.82 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.388 -0.82 . . . . 0.0 110.25 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -42.27 99.21 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.544 -0.722 . . . . 0.0 110.317 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.67 -35.02 67.61 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.455 -0.778 . . . . 0.0 110.366 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.0 t -70.38 -48.01 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.447 -0.783 . . . . 0.0 110.157 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.509 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 1.3 t-20 -65.47 -36.08 82.82 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.542 -0.724 . . . . 0.0 110.508 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.1 t -57.1 -44.29 83.05 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.47 -0.769 . . . . 0.0 109.968 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -77.96 -37.27 47.88 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.449 -0.782 . . . . 0.0 109.598 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 12.3 mt -56.5 -41.87 77.37 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.677 -0.639 . . . . 0.0 110.281 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.45 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 4.5 t-105 -58.79 -42.95 90.27 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.447 -0.783 . . . . 0.0 109.584 179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -61.5 -44.36 97.2 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.435 -0.79 . . . . 0.0 109.433 179.129 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -54.59 -39.15 67.56 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.712 -0.618 . . . . 0.0 110.144 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.521 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -56.79 -60.05 4.13 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.39 0.614 . . . . 0.0 110.248 179.747 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.66 -33.49 72.66 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.556 -0.715 . . . . 0.0 110.567 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -52.19 -43.74 64.33 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.475 -0.766 . . . . 0.0 109.838 179.437 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.524 ' O ' HG22 ' A' ' 20' ' ' VAL . 7.0 t90 -70.06 -45.53 66.89 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.54 -0.725 . . . . 0.0 109.224 178.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -58.81 -48.76 80.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.826 -0.546 . . . . 0.0 109.748 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.519 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -67.5 -33.84 75.93 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.454 -0.779 . . . . 0.0 110.019 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 19.9 t-20 -64.46 -45.01 89.27 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.335 -0.853 . . . . 0.0 110.549 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 16' ' ' TRP . 29.9 m -85.08 -24.63 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.21 -0.932 . . . . 0.0 111.263 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 65.9 m -84.46 -40.35 17.83 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.065 -1.022 . . . . 0.0 110.469 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.519 HD12 ' HB3' ' A' ' 18' ' ' TRP . 10.9 mt -96.55 -22.19 17.23 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.435 -0.791 . . . . 0.0 110.829 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 52.92 65.88 5.45 Favored Pre-proline 0 N--CA 1.5 2.061 0 O-C-N 121.663 -0.648 . . . . 0.0 110.488 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.8 91.76 0.8 Allowed 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.718 1.378 . . . . 0.0 110.914 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -112.3 139.12 48.12 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 110.217 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.915 0 CA-C-O 118.268 -0.873 . . . . 0.0 110.615 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.0 ttm180 . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 121.033 0.444 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.52 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 0.4 OUTLIER -162.77 175.65 11.08 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.582 -0.699 . . . . 0.0 110.179 -179.947 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.01 -38.98 8.76 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.361 -0.837 . . . . 0.0 110.75 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 mt -106.31 9.32 31.98 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.375 -0.828 . . . . 0.0 111.515 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.52 ' HB ' ' HB2' ' A' ' 2' ' ' SER . 78.5 t -108.83 -56.81 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.04 -1.038 . . . . 0.0 109.644 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -65.2 -38.92 91.99 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.63 -0.669 . . . . 0.0 110.165 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.1 t -58.07 -47.75 82.22 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.459 -0.776 . . . . 0.0 109.654 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -69.26 -41.87 76.32 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.55 -0.718 . . . . 0.0 109.836 179.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.89 -40.41 95.31 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.54 -0.725 . . . . 0.0 110.528 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.7 t90 -66.2 -46.88 75.75 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.337 -0.852 . . . . 0.0 110.154 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -37.58 67.74 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.339 -0.851 . . . . 0.0 110.222 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -32.4 68.87 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.569 -0.707 . . . . 0.0 110.394 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.74 -44.89 88.68 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.458 -0.776 . . . . 0.0 109.983 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -70.2 -39.94 74.89 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.327 -0.858 . . . . 0.0 109.964 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.53 -48.26 77.63 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.498 -0.751 . . . . 0.0 109.282 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -68.74 -42.57 77.39 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.597 -0.689 . . . . 0.0 109.452 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.3 -57.84 10.85 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.711 -0.618 . . . . 0.0 110.207 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.473 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.6 m95 -59.52 -37.12 77.51 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.332 -0.855 . . . . 0.0 110.428 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -56.35 -44.91 80.53 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.505 -0.747 . . . . 0.0 110.821 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.5 m -92.74 -31.78 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.3 -0.875 . . . . 0.0 110.976 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.8 m -69.74 -32.19 70.59 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.184 -0.947 . . . . 0.0 110.264 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.473 HD12 ' HB3' ' A' ' 18' ' ' TRP . 10.4 mt -105.4 -103.3 0.32 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.441 -0.787 . . . . 0.0 109.367 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.741 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER 173.91 -55.48 0.0 OUTLIER Pre-proline 0 N--CA 1.503 2.179 0 O-C-N 121.541 -0.724 . . . . 0.0 110.483 179.346 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.741 ' HD3' ' HB3' ' A' ' 23' ' ' ARG . 53.8 Cg_endo -79.82 -171.77 1.34 Allowed 'Trans proline' 0 N--CA 1.487 1.112 0 O-C-N 123.286 1.15 . . . . 0.0 110.953 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.6 166.85 22.08 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.507 -0.746 . . . . 0.0 110.158 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.304 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 27.2 ttt85 . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 120.979 0.418 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.39 -166.26 0.16 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.686 -0.634 . . . . 0.0 110.7 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -114.58 -50.44 2.79 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.153 -0.967 . . . . 0.0 110.89 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.16 26.64 3.19 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.316 -0.865 . . . . 0.0 111.036 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 52.5 t -106.25 -53.99 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.16 -0.962 . . . . 0.0 109.682 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.422 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.6 OUTLIER -65.88 -35.68 81.33 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.449 -0.782 . . . . 0.0 110.165 179.495 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.9 p -59.68 -48.79 80.27 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.453 -0.78 . . . . 0.0 109.24 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -66.62 -37.73 85.47 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.644 -0.66 . . . . 0.0 109.221 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 9' ' ' LEU . 11.5 mt -58.75 -44.78 90.63 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.717 -0.614 . . . . 0.0 109.963 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.7 t90 -62.85 -45.75 91.1 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.645 -0.659 . . . . 0.0 109.366 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -39.79 74.07 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.514 -0.741 . . . . 0.0 110.011 179.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -63.54 -39.75 95.23 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.622 -0.674 . . . . 0.0 110.385 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -45.69 92.73 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.475 -0.766 . . . . 0.0 109.72 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -72.69 -39.05 67.33 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.252 -0.905 . . . . 0.0 109.726 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.63 -42.91 68.29 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.602 -0.686 . . . . 0.0 109.86 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -70.39 -45.12 66.6 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.453 -0.779 . . . . 0.0 109.297 179.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -55.47 -45.88 76.91 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.69 -0.631 . . . . 0.0 109.65 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 25.6 m95 -72.84 -36.52 67.48 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.613 -0.679 . . . . 0.0 109.958 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -53.99 -43.43 69.98 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.547 -0.721 . . . . 0.0 110.651 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.528 ' HA ' ' CD ' ' A' ' 23' ' ' ARG . 28.8 m -84.46 -27.93 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.374 -0.829 . . . . 0.0 110.896 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.8 m -80.54 -24.54 39.22 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.219 -0.926 . . . . 0.0 110.917 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.3 -3.53 47.23 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.305 -0.872 . . . . 0.0 111.366 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.528 ' CD ' ' HA ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -48.47 -55.37 19.48 Favored Pre-proline 0 N--CA 1.504 2.246 0 O-C-N 121.394 -0.816 . . . . 0.0 111.237 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 46.8 Cg_endo -71.95 98.56 0.9 Allowed 'Trans proline' 0 N--CA 1.486 1.04 0 O-C-N 123.468 1.246 . . . . 0.0 110.375 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.21 -167.23 0.98 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.466 -0.771 . . . . 0.0 110.559 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.749 0 O-C-N 121.318 -0.864 . . . . 0.0 110.268 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 28.9 ttp85 . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 120.992 0.425 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.656 ' O ' ' HB3' ' A' ' 3' ' ' ALA . 48.7 m 54.29 -114.09 0.84 Allowed 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.771 -0.581 . . . . 0.0 110.597 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 2' ' ' SER . . . 74.32 -48.53 0.66 Allowed 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.545 -0.722 . . . . 0.0 110.641 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.7 mt -114.3 9.81 17.03 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.28 -0.887 . . . . 0.0 110.596 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.8 t -116.67 -47.64 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.27 -0.894 . . . . 0.0 109.689 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.94 -34.05 30.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.429 -0.794 . . . . 0.0 110.408 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.6 m -52.72 -48.09 66.9 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.462 -0.774 . . . . 0.0 110.232 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -70.03 -43.14 71.93 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.464 -0.773 . . . . 0.0 109.519 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 9' ' ' LEU . 9.1 mt -59.57 -43.46 93.59 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.678 -0.639 . . . . 0.0 110.12 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -62.51 -44.94 95.14 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.637 -0.665 . . . . 0.0 110.032 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -59.08 -41.33 87.76 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.283 -0.886 . . . . 0.0 110.103 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -39.49 94.92 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.607 -0.683 . . . . 0.0 110.364 179.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -45.43 93.49 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.471 -0.768 . . . . 0.0 109.94 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -72.59 -34.87 67.72 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.233 -0.917 . . . . 0.0 109.956 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.31 -47.74 72.1 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.524 -0.735 . . . . 0.0 109.521 178.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -74.16 -41.93 60.72 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.519 -0.738 . . . . 0.0 109.582 179.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -55.36 -47.99 74.91 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.544 -0.723 . . . . 0.0 110.427 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 21.1 m95 -72.53 -33.42 66.85 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.447 -0.783 . . . . 0.0 110.379 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -58.96 -30.57 68.0 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.364 -0.835 . . . . 0.0 110.774 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.6 m -100.12 -19.94 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.236 -0.915 . . . . 0.0 110.835 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.4 m -88.91 -27.05 21.24 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.237 -0.914 . . . . 0.0 110.782 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.3 mt -83.96 -22.38 31.47 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.269 -0.894 . . . . 0.0 110.969 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.518 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -59.72 -52.96 70.17 Favored Pre-proline 0 N--CA 1.499 2.001 0 O-C-N 121.454 -0.779 . . . . 0.0 110.841 -179.889 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.518 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 50.8 Cg_endo -87.26 22.38 0.93 Allowed 'Trans proline' 0 C--N 1.32 -0.971 0 O-C-N 123.478 1.251 . . . . 0.0 111.496 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.0 -177.32 0.08 Allowed 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.405 -0.809 . . . . 0.0 111.308 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.627 -179.789 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.122 0.486 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.656 ' HB3' HG23 ' A' ' 5' ' ' VAL . 0.1 OUTLIER -81.25 141.43 34.13 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.405 -0.809 . . . . 0.0 110.621 -179.907 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -72.57 -22.98 60.91 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.551 -0.718 . . . . 0.0 111.044 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -84.87 6.43 24.8 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.201 -0.937 . . . . 0.0 111.408 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.656 HG23 ' HB3' ' A' ' 2' ' ' SER . 95.2 t -101.51 -50.22 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 121.112 -0.993 . . . . 0.0 109.999 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -74.42 -40.78 61.77 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.498 -0.751 . . . . 0.0 110.624 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 m -54.65 -52.32 62.66 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.36 -0.837 . . . . 0.0 109.747 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -62.73 -42.65 99.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.521 -0.737 . . . . 0.0 109.386 178.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.431 ' HA ' HD23 ' A' ' 9' ' ' LEU . 8.6 mt -58.76 -44.76 90.67 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.634 -0.666 . . . . 0.0 109.901 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -64.81 -42.86 94.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.712 -0.617 . . . . 0.0 109.673 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -61.19 -39.58 90.72 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.289 -0.882 . . . . 0.0 110.312 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -37.27 86.95 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.402 -0.811 . . . . 0.0 110.275 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.424 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -65.79 -46.35 79.02 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.369 -0.832 . . . . 0.0 109.596 179.653 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.413 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 3.9 mt-10 -68.62 -35.25 77.06 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.399 -0.813 . . . . 0.0 109.932 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 2.3 t-20 -55.83 -53.22 59.38 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.56 -0.713 . . . . 0.0 109.227 178.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.4 ' O ' HG22 ' A' ' 20' ' ' VAL . 9.2 t90 -65.85 -42.25 90.68 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.676 -0.64 . . . . 0.0 109.396 178.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.424 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 55.4 t80 -54.87 -57.53 11.22 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.715 -0.616 . . . . 0.0 109.828 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.415 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 16.3 m95 -64.52 -32.91 74.75 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.368 -0.832 . . . . 0.0 110.185 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 3.6 t30 -55.92 -35.31 66.45 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.455 -0.778 . . . . 0.0 110.491 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 16' ' ' TRP . 30.1 m -104.33 -9.59 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.283 -0.885 . . . . 0.0 111.002 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.415 ' HB ' ' HA ' ' A' ' 18' ' ' TRP . 67.1 m -93.44 -33.05 13.97 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.188 -0.945 . . . . 0.0 110.496 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.3 mt -82.35 -20.02 38.1 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.407 -0.808 . . . . 0.0 110.911 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.584 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -63.62 -52.86 55.86 Favored Pre-proline 0 N--CA 1.498 1.942 0 O-C-N 121.363 -0.836 . . . . 0.0 111.017 -179.767 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 23' ' ' ARG . 52.5 Cg_endo -78.34 50.85 3.49 Favored 'Trans proline' 0 N--CA 1.488 1.2 0 O-C-N 123.37 1.195 . . . . 0.0 110.627 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -166.05 160.75 16.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.253 -0.905 . . . . 0.0 110.161 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 117.828 -1.082 . . . . 0.0 110.4 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.815 0 CA-C-O 121.05 0.452 . . . . 0.0 110.103 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 t -75.51 148.74 38.72 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.385 -0.822 . . . . 0.0 110.006 179.682 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.46 -4.8 16.06 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.46 -0.775 . . . . 0.0 111.321 -179.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.6 mt -117.9 -4.73 11.08 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.002 -1.061 . . . . 0.0 111.303 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 58.9 t -114.96 -53.86 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.082 -1.011 . . . . 0.0 110.175 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -85.65 -13.76 47.62 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.507 -0.745 . . . . 0.0 111.324 -179.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.53 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -63.86 -57.56 9.47 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.044 -1.035 . . . . 0.0 110.006 179.636 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -69.68 -14.74 62.96 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.316 -0.865 . . . . 0.0 111.158 179.69 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -95.82 -28.51 14.7 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.15 -0.969 . . . . 0.0 111.217 -179.595 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -99.84 -48.47 4.68 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.165 -0.959 . . . . 0.0 110.917 -179.656 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.53 ' HB2' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -55.02 -32.74 62.05 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.266 -0.896 . . . . 0.0 110.843 -179.542 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -61.09 -38.15 85.24 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.327 -0.858 . . . . 0.0 110.114 179.395 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.412 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -59.78 -45.14 93.22 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.646 -0.659 . . . . 0.0 109.553 179.7 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.412 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 21.7 mt-10 -69.18 -35.76 76.61 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.394 -0.816 . . . . 0.0 109.897 179.485 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -49.5 67.41 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.518 -0.739 . . . . 0.0 109.338 179.109 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -69.67 -43.19 73.02 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.492 -0.755 . . . . 0.0 109.279 178.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.76 -53.18 60.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.749 -0.595 . . . . 0.0 110.182 179.848 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 8.1 m95 -64.42 -36.46 84.23 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.299 -0.876 . . . . 0.0 110.197 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -58.49 -34.24 70.7 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.472 -0.767 . . . . 0.0 111.271 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.4 m -103.17 -27.66 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.206 -0.934 . . . . 0.0 111.115 -179.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.7 m -77.42 -41.65 39.09 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.163 -0.96 . . . . 0.0 110.768 -179.632 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.7 mt -67.7 -35.27 78.5 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.427 -0.796 . . . . 0.0 110.47 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -131.86 88.58 41.44 Favored Pre-proline 0 N--CA 1.493 1.677 0 O-C-N 121.51 -0.744 . . . . 0.0 110.08 179.782 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.8 151.63 57.48 Favored 'Trans proline' 0 C--N 1.312 -1.349 0 O-C-N 123.825 1.434 . . . . 0.0 110.721 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.42 155.25 43.03 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.713 -0.617 . . . . 0.0 110.416 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.893 0 CA-C-O 117.774 -1.108 . . . . 0.0 110.688 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 121.255 0.55 . . . . 0.0 110.039 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.515 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.4 OUTLIER -149.33 148.74 29.87 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.282 -0.886 . . . . 0.0 110.321 -179.892 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.06 -32.47 6.56 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.438 -0.789 . . . . 0.0 111.257 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 mp -105.64 14.83 27.85 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.117 -0.989 . . . . 0.0 111.438 -179.536 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 54.2 t -98.12 -33.42 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 O-C-N 121.132 -0.98 . . . . 0.0 109.912 179.345 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -87.27 -26.45 23.45 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.249 -0.907 . . . . 0.0 110.284 179.39 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 57.7 m -61.25 -56.0 25.62 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.526 -0.734 . . . . 0.0 110.718 -179.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.485 ' CZ ' HD13 ' A' ' 9' ' ' LEU . 1.2 p90 -67.2 -26.6 66.7 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.259 -0.901 . . . . 0.0 110.388 179.89 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' A' ' 9' ' ' LEU . 1.4 tp -60.32 -42.86 96.48 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.327 -0.858 . . . . 0.0 109.836 178.949 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.605 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -78.06 -36.92 47.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.361 -0.837 . . . . 0.0 109.841 179.378 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -66.66 -47.6 71.99 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.403 -0.811 . . . . 0.0 109.727 179.385 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' A' ' 16' ' ' TRP . 9.1 tmm_? -59.07 -17.23 24.05 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.487 -0.758 . . . . 0.0 110.337 178.982 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.457 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -83.42 -58.42 2.84 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.314 -0.866 . . . . 0.0 109.888 179.431 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -82.31 -47.69 12.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.811 -0.555 . . . . 0.0 111.515 -178.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -53.65 -40.12 65.61 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.164 -0.96 . . . . 0.0 110.284 -179.696 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.469 ' HB3' ' O ' ' A' ' 12' ' ' ARG . 9.1 t90 -75.26 -48.51 22.95 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.313 -0.867 . . . . 0.0 109.561 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -57.18 -49.74 75.03 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.597 -0.69 . . . . 0.0 110.309 -179.596 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.709 ' CE3' HD12 ' A' ' 22' ' ' LEU . 4.9 m95 -65.53 -35.43 80.82 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.187 -0.946 . . . . 0.0 110.033 179.664 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.607 ' HA ' ' HD2' ' A' ' 24' ' ' PRO . 5.3 t30 -71.66 -36.49 70.67 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.09 -1.006 . . . . 0.0 110.641 179.546 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.4 p -89.93 -20.65 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.383 -0.823 . . . . 0.0 111.07 -179.732 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.1 m -107.78 -59.21 1.87 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.199 -0.938 . . . . 0.0 110.202 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.709 HD12 ' CE3' ' A' ' 18' ' ' TRP . 3.1 mt -67.61 -31.19 71.06 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.505 -0.747 . . . . 0.0 110.352 179.624 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 53.29 63.11 8.72 Favored Pre-proline 0 N--CA 1.501 2.104 0 O-C-N 121.769 -0.582 . . . . 0.0 111.02 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.607 ' HD2' ' HA ' ' A' ' 19' ' ' ASN . 49.1 Cg_endo -73.52 170.84 19.01 Favored 'Trans proline' 0 C--N 1.315 -1.197 0 O-C-N 123.78 1.41 . . . . 0.0 110.627 179.67 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 57.55 -158.41 0.27 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.746 -0.596 . . . . 0.0 110.835 179.717 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.2 tpt85 . . . . . 0 N--CA 1.494 1.744 0 O-C-N 121.194 -0.941 . . . . 0.0 110.125 -179.924 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.9 mtt85 . . . . . 0 N--CA 1.495 1.798 0 CA-C-O 120.945 0.402 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.8 m -142.67 158.38 43.72 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.487 -0.758 . . . . 0.0 110.503 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -97.36 -35.35 10.73 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.63 -0.669 . . . . 0.0 110.521 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 tp -89.48 15.13 9.8 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.279 -0.888 . . . . 0.0 111.179 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 79.1 t -107.81 -53.66 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.017 -1.052 . . . . 0.0 109.527 179.564 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -69.32 -43.84 72.93 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.648 -0.657 . . . . 0.0 110.078 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.0 m -58.08 -46.84 84.78 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.294 -0.879 . . . . 0.0 109.384 179.057 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -59.67 -44.66 93.51 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.782 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 9' ' ' LEU . 0.3 OUTLIER -67.59 -43.86 79.49 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.738 -0.601 . . . . 0.0 109.975 179.551 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.476 ' CE3' ' HG3' ' A' ' 11' ' ' GLN . 19.1 t90 -61.94 -45.11 95.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.668 -0.645 . . . . 0.0 109.665 179.403 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.476 ' HG3' ' CE3' ' A' ' 10' ' ' TRP . 5.0 mt-30 -58.12 -39.11 77.87 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.486 -0.759 . . . . 0.0 110.244 179.692 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.8 mmt-85 -64.7 -42.96 94.93 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.491 -0.756 . . . . 0.0 110.367 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -44.87 91.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.441 -0.787 . . . . 0.0 109.998 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -74.17 -35.89 64.03 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.225 -0.922 . . . . 0.0 110.223 179.54 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -55.45 -47.78 75.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.39 -0.818 . . . . 0.0 109.781 179.472 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.4 t90 -67.08 -46.07 75.42 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.587 -0.696 . . . . 0.0 109.361 179.043 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -55.14 -52.4 63.42 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.723 -0.61 . . . . 0.0 109.723 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.408 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.3 m95 -66.79 -31.13 71.56 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.484 -0.76 . . . . 0.0 110.065 179.384 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 4.3 t30 -57.98 -46.24 85.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.409 -0.807 . . . . 0.0 110.152 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.432 HG22 ' H ' ' A' ' 20' ' ' VAL . 30.0 m -84.99 -25.89 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.349 -0.845 . . . . 0.0 110.608 179.589 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.408 ' HB ' ' HA ' ' A' ' 18' ' ' TRP . 55.2 m -74.37 -37.64 63.41 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.248 -0.907 . . . . 0.0 110.231 179.713 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.6 mt -84.33 -36.23 22.7 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.501 -0.749 . . . . 0.0 110.373 179.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -141.95 82.25 13.76 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.426 -0.796 . . . . 0.0 110.34 179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.66 152.5 69.86 Favored 'Trans proline' 0 C--N 1.314 -1.26 0 O-C-N 123.543 1.286 . . . . 0.0 110.787 179.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -94.31 -54.33 3.59 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.688 -0.632 . . . . 0.0 110.429 -179.84 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 117.884 -1.055 . . . . 0.0 110.26 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.0 ptp180 . . . . . 0 N--CA 1.497 1.906 0 CA-C-O 121.074 0.464 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.9 -168.07 2.83 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.544 -0.723 . . . . 0.0 110.234 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -111.26 -53.28 2.72 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.303 -0.873 . . . . 0.0 110.582 -179.755 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.1 pp -107.78 0.02 21.96 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.338 -0.851 . . . . 0.0 111.126 -179.977 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.9 t -101.34 -54.13 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.173 -0.954 . . . . 0.0 109.763 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -68.7 -40.94 79.79 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.579 -0.701 . . . . 0.0 110.365 179.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 t -55.39 -48.7 73.93 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.365 -0.834 . . . . 0.0 109.585 179.615 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -60.65 -43.65 97.35 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.606 -0.684 . . . . 0.0 109.488 178.983 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.05 -43.18 88.26 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.561 -0.712 . . . . 0.0 109.822 179.604 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.44 ' CE3' ' HG3' ' A' ' 11' ' ' GLN . 12.3 t90 -65.79 -42.65 90.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.645 -0.659 . . . . 0.0 109.931 179.492 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.44 ' HG3' ' CE3' ' A' ' 10' ' ' TRP . 10.0 mt-30 -54.14 -46.28 72.21 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.385 -0.822 . . . . 0.0 110.352 179.869 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -64.36 -33.49 75.97 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.655 -0.653 . . . . 0.0 110.8 -179.923 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.512 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -66.85 -44.55 80.72 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.31 -0.869 . . . . 0.0 110.402 -179.63 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.512 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 6.3 mt-10 -75.94 -49.97 16.26 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.193 -0.942 . . . . 0.0 110.922 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.1 -39.5 59.87 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.329 -0.857 . . . . 0.0 110.185 179.893 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 9.1 t90 -77.16 -45.29 27.23 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.385 -0.822 . . . . 0.0 109.534 179.035 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -55.65 -53.99 49.71 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.628 -0.67 . . . . 0.0 110.033 -179.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.6 ' HB3' HD12 ' A' ' 22' ' ' LEU . 6.1 m95 -59.97 -33.07 71.45 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.22 -0.925 . . . . 0.0 110.075 179.384 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -38.13 80.57 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.424 -0.798 . . . . 0.0 110.995 179.666 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.9 m -103.93 -25.87 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 O-C-N 121.409 -0.807 . . . . 0.0 111.348 -179.391 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.1 m -82.78 -48.37 10.89 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.094 -1.004 . . . . 0.0 110.757 -179.511 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.6 HD12 ' HB3' ' A' ' 18' ' ' TRP . 49.4 mt -79.71 -75.34 0.26 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.427 -0.796 . . . . 0.0 110.207 179.981 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 ttp180 51.33 74.06 0.86 Allowed Pre-proline 0 N--CA 1.501 2.075 0 O-C-N 121.686 -0.634 . . . . 0.0 110.511 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -79.03 68.43 8.28 Favored 'Trans proline' 0 C--N 1.316 -1.17 0 O-C-N 123.805 1.423 . . . . 0.0 110.67 -179.742 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 51.57 58.81 5.09 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.557 -0.714 . . . . 0.0 110.679 179.919 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.501 -179.843 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 120.981 0.42 . . . . 0.0 110.323 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.424 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 0.1 OUTLIER -148.75 154.26 39.33 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.54 -0.725 . . . . 0.0 110.316 179.934 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.08 -34.8 10.25 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.541 -0.725 . . . . 0.0 110.759 -179.743 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.38 -21.88 35.68 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.262 -0.899 . . . . 0.0 111.128 -179.878 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 75.7 t -70.09 -46.52 72.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.278 -0.889 . . . . 0.0 110.092 179.989 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -61.72 -37.54 84.55 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.461 -0.775 . . . . 0.0 110.203 179.737 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.4 t -62.66 -46.96 85.77 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -0.839 . . . . 0.0 110.059 179.48 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.05 -39.38 83.04 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.444 -0.785 . . . . 0.0 109.806 179.607 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.451 ' HA ' HD22 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -67.33 -44.31 79.41 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.433 -0.792 . . . . 0.0 109.963 179.336 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.502 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 3.5 t-105 -60.81 -37.75 83.05 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.647 -0.658 . . . . 0.0 110.252 179.721 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.1 -49.76 73.2 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.298 -0.877 . . . . 0.0 109.648 179.573 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -35.86 75.99 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.611 -0.681 . . . . 0.0 109.825 179.037 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.462 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -55.53 -50.81 68.99 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.722 0.772 . . . . 0.0 109.803 179.146 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -78.44 -31.74 48.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.859 -0.526 . . . . 0.0 110.168 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.428 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -49.52 -49.17 47.09 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.601 -0.687 . . . . 0.0 109.818 179.413 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.468 ' O ' HG12 ' A' ' 20' ' ' VAL . 6.1 t90 -72.52 -44.58 62.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.624 -0.673 . . . . 0.0 109.297 178.973 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -53.8 -48.9 69.37 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.839 -0.538 . . . . 0.0 110.148 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 5.8 m95 -70.2 -39.45 75.18 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.391 -0.818 . . . . 0.0 109.74 179.391 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 7.7 t-20 -62.45 -55.69 25.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.309 -0.869 . . . . 0.0 110.38 179.595 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.468 HG12 ' O ' ' A' ' 16' ' ' TRP . 8.6 p -66.52 -22.66 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.334 -0.853 . . . . 0.0 111.641 -179.828 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.1 m -90.79 -36.25 14.37 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.002 -1.061 . . . . 0.0 110.921 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.6 mt -88.59 -39.85 13.8 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.333 -0.854 . . . . 0.0 110.594 -179.674 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -152.98 91.49 3.43 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 121.547 -0.721 . . . . 0.0 110.126 -179.766 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -74.51 70.36 4.92 Favored 'Trans proline' 0 C--N 1.315 -1.208 0 O-C-N 123.777 1.409 . . . . 0.0 111.135 -179.595 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -96.88 -42.6 7.86 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.317 -0.864 . . . . 0.0 109.852 179.508 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.174 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 120.913 0.387 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.8 t 55.57 -149.42 0.45 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.671 -0.643 . . . . 0.0 110.627 -179.805 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.93 -53.92 0.16 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.318 -0.864 . . . . 0.0 110.612 -179.807 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.63 4.38 43.27 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.387 -0.821 . . . . 0.0 111.297 -179.775 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 78.8 t -100.28 -56.41 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 121.092 -1.005 . . . . 0.0 109.781 179.773 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.514 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.3 OUTLIER -65.23 -34.85 79.33 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.544 -0.723 . . . . 0.0 110.478 179.727 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.0 m -56.08 -47.66 77.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.459 -0.775 . . . . 0.0 109.41 179.377 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -70.77 -39.39 73.24 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.725 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.514 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 15.1 mt -57.53 -45.95 84.41 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.562 -0.711 . . . . 0.0 109.847 179.582 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.7 t90 -73.9 -48.14 32.98 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.629 -0.669 . . . . 0.0 109.768 179.335 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -56.74 -40.24 75.4 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.408 -0.808 . . . . 0.0 110.385 -179.817 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.63 -38.05 86.25 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.487 -0.758 . . . . 0.0 110.384 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.409 ' CG ' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -65.37 -47.97 74.56 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.357 -0.84 . . . . 0.0 109.213 179.463 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 3.1 mt-10 -69.52 -31.25 69.37 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.535 -0.728 . . . . 0.0 109.848 179.158 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -55.35 -49.53 72.0 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.424 -0.797 . . . . 0.0 108.866 178.601 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.58 ' NE1' HG21 ' A' ' 20' ' ' VAL . 14.3 t90 -70.1 -42.35 72.82 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.576 -0.702 . . . . 0.0 109.236 178.59 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -54.22 -31.8 54.18 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.624 -0.672 . . . . 0.0 110.874 179.728 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.525 ' HB3' HD12 ' A' ' 22' ' ' LEU . 24.1 m95 -102.91 -43.22 5.59 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.363 -0.835 . . . . 0.0 110.972 -179.601 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -57.51 -37.78 73.56 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.247 -0.908 . . . . 0.0 111.098 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.58 HG21 ' NE1' ' A' ' 16' ' ' TRP . 89.8 t -65.88 -32.86 60.04 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.238 -0.914 . . . . 0.0 110.316 179.907 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.9 m -93.68 -22.58 18.66 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.534 -0.729 . . . . 0.0 111.029 -179.81 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.525 HD12 ' HB3' ' A' ' 18' ' ' TRP . 78.2 mt -95.78 -2.56 47.42 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.255 -0.903 . . . . 0.0 111.309 -179.629 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.469 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -51.88 -52.0 65.44 Favored Pre-proline 0 N--CA 1.501 2.102 0 O-C-N 121.362 -0.836 . . . . 0.0 111.302 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 47.0 Cg_endo -74.49 82.02 1.96 Allowed 'Trans proline' 0 N--CA 1.486 1.032 0 O-C-N 123.555 1.292 . . . . 0.0 110.51 179.924 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -147.11 75.52 1.38 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.343 -0.848 . . . . 0.0 110.124 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.503 2.215 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 19.7 ttp180 . . . . . 0 N--CA 1.495 1.798 0 CA-C-O 121.246 0.546 . . . . 0.0 110.104 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m -145.34 158.97 43.72 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.351 -0.843 . . . . 0.0 110.492 -179.805 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.43 -34.21 10.37 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.5 -0.75 . . . . 0.0 110.328 179.554 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 tp -88.62 8.76 26.84 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.399 -0.813 . . . . 0.0 111.231 179.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 63.3 t -98.15 -46.16 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.061 -1.025 . . . . 0.0 110.149 179.739 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -63.44 -41.27 98.67 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.417 -0.802 . . . . 0.0 110.633 179.842 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.6 t -57.98 -42.96 86.19 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.357 -0.839 . . . . 0.0 109.602 179.524 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.421 ' CD2' HD22 ' A' ' 9' ' ' LEU . 35.8 t80 -71.92 -39.52 69.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.372 -0.83 . . . . 0.0 109.495 178.995 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.445 HD13 ' HA ' ' A' ' 9' ' ' LEU . 1.1 mm? -70.77 -23.01 62.33 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.406 -0.809 . . . . 0.0 110.99 179.835 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.454 ' HA ' ' HD1' ' A' ' 13' ' ' TRP . 26.8 t90 -103.88 -53.69 2.71 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.357 -0.839 . . . . 0.0 110.863 -179.405 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -62.44 -49.24 76.23 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.098 -1.001 . . . . 0.0 110.889 -179.508 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -38.53 87.16 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.285 -0.884 . . . . 0.0 110.215 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.497 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -63.45 -43.93 95.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.451 -0.781 . . . . 0.0 109.504 179.48 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.494 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 48.7 mt-10 -69.29 -45.06 70.54 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.354 -0.841 . . . . 0.0 109.968 179.535 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.85 -42.56 65.32 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.384 -0.823 . . . . 0.0 109.586 179.163 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -72.66 -43.86 62.6 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.433 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.497 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 81.8 t80 -56.04 -53.81 52.49 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.72 -0.612 . . . . 0.0 109.62 179.473 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -59.28 -32.56 70.14 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.576 -0.703 . . . . 0.0 109.831 179.189 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -61.31 -35.38 77.19 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.59 -0.693 . . . . 0.0 110.769 179.435 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.7 m -111.03 7.9 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.255 -0.903 . . . . 0.0 111.519 -179.991 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.443 HG21 ' CZ ' ' A' ' 17' ' ' PHE . 97.7 m -119.04 -31.6 4.69 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.977 -1.077 . . . . 0.0 111.087 -179.857 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 22' ' ' LEU . 18.4 mt -61.17 -38.29 85.94 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.315 -0.866 . . . . 0.0 110.988 -179.806 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.434 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -70.71 -58.61 4.32 Favored Pre-proline 0 N--CA 1.499 1.975 0 O-C-N 121.488 -0.757 . . . . 0.0 111.043 -179.581 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.434 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 48.4 Cg_endo -74.18 100.91 1.35 Allowed 'Trans proline' 0 N--CA 1.487 1.133 0 O-C-N 123.48 1.253 . . . . 0.0 110.738 -179.807 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -133.98 112.06 10.92 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.447 -0.783 . . . . 0.0 109.893 179.764 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.872 0 CA-C-O 117.823 -1.084 . . . . 0.0 110.824 -179.743 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 . . . . . 0 N--CA 1.495 1.785 0 CA-C-O 121.003 0.43 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.3 m -121.77 164.49 17.34 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.586 -0.696 . . . . 0.0 110.422 179.876 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.49 -40.87 9.25 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.53 -0.731 . . . . 0.0 110.413 179.784 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.93 14.57 7.09 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.407 -0.808 . . . . 0.0 111.147 179.928 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.2 t -104.46 -54.03 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.011 -1.056 . . . . 0.0 109.793 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -72.92 -37.91 67.02 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.5 -0.75 . . . . 0.0 110.665 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.8 t -52.69 -43.59 65.69 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.142 -0.974 . . . . 0.0 110.168 -179.974 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.492 ' CZ ' ' HG3' ' A' ' 12' ' ' ARG . 33.9 t80 -79.86 -39.07 31.38 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.457 -0.777 . . . . 0.0 110.075 179.423 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.53 -35.87 78.05 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.583 -0.698 . . . . 0.0 111.186 -179.525 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -58.76 -54.56 45.68 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.267 -0.896 . . . . 0.0 110.44 -179.665 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.69 -38.39 86.69 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.39 -0.819 . . . . 0.0 110.322 179.728 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.492 ' HG3' ' CZ ' ' A' ' 8' ' ' TYR . 13.4 mmm180 -65.54 -8.73 21.24 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.198 -0.939 . . . . 0.0 111.198 179.692 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -101.81 -47.36 4.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.223 -0.923 . . . . 0.0 109.981 179.637 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -88.37 -45.86 9.65 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.919 -0.488 . . . . 0.0 110.864 -178.774 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -39.66 95.3 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.264 -0.898 . . . . 0.0 109.972 179.826 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.427 ' O ' HG22 ' A' ' 20' ' ' VAL . 9.8 t90 -72.21 -47.71 48.5 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.427 -0.796 . . . . 0.0 109.668 179.178 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -57.37 -51.71 68.29 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.68 -0.638 . . . . 0.0 110.166 -179.815 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 8.6 m95 -65.8 -33.46 75.9 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.312 -0.867 . . . . 0.0 110.465 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -60.49 -57.05 14.37 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.172 -0.955 . . . . 0.0 110.611 179.966 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.429 ' HA ' ' HG3' ' A' ' 24' ' ' PRO . 27.3 m -67.54 -22.79 29.0 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.287 -0.883 . . . . 0.0 111.252 -179.57 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 86.7 m -87.89 -31.06 19.67 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.086 -1.009 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.1 mt -81.64 -69.19 0.63 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.275 -0.891 . . . . 0.0 110.214 -179.93 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.33 83.54 0.74 Allowed Pre-proline 0 N--CA 1.498 1.928 0 O-C-N 121.599 -0.688 . . . . 0.0 110.15 -179.759 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.429 ' HG3' ' HA ' ' A' ' 20' ' ' VAL . 49.3 Cg_endo -74.94 179.38 6.12 Favored 'Trans proline' 0 C--N 1.314 -1.258 0 O-C-N 123.872 1.459 . . . . 0.0 110.822 -179.985 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.497 ' O ' ' HB2' ' A' ' 26' ' ' ARG . 1.3 mt-10 -66.32 -37.98 86.62 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.469 -0.769 . . . . 0.0 110.162 179.627 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.497 ' HB2' ' O ' ' A' ' 25' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.504 2.227 0 CA-C-O 117.587 -1.197 . . . . 0.0 110.679 179.972 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 . . . . . 0 N--CA 1.497 1.922 0 CA-C-O 121.073 0.463 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.0 t -129.25 165.39 21.48 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.07 -1.019 . . . . 0.0 110.458 179.844 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -97.69 -45.29 6.42 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.505 -0.747 . . . . 0.0 110.41 -179.951 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 pp -57.36 -25.26 59.17 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.549 -0.72 . . . . 0.0 111.258 -179.924 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.4 t -65.93 -50.15 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.291 -0.881 . . . . 0.0 109.551 179.396 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -66.02 -36.64 83.81 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.515 -0.741 . . . . 0.0 110.021 179.46 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 71.7 m -54.38 -54.91 34.24 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.442 -0.786 . . . . 0.0 109.67 179.546 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -61.61 -44.25 97.34 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.655 -0.653 . . . . 0.0 109.437 178.915 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 9' ' ' LEU . 9.6 mt -57.05 -41.12 78.12 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.628 -0.67 . . . . 0.0 110.308 179.69 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.472 ' HA ' ' HD1' ' A' ' 13' ' ' TRP . 28.5 t90 -68.47 -39.33 81.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.472 -0.768 . . . . 0.0 109.988 179.395 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -64.33 -36.63 84.76 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.383 -0.823 . . . . 0.0 110.824 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -39.8 61.06 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.297 -0.877 . . . . 0.0 110.658 -179.807 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.472 ' HD1' ' HA ' ' A' ' 10' ' ' TRP . 0.0 OUTLIER -60.05 -45.5 92.65 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.32 -0.862 . . . . 0.0 110.02 179.952 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.431 ' N ' ' CG ' ' A' ' 13' ' ' TRP . 3.0 mt-10 -65.16 -42.94 93.27 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.308 -0.87 . . . . 0.0 110.264 179.836 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.06 -36.19 70.24 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.513 -0.742 . . . . 0.0 110.174 179.483 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -71.33 -47.07 58.83 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.448 -0.782 . . . . 0.0 109.298 179.272 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -55.89 -53.12 60.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.629 -0.669 . . . . 0.0 110.051 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 6.1 m95 -59.86 -31.08 69.43 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.352 -0.843 . . . . 0.0 110.697 179.604 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -31.69 72.33 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.352 -0.843 . . . . 0.0 111.283 179.945 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.2 m -106.28 -25.28 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.072 -1.017 . . . . 0.0 111.387 -179.665 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.8 m -82.11 -35.61 28.4 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.131 -0.981 . . . . 0.0 111.29 -179.278 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.68 -17.02 58.1 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.307 -0.871 . . . . 0.0 111.562 -179.533 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.1 ttm-85 57.26 64.53 4.24 Favored Pre-proline 0 N--CA 1.501 2.083 0 O-C-N 121.511 -0.743 . . . . 0.0 110.606 -179.786 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -74.31 65.13 5.41 Favored 'Trans proline' 0 C--N 1.316 -1.142 0 O-C-N 123.831 1.437 . . . . 0.0 110.542 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -158.76 -60.08 0.07 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.294 -0.879 . . . . 0.0 110.29 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.5 mtm105 . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 118.066 -0.968 . . . . 0.0 110.202 -179.828 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 121.06 0.457 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -142.94 134.37 26.25 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.413 -0.804 . . . . 0.0 110.273 179.95 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.54 8.78 19.37 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.624 -0.672 . . . . 0.0 111.136 179.822 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -121.23 4.63 10.3 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.035 -1.041 . . . . 0.0 111.392 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.5 t -90.33 -54.85 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.117 -0.99 . . . . 0.0 110.154 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -66.1 -38.84 89.24 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.451 -0.781 . . . . 0.0 110.737 -179.915 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.7 t -50.61 -49.76 55.78 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.232 -0.917 . . . . 0.0 110.22 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -71.84 -46.52 57.74 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.475 -0.766 . . . . 0.0 110.024 179.497 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.462 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.1 mm? -57.75 -41.82 82.67 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.458 -0.776 . . . . 0.0 110.202 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.572 ' HA ' ' HE3' ' A' ' 10' ' ' TRP . 1.0 OUTLIER -75.0 -34.76 61.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.529 -0.732 . . . . 0.0 109.72 179.342 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -64.53 -39.36 93.62 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.529 -0.732 . . . . 0.0 110.32 179.544 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.58 -26.57 22.2 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.314 -0.866 . . . . 0.0 110.332 179.278 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.566 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -86.89 -43.59 12.31 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.564 -0.71 . . . . 0.0 110.806 179.923 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -83.62 -38.69 21.25 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.381 -0.824 . . . . 0.0 111.496 -178.507 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -50.04 -43.72 51.12 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.26 -0.9 . . . . 0.0 109.763 179.551 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.542 ' NE1' HG21 ' A' ' 20' ' ' VAL . 18.5 t90 -73.22 -44.05 60.25 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.561 -0.712 . . . . 0.0 109.086 178.622 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -55.43 -44.92 76.72 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.462 -0.774 . . . . 0.0 109.987 179.525 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -71.77 -51.01 24.84 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.42 -0.8 . . . . 0.0 110.553 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.07 -21.61 65.09 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.16 -0.962 . . . . 0.0 111.803 -179.795 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.542 HG21 ' NE1' ' A' ' 16' ' ' TRP . 99.3 t -102.09 -31.64 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 120.961 -1.087 . . . . 0.0 111.288 -179.21 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.6 m -88.59 -34.06 17.45 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.977 -1.077 . . . . 0.0 111.28 -179.446 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.9 mt -71.35 -28.64 64.2 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.175 -0.953 . . . . 0.0 110.841 -179.743 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.466 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 9.3 mtt-85 -56.06 -58.88 13.74 Favored Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 121.481 -0.762 . . . . 0.0 110.913 -179.779 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.466 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 51.3 Cg_endo -76.13 54.58 4.23 Favored 'Trans proline' 0 N--CA 1.489 1.222 0 O-C-N 123.422 1.222 . . . . 0.0 110.408 179.53 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -170.55 -47.89 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.408 -0.807 . . . . 0.0 109.818 -179.969 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 ttm180 . . . . . 0 N--CA 1.494 1.757 0 CA-C-O 117.829 -1.082 . . . . 0.0 110.363 179.904 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.766 0 CA-C-O 121.087 0.47 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.35 -175.25 0.11 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.552 -0.718 . . . . 0.0 110.947 179.99 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.25 -45.33 0.17 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.486 -0.759 . . . . 0.0 110.705 -179.729 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.69 -31.95 41.35 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.376 -0.828 . . . . 0.0 110.716 179.95 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 91.9 t -65.63 -51.57 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.503 -0.748 . . . . 0.0 110.142 -179.993 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.59 -39.44 94.4 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.579 -0.701 . . . . 0.0 110.433 179.861 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.0 t -58.56 -47.71 83.33 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.292 -0.88 . . . . 0.0 109.69 179.363 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -66.79 -41.68 87.22 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.468 -0.77 . . . . 0.0 109.451 179.011 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.9 -40.27 97.04 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.678 -0.639 . . . . 0.0 110.038 179.499 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 28.0 t90 -61.57 -44.63 96.67 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.65 -0.656 . . . . 0.0 110.264 179.695 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -34.66 78.73 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.406 -0.809 . . . . 0.0 110.501 179.863 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -37.96 77.93 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.364 -0.835 . . . . 0.0 110.4 179.707 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.468 ' CZ3' ' HB2' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -60.03 -47.22 86.77 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.448 -0.783 . . . . 0.0 109.675 179.985 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.462 ' HG3' ' CD1' ' A' ' 13' ' ' TRP . 28.4 mt-10 -69.01 -38.54 79.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.264 -0.897 . . . . 0.0 109.872 179.314 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.48 -49.26 78.47 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.574 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -67.11 -42.04 85.22 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.821 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.468 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 69.3 t80 -55.07 -58.06 9.2 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.599 -0.688 . . . . 0.0 109.684 179.687 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -62.93 -34.71 78.03 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.439 -0.788 . . . . 0.0 110.177 179.484 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -53.92 -36.72 63.07 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.5 -0.75 . . . . 0.0 110.602 179.396 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.6 m -104.42 -23.74 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 121.282 -0.886 . . . . 0.0 110.975 179.839 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 58.0 m -78.09 -27.92 48.58 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.152 -0.968 . . . . 0.0 111.016 -179.874 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 22' ' ' LEU . 51.8 mt -74.47 -12.45 60.5 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.381 -0.824 . . . . 0.0 111.081 -179.941 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.2 mtt180 57.65 78.8 0.35 Allowed Pre-proline 0 N--CA 1.501 2.103 0 O-C-N 121.674 -0.641 . . . . 0.0 110.734 179.967 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -76.03 63.66 6.86 Favored 'Trans proline' 0 C--N 1.315 -1.214 0 O-C-N 123.828 1.436 . . . . 0.0 110.395 179.654 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -140.09 141.95 36.13 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.451 -0.781 . . . . 0.0 110.273 -179.899 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.868 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.463 -179.835 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 . . . . . 0 N--CA 1.495 1.778 0 CA-C-O 121.173 0.511 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.488 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 59.3 m -91.93 132.74 36.27 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.383 -0.823 . . . . 0.0 110.114 179.92 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.46 -42.52 3.65 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.516 -0.74 . . . . 0.0 110.645 -179.874 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 mp -105.93 -22.42 12.91 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.445 -0.784 . . . . 0.0 111.065 -179.704 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.488 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 94.7 t -60.75 -52.98 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.403 -0.811 . . . . 0.0 110.313 -179.542 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.421 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 0.7 OUTLIER -67.34 -32.85 74.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.497 -0.752 . . . . 0.0 110.378 179.741 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.6 m -57.69 -44.96 86.22 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.345 -0.847 . . . . 0.0 109.647 179.425 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -70.01 -39.88 75.56 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.513 -0.742 . . . . 0.0 109.216 178.648 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' A' ' 9' ' ' LEU . 12.3 mt -61.68 -49.83 74.93 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.745 -0.597 . . . . 0.0 109.948 179.458 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -64.49 -36.74 85.17 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.569 -0.707 . . . . 0.0 109.645 179.221 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -60.08 -44.0 95.08 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.446 -0.784 . . . . 0.0 110.19 179.441 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 ttp85 -53.57 -36.26 61.71 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.615 -0.678 . . . . 0.0 110.689 179.688 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.461 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -61.44 -59.45 5.24 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.564 -0.71 . . . . 0.0 110.227 179.97 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.569 ' HA ' ' HB3' ' A' ' 17' ' ' PHE . 8.9 mt-10 -72.87 -30.97 64.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.681 -0.637 . . . . 0.0 110.942 -179.545 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -50.57 -48.66 57.46 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.378 -0.826 . . . . 0.0 109.864 179.676 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.57 ' NE1' HG21 ' A' ' 20' ' ' VAL . 6.2 t90 -72.5 -42.12 65.2 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.528 -0.732 . . . . 0.0 109.302 178.903 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.569 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 15.9 t80 -57.72 -45.27 86.01 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.593 -0.692 . . . . 0.0 110.459 179.962 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -63.44 -57.62 9.69 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.276 -0.89 . . . . 0.0 110.895 -179.534 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.04 -27.13 68.11 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.043 -1.036 . . . . 0.0 111.716 -179.544 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.57 HG21 ' NE1' ' A' ' 16' ' ' TRP . 71.3 t -91.27 -24.88 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.062 -1.024 . . . . 0.0 111.324 -179.392 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.6 m -101.12 -38.02 8.32 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.085 -1.009 . . . . 0.0 111.338 -179.395 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 77.3 mt -63.44 -33.79 76.33 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.251 -0.906 . . . . 0.0 110.96 -179.571 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.514 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 3.7 mmm180 -60.76 -60.47 10.54 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 121.424 -0.798 . . . . 0.0 110.331 179.99 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.514 ' HD3' ' CB ' ' A' ' 23' ' ' ARG . 51.7 Cg_endo -77.35 72.36 5.99 Favored 'Trans proline' 0 N--CA 1.487 1.089 0 O-C-N 123.565 1.297 . . . . 0.0 110.223 179.169 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.39 100.43 12.2 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.325 -0.86 . . . . 0.0 110.126 -179.887 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.073 0 CA-C-O 117.886 -1.054 . . . . 0.0 110.668 -179.843 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.451 ' HG2' ' HB2' ' A' ' 6' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.864 0 CA-C-O 120.898 0.38 . . . . 0.0 110.182 . . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.659 ' O ' ' HB3' ' A' ' 3' ' ' ALA . 7.5 t -86.39 9.26 18.59 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.213 -0.929 . . . . 0.0 111.534 -179.659 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 2' ' ' SER . . . 75.46 -39.21 0.39 Allowed 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.526 -0.734 . . . . 0.0 111.736 179.912 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' A' ' 4' ' ' LEU . 1.4 mm? -108.29 14.98 24.46 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.017 -1.052 . . . . 0.0 111.402 -179.754 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.445 HG23 ' HB3' ' A' ' 2' ' ' SER . 98.3 t -112.59 -42.77 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.122 -0.986 . . . . 0.0 110.528 179.75 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.567 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 59.9 t30 -83.57 -20.99 32.79 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.207 -0.933 . . . . 0.0 111.355 -179.862 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.4 t -52.19 -52.45 52.04 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.102 -0.999 . . . . 0.0 109.929 179.96 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -70.61 -40.88 72.93 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.465 -0.772 . . . . 0.0 109.748 179.121 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 29.7 mt -60.03 -36.52 77.45 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.63 -0.669 . . . . 0.0 110.403 179.691 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -72.4 -40.1 67.46 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.418 -0.801 . . . . 0.0 110.024 179.485 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 5.8 mm-40 -61.44 -40.23 93.7 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.464 -0.773 . . . . 0.0 110.471 179.916 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.96 -38.81 65.36 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.568 -0.708 . . . . 0.0 110.321 179.54 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.493 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -58.92 -61.92 2.27 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.697 -0.627 . . . . 0.0 110.303 179.704 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -66.02 -33.84 76.72 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.546 -0.721 . . . . 0.0 110.661 -179.707 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -51.95 -46.05 64.61 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.471 -0.768 . . . . 0.0 109.193 178.903 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.623 ' O ' HG22 ' A' ' 20' ' ' VAL . 18.1 t90 -70.99 -43.22 68.47 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.518 -0.739 . . . . 0.0 109.407 178.817 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -58.02 -52.02 67.27 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.635 -0.666 . . . . 0.0 109.916 179.818 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.495 ' HB3' HD12 ' A' ' 22' ' ' LEU . 7.8 m95 -64.21 -33.98 77.05 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.425 -0.797 . . . . 0.0 110.202 179.426 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -68.2 -41.95 80.62 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.363 -0.836 . . . . 0.0 111.063 179.837 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 16' ' ' TRP . 26.4 m -89.4 -25.02 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.187 -0.945 . . . . 0.0 111.438 -179.527 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.6 m -84.72 -51.74 6.58 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.106 -0.996 . . . . 0.0 110.653 -179.718 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.495 HD12 ' HB3' ' A' ' 18' ' ' TRP . 59.0 mt -70.62 -63.4 1.1 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.415 -0.803 . . . . 0.0 109.749 179.904 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.529 ' HD2' ' HG3' ' A' ' 26' ' ' ARG . 1.9 mtm-85 49.1 75.37 0.67 Allowed Pre-proline 0 N--CA 1.5 2.072 0 O-C-N 121.816 -0.552 . . . . 0.0 111.251 179.362 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -77.86 53.21 4.31 Favored 'Trans proline' 0 C--N 1.313 -1.319 0 O-C-N 123.672 1.354 . . . . 0.0 110.483 179.535 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -169.76 -52.33 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.404 -0.81 . . . . 0.0 110.217 -179.75 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.529 ' HG3' ' HD2' ' A' ' 23' ' ' ARG . 1.5 ptt-85 . . . . . 0 N--CA 1.498 1.929 0 CA-C-O 118.374 -0.822 . . . . 0.0 110.524 179.999 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.9 ttt-85 . . . . . 0 N--CA 1.495 1.802 0 CA-C-O 121.117 0.484 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.421 ' O ' ' HB3' ' A' ' 3' ' ' ALA . 1.9 t -99.18 -1.35 39.53 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.427 -0.796 . . . . 0.0 111.188 179.992 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 2' ' ' SER . . . 58.64 10.03 1.3 Allowed 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.466 -0.771 . . . . 0.0 111.59 -179.469 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.6 mt -132.52 3.79 3.91 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.976 -1.077 . . . . 0.0 111.079 179.893 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 37.4 t -98.17 -53.09 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.187 -0.945 . . . . 0.0 109.569 179.74 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -62.16 -41.53 98.39 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.744 -0.597 . . . . 0.0 110.451 179.695 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.7 p -57.43 -50.74 72.03 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.39 -0.819 . . . . 0.0 109.672 179.601 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -62.73 -44.86 95.12 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.651 -0.656 . . . . 0.0 109.437 179.0 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.39 -45.57 92.54 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.816 -0.553 . . . . 0.0 110.334 179.732 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 12.0 t90 -61.94 -49.36 76.44 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.522 -0.736 . . . . 0.0 109.916 179.589 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.407 ' O ' ' HB2' ' A' ' 15' ' ' ASN . 50.0 tp60 -55.09 -35.98 65.17 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.447 -0.783 . . . . 0.0 110.297 179.918 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.38 -36.82 77.18 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.423 -0.798 . . . . 0.0 110.457 179.729 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.448 ' NE1' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -60.45 -45.91 91.96 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.476 -0.765 . . . . 0.0 109.333 179.564 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.448 ' HG3' ' NE1' ' A' ' 13' ' ' TRP . 5.2 mt-10 -73.32 -35.42 66.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.339 -0.851 . . . . 0.0 109.675 178.959 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -51.98 -46.58 64.89 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.393 -0.817 . . . . 0.0 109.921 179.365 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -68.47 -47.29 67.5 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.506 -0.747 . . . . 0.0 109.27 179.244 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -55.09 -42.35 72.74 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.692 -0.63 . . . . 0.0 109.815 179.596 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.569 ' HB3' HD12 ' A' ' 22' ' ' LEU . 5.5 m95 -77.65 -27.81 51.06 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.674 -0.641 . . . . 0.0 110.315 179.612 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 14.4 t-20 -65.0 -43.7 91.66 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.408 -0.807 . . . . 0.0 110.947 -179.806 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 m -80.09 -17.32 12.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.268 -0.895 . . . . 0.0 111.705 -179.461 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.5 p -95.93 -55.79 2.87 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.971 -1.081 . . . . 0.0 110.524 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.569 HD12 ' HB3' ' A' ' 18' ' ' TRP . 6.8 mt -76.92 -28.73 55.39 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.59 -0.694 . . . . 0.0 110.805 -179.902 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 59.72 87.77 0.13 Allowed Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.679 -0.638 . . . . 0.0 110.508 -179.979 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 19' ' ' ASN . 43.6 Cg_endo -70.33 169.48 19.54 Favored 'Trans proline' 0 C--N 1.314 -1.266 0 O-C-N 123.705 1.371 . . . . 0.0 111.158 -179.822 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -102.07 -52.07 3.24 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.638 -0.664 . . . . 0.0 110.497 -179.614 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.92 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.449 -179.951 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 121.311 0.577 . . . . 0.0 110.066 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.577 ' HB3' ' HB ' ' A' ' 5' ' ' VAL . 1.1 m -80.19 141.34 35.75 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.342 -0.849 . . . . 0.0 110.434 -179.864 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.86 -37.53 5.38 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.544 -0.723 . . . . 0.0 110.886 -179.874 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 mp -111.06 15.72 21.51 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.269 -0.894 . . . . 0.0 111.15 -179.693 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.577 ' HB ' ' HB3' ' A' ' 2' ' ' SER . 75.0 t -107.95 -54.18 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.14 -0.975 . . . . 0.0 109.526 179.434 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.79 -41.85 64.55 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.578 -0.701 . . . . 0.0 109.872 179.33 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.4 m -57.98 -43.72 86.68 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.318 -0.864 . . . . 0.0 109.312 179.061 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -67.2 -38.48 85.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.789 -0.569 . . . . 0.0 109.614 178.936 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' A' ' 9' ' ' LEU . 0.5 OUTLIER -69.01 -41.25 78.01 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.579 -0.701 . . . . 0.0 110.333 179.715 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -75.67 -43.32 48.08 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.504 -0.748 . . . . 0.0 110.317 179.928 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.03 -57.0 13.96 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.306 -0.871 . . . . 0.0 110.614 -179.564 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.7 -37.89 43.89 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.557 -0.715 . . . . 0.0 110.991 -179.783 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.546 ' CE3' ' HA ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -57.12 -60.0 4.25 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.658 -0.651 . . . . 0.0 110.482 179.85 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -76.01 -35.97 59.33 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.636 -0.665 . . . . 0.0 110.887 -179.476 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 3.2 t-20 -51.91 -49.21 63.51 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.506 -0.746 . . . . 0.0 109.552 179.565 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -67.2 -45.92 75.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.56 -0.712 . . . . 0.0 109.341 178.944 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -54.94 -52.5 62.82 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.672 -0.642 . . . . 0.0 109.892 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -65.14 -39.75 93.44 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.304 -0.872 . . . . 0.0 110.008 179.566 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 15' ' ' ASN . 26.8 t30 -66.48 -29.24 69.31 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.459 -0.776 . . . . 0.0 111.336 179.791 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.2 p -101.61 -7.83 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.99 0 O-C-N 121.123 -0.985 . . . . 0.0 111.532 -179.407 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.7 m -109.0 -30.48 8.06 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.958 -1.089 . . . . 0.0 111.174 -179.718 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.0 mt -75.14 -35.79 61.63 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.298 -0.876 . . . . 0.0 110.774 -179.995 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.464 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -58.57 -55.17 48.69 Favored Pre-proline 0 N--CA 1.499 1.988 0 O-C-N 121.509 -0.744 . . . . 0.0 110.692 179.962 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.464 ' HD3' ' HB3' ' A' ' 23' ' ' ARG . 50.5 Cg_endo -74.24 -170.05 0.67 Allowed 'Trans proline' 0 N--CA 1.487 1.143 0 O-C-N 123.527 1.278 . . . . 0.0 110.598 179.591 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.59 -157.14 0.34 Allowed 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.624 -0.673 . . . . 0.0 110.59 179.983 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.935 0 CA-C-O 118.173 -0.918 . . . . 0.0 110.689 -179.947 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 121.135 0.493 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.409 ' N ' ' HB ' ' A' ' 5' ' ' VAL . 0.3 OUTLIER -166.48 -175.81 3.35 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.526 -0.734 . . . . 0.0 110.118 179.985 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.52 -45.6 93.23 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.536 -0.728 . . . . 0.0 110.834 179.928 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.53 9.86 31.41 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.434 -0.791 . . . . 0.0 111.064 179.897 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.409 ' HB ' ' N ' ' A' ' 2' ' ' SER . 69.4 t -102.76 -40.96 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.119 -0.988 . . . . 0.0 110.361 179.931 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -84.45 -35.01 23.33 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.257 -0.902 . . . . 0.0 110.315 179.814 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -51.11 70.88 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.451 -0.781 . . . . 0.0 109.656 179.524 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -63.68 -40.26 96.36 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.638 -0.664 . . . . 0.0 109.364 178.824 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.422 ' HA ' HD23 ' A' ' 9' ' ' LEU . 6.9 mt -58.1 -41.81 84.33 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.59 -0.694 . . . . 0.0 110.205 179.561 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 33.3 t90 -65.6 -45.88 81.5 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.471 -0.768 . . . . 0.0 109.819 179.231 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -60.42 -35.53 76.02 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.353 -0.842 . . . . 0.0 110.218 179.9 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -40.13 88.14 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.544 -0.722 . . . . 0.0 110.1 179.305 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -46.35 88.16 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.546 -0.721 . . . . 0.0 109.438 179.501 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -74.18 -41.05 62.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.28 -0.887 . . . . 0.0 109.528 179.024 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -54.06 -47.74 71.33 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.634 -0.666 . . . . 0.0 109.38 179.06 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.537 ' O ' HG22 ' A' ' 20' ' ' VAL . 12.3 t90 -62.39 -47.76 82.7 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.531 -0.731 . . . . 0.0 109.282 179.004 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -58.1 -51.37 69.99 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.657 -0.652 . . . . 0.0 110.149 179.704 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.967 ' HE3' HD11 ' A' ' 22' ' ' LEU . 35.6 m95 -64.83 -16.31 62.95 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.463 -0.773 . . . . 0.0 110.73 179.472 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -92.91 -28.38 16.51 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.967 -1.083 . . . . 0.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.537 HG22 ' O ' ' A' ' 16' ' ' TRP . 19.8 m -106.2 0.21 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.112 0 O-C-N 121.097 -1.002 . . . . 0.0 111.737 -179.731 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 86.6 m -110.29 -16.72 13.67 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.917 -1.114 . . . . 0.0 111.179 -179.804 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.967 HD11 ' HE3' ' A' ' 18' ' ' TRP . 6.8 mp -95.38 -35.79 11.61 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.199 -0.938 . . . . 0.0 110.143 -179.889 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 mmt85 -130.26 65.9 76.79 Favored Pre-proline 0 N--CA 1.496 1.835 0 O-C-N 121.495 -0.753 . . . . 0.0 110.148 179.502 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -79.17 67.56 8.55 Favored 'Trans proline' 0 C--N 1.316 -1.158 0 O-C-N 123.674 1.355 . . . . 0.0 110.584 -179.933 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 50.33 59.51 4.51 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.519 -0.738 . . . . 0.0 110.663 -179.897 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 118.336 -0.84 . . . . 0.0 110.35 -179.99 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