data_2l5g_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 2l5g _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.3 tt . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 121.155 0.502 . . . . 0.0 109.882 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -67.47 -29.93 69.5 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.544 -0.722 . . . . 0.0 109.955 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -74.94 -35.59 62.15 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.651 -0.656 . . . . 0.0 109.943 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 88.3 m -71.29 -30.81 66.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.763 -0.586 . . . . 0.0 109.682 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -68.74 -28.71 67.06 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.618 -0.676 . . . . 0.0 109.899 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -66.86 -32.36 73.58 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.585 -0.697 . . . . 0.0 110.022 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -78.18 -31.34 49.53 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.644 -0.66 . . . . 0.0 109.695 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.4 mt -77.28 -29.67 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.663 -0.648 . . . . 0.0 109.539 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.97 -33.35 63.82 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.639 -0.663 . . . . 0.0 109.651 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.9 tptt -66.31 -30.7 71.16 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.655 -0.653 . . . . 0.0 109.563 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 10.4 mt -62.38 -31.24 71.87 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.669 -0.644 . . . . 0.0 109.856 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -63.01 -36.59 84.06 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.57 -0.707 . . . . 0.0 109.787 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -76.36 -31.52 58.11 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.694 -0.629 . . . . 0.0 109.576 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -77.07 -30.49 55.52 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.702 -0.624 . . . . 0.0 109.671 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 41.5 tp -77.91 -32.8 51.94 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.614 -0.679 . . . . 0.0 109.633 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.3 mt -75.18 -31.63 61.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.706 -0.621 . . . . 0.0 109.565 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.66 -30.41 67.01 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.645 -0.66 . . . . 0.0 109.731 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.16 -41.81 80.98 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.72 -0.613 . . . . 0.0 109.641 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -68.15 -31.14 70.49 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.609 -0.682 . . . . 0.0 109.674 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.91 -30.53 69.88 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.657 -0.652 . . . . 0.0 109.62 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.07 -45.84 83.62 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.672 -0.642 . . . . 0.0 109.749 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.3 tttm -64.34 -32.2 73.71 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.568 -0.707 . . . . 0.0 109.45 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.78 -30.13 71.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.722 -0.611 . . . . 0.0 109.844 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.7 tm0? -65.99 -33.58 76.13 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.601 -0.687 . . . . 0.0 109.736 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.8 mt -65.76 -32.32 73.79 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.631 -0.668 . . . . 0.0 109.661 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.404 ' CD1' ' HE3' ' B' ' 176' ' ' MET . 1.9 m-85 -61.28 -35.83 78.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.654 -0.654 . . . . 0.0 109.83 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -61.73 -29.94 70.45 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.74 -0.6 . . . . 0.0 109.832 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -101.71 -19.6 15.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.676 -0.64 . . . . 0.0 110.553 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.401 ' CD1' ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.047 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.552 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -144.88 -67.47 0.32 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.61 -0.935 . . . . 0.0 110.751 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 11.0 t -145.39 16.68 1.5 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.145 -0.972 . . . . 0.0 110.919 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.3 tptt 50.68 25.76 2.21 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.171 -0.955 . . . . 0.0 110.684 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -148.93 -46.77 0.14 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.655 -0.653 . . . . 0.0 109.472 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.9 -33.17 73.32 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 119.95 -0.7 . . . . 0.0 109.262 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.5 tt -77.87 -27.75 49.81 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . 0.43 HD13 HG23 ' B' ' 173' ' ' ILE . 49.1 mm -71.14 -31.08 43.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.632 -0.667 . . . . 0.0 109.399 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -70.35 -29.49 66.18 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.689 -0.632 . . . . 0.0 109.984 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -69.29 -29.08 66.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.605 -0.684 . . . . 0.0 110.081 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.404 ' HE3' ' CD1' ' A' ' 87' ' ' PHE . 0.4 OUTLIER -71.46 -29.34 64.73 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.527 -0.733 . . . . 0.0 110.045 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -75.6 -29.96 59.44 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.603 -0.686 . . . . 0.0 110.168 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.4 ttp180 -76.11 -32.21 59.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.619 -0.675 . . . . 0.0 109.95 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 72.1 t -74.08 -29.86 26.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.684 -0.635 . . . . 0.0 109.652 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -71.76 -28.59 63.75 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.667 -0.645 . . . . 0.0 110.022 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 19.4 mtp180 -74.15 -28.39 61.29 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.568 -0.708 . . . . 0.0 110.077 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -73.82 -29.12 61.97 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.588 -0.695 . . . . 0.0 110.128 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . 0.451 HG23 HD12 ' B' ' 183' ' ' ILE . 85.0 mt -72.53 -27.81 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.587 -0.696 . . . . 0.0 109.894 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.2 m -71.2 -31.01 67.09 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.56 -0.712 . . . . 0.0 109.937 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.3 ttp -71.7 -44.08 64.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.637 -0.664 . . . . 0.0 109.934 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.0 t -71.28 -31.24 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.615 -0.678 . . . . 0.0 109.554 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -75.21 -29.11 60.21 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.717 -0.614 . . . . 0.0 109.779 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . 0.4 ' O ' ' OG ' ' B' ' 191' ' ' SER . 11.5 tp-100 -73.27 -28.5 62.16 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.654 -0.654 . . . . 0.0 110.068 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -32.49 64.13 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.572 -0.705 . . . . 0.0 109.962 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.403 HG21 HD12 ' B' ' 190' ' ' ILE . 77.0 mt -73.41 -31.67 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.677 -0.64 . . . . 0.0 109.776 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 191' ' ' SER . . . . . 0.4 ' OG ' ' O ' ' B' ' 188' ' ' GLN . 19.0 p -69.9 -35.61 74.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.649 -0.657 . . . . 0.0 109.636 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -76.91 -32.28 57.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.659 -0.651 . . . . 0.0 109.431 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.89 -30.8 62.81 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.685 -0.634 . . . . 0.0 109.374 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -67.76 -40.32 84.09 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.647 -0.658 . . . . 0.0 109.514 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -68.48 -33.11 73.58 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.634 -0.666 . . . . 0.0 109.344 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 1.5 ttpp -63.91 -34.54 78.2 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -29.87 71.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.753 -0.592 . . . . 0.0 109.469 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -47.65 85.36 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.652 -0.655 . . . . 0.0 109.74 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -62.41 -41.49 98.73 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.198 -0.601 . . . . 0.0 109.925 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.58 -36.31 68.15 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.619 -0.676 . . . . 0.0 109.733 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.642 -0.661 . . . . 0.0 109.826 179.553 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.8 tp . . . . . 0 N--CA 1.497 1.892 0 CA-C-O 121.099 0.476 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -76.64 -32.69 58.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.605 -0.684 . . . . 0.0 110.089 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -76.83 -30.7 56.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.598 -0.689 . . . . 0.0 109.771 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.3 m -74.53 -29.98 61.59 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.727 -0.608 . . . . 0.0 109.704 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -70.41 -27.04 63.98 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.611 -0.681 . . . . 0.0 109.997 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -69.37 -33.22 72.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.581 -0.7 . . . . 0.0 110.189 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -76.11 -36.05 59.05 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.581 -0.699 . . . . 0.0 109.711 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 82.5 mt -71.79 -27.19 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.737 -0.602 . . . . 0.0 109.533 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.4 -37.37 77.46 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.599 -0.688 . . . . 0.0 109.717 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -71.06 -30.38 66.51 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.594 -0.691 . . . . 0.0 109.781 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.32 -27.08 62.2 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.639 -0.663 . . . . 0.0 110.067 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -74.16 -32.82 63.27 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.493 -0.754 . . . . 0.0 109.622 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.91 -31.69 63.22 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.733 -0.604 . . . . 0.0 109.392 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -67.82 -30.8 70.29 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.734 -0.604 . . . . 0.0 109.666 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.1 tp -74.38 -30.02 61.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.633 -0.667 . . . . 0.0 109.851 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.89 -33.41 62.05 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.625 -0.672 . . . . 0.0 109.739 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.4 -29.43 66.06 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.709 -0.619 . . . . 0.0 109.858 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.78 -42.41 67.17 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.715 -0.616 . . . . 0.0 109.761 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -66.88 -30.52 70.71 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.567 -0.708 . . . . 0.0 109.696 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -67.17 -29.42 69.1 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.706 -0.621 . . . . 0.0 109.803 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -47.64 71.05 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.598 -0.688 . . . . 0.0 109.614 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -62.78 -28.92 70.32 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.558 -0.714 . . . . 0.0 109.67 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -65.14 -29.54 70.39 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.654 -0.654 . . . . 0.0 109.996 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -65.36 -41.46 93.8 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.612 -0.68 . . . . 0.0 109.693 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.5 mt -61.77 -29.22 69.99 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.609 -0.682 . . . . 0.0 109.868 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.22 -35.72 79.78 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.594 -0.691 . . . . 0.0 109.636 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.4 mt -77.46 -29.59 52.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.739 -0.601 . . . . 0.0 109.789 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -90.04 -14.52 33.7 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.671 -0.643 . . . . 0.0 110.807 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.0 tp . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.515 -179.876 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.402 ' CD1' ' CB ' ' B' ' 171' ' ' GLU . 0.0 OUTLIER -145.75 -75.52 0.21 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.621 -0.929 . . . . 0.0 110.492 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 3.9 t -138.0 19.51 2.82 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.124 -0.985 . . . . 0.0 110.924 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 18.5 tptm 50.82 25.91 2.36 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.134 -0.979 . . . . 0.0 110.67 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -150.73 -45.84 0.12 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.715 -0.615 . . . . 0.0 109.661 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . 0.402 ' CB ' ' CD1' ' B' ' 167' ' ' LEU . 1.4 mp0 -68.23 -30.26 69.28 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.671 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 2.0 tt -81.51 -30.46 33.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.648 -0.657 . . . . 0.0 109.483 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . 0.438 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.1 mp -74.13 -30.88 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -63.97 -32.73 74.37 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -76.18 -31.3 58.44 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -29.01 67.0 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.664 -0.647 . . . . 0.0 109.83 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -75.04 -29.65 60.84 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.568 -0.708 . . . . 0.0 110.243 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -75.25 -29.73 60.28 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.59 -0.694 . . . . 0.0 110.043 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 60.7 t -76.19 -28.63 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.629 -0.669 . . . . 0.0 109.837 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -75.77 -28.63 58.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.631 -0.668 . . . . 0.0 110.07 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -28.49 59.89 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.588 -0.695 . . . . 0.0 110.117 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.7 -30.66 61.62 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.618 -0.676 . . . . 0.0 110.138 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 75.7 mt -73.42 -30.11 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.633 -0.667 . . . . 0.0 109.749 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.9 -32.45 69.41 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.669 -0.645 . . . . 0.0 109.713 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 5.5 mtp -71.99 -46.09 58.58 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.617 -0.677 . . . . 0.0 109.693 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -66.97 -31.31 52.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 119.989 -0.685 . . . . 0.0 109.286 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -66.24 -33.99 77.0 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.756 -0.59 . . . . 0.0 110.027 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 65.8 mm-40 -66.58 -27.53 67.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.582 -0.699 . . . . 0.0 110.0 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -23.32 57.7 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.586 -0.696 . . . . 0.0 110.408 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 33.8 mm -79.79 -36.8 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.369 -0.832 . . . . 0.0 109.55 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -30.53 63.95 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.735 -0.603 . . . . 0.0 109.736 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -75.33 -38.75 60.05 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.649 -0.657 . . . . 0.0 109.783 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.0 -30.23 65.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.578 -0.701 . . . . 0.0 109.348 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -67.03 -37.69 84.56 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.351 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 24.4 tptt -66.43 -30.96 71.44 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.63 -0.669 . . . . 0.0 109.361 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -62.96 -37.57 87.61 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.702 -0.624 . . . . 0.0 109.464 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -62.49 -30.65 71.42 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.78 -0.575 . . . . 0.0 109.609 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -61.3 -41.31 96.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.705 -0.622 . . . . 0.0 110.016 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -63.28 -39.93 95.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.735 -0.603 . . . . 0.0 109.891 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.3 tp -72.83 -30.76 64.28 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.639 -0.663 . . . . 0.0 109.833 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 . . . . . 0 N--CA 1.493 1.722 0 O-C-N 121.586 -0.696 . . . . 0.0 109.879 179.681 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.1 tp . . . . . 0 N--CA 1.495 1.783 0 CA-C-O 121.157 0.504 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.24 -29.56 64.04 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.602 -0.686 . . . . 0.0 110.049 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -75.4 -33.27 60.96 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.592 -0.693 . . . . 0.0 109.892 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.7 m -71.18 -30.49 66.49 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.649 -0.657 . . . . 0.0 109.713 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -68.2 -29.14 67.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.607 -0.683 . . . . 0.0 109.978 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -66.58 -32.55 73.96 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.541 -0.725 . . . . 0.0 110.05 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -76.7 -32.82 58.12 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.643 -0.66 . . . . 0.0 109.853 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.9 mt -75.66 -28.96 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.719 -0.613 . . . . 0.0 109.597 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.7 tp -74.4 -33.6 63.06 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.662 -0.649 . . . . 0.0 109.845 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.63 -35.76 70.53 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.639 -0.663 . . . . 0.0 109.808 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.403 ' CG ' ' CD1' ' B' ' 190' ' ' ILE . 2.0 tp -68.67 -27.87 66.36 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.608 -0.683 . . . . 0.0 109.849 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -67.4 -35.51 79.45 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.544 -0.722 . . . . 0.0 109.493 179.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.19 -31.44 60.95 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -71.06 -30.79 67.04 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.753 -0.592 . . . . 0.0 109.712 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.1 tp -72.08 -31.31 65.96 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.592 -0.693 . . . . 0.0 109.689 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.09 -32.8 56.9 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.655 -0.653 . . . . 0.0 109.677 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.41 -31.24 63.74 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 120.121 -0.631 . . . . 0.0 109.376 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.3 tp -65.06 -33.85 77.03 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.663 -0.648 . . . . 0.0 109.425 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -31.32 65.66 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.697 -0.627 . . . . 0.0 109.49 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -67.98 -30.09 69.28 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.691 -0.63 . . . . 0.0 109.735 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -66.27 -44.96 82.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.646 -0.659 . . . . 0.0 109.914 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -66.91 -30.15 70.23 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.597 -0.69 . . . . 0.0 109.863 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -70.32 -29.27 65.94 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.713 -0.617 . . . . 0.0 109.894 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -67.4 -32.21 72.95 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.629 -0.67 . . . . 0.0 109.866 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.71 -30.55 69.22 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.593 -0.692 . . . . 0.0 109.969 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.408 ' CG ' ' HE2' ' B' ' 176' ' ' MET . 2.7 m-85 -68.54 -27.89 66.5 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.597 -0.689 . . . . 0.0 110.187 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.5 -28.66 64.07 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.524 -0.735 . . . . 0.0 110.025 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -117.82 25.6 10.26 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.627 -0.67 . . . . 0.0 110.532 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.061 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.405 ' CD1' ' CB ' ' B' ' 171' ' ' GLU . 0.0 OUTLIER -139.78 -82.75 0.26 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.554 -0.968 . . . . 0.0 110.536 -179.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 88.6 p -130.49 20.81 5.17 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.246 -0.909 . . . . 0.0 110.94 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.1 tptt 50.92 25.62 2.29 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.234 -0.916 . . . . 0.0 110.729 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -150.64 -46.09 0.12 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.724 -0.61 . . . . 0.0 109.643 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . 0.405 ' CB ' ' CD1' ' B' ' 167' ' ' LEU . 0.4 OUTLIER -66.38 -29.88 70.14 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.982 -0.687 . . . . 0.0 109.447 179.418 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 14.8 tp -81.49 -33.2 32.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.704 -0.622 . . . . 0.0 109.386 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . 0.434 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.1 mp -74.76 -31.37 26.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -64.06 -32.14 73.59 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -75.38 -32.72 60.89 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.408 ' HE2' ' CG ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -66.45 -33.13 75.02 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.172 -0.611 . . . . 0.0 109.555 179.47 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -76.33 -31.59 58.21 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.639 -0.663 . . . . 0.0 109.751 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -74.31 -29.58 61.68 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.701 -0.624 . . . . 0.0 109.864 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 68.8 t -73.43 -29.57 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.658 -0.651 . . . . 0.0 109.763 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -75.37 -32.83 60.96 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.568 -0.707 . . . . 0.0 110.04 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -73.02 -29.43 63.0 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.71 -0.619 . . . . 0.0 109.864 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -73.42 -39.66 64.86 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.616 -0.677 . . . . 0.0 109.925 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 96.3 mt -66.81 -28.49 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.67 -0.644 . . . . 0.0 109.723 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 79.0 m -67.95 -37.07 81.14 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.609 -0.682 . . . . 0.0 109.672 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 19.9 tpp -70.73 -44.4 66.91 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.64 -0.662 . . . . 0.0 109.485 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 68.3 t -66.85 -35.79 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -63.7 -34.23 77.4 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.726 -0.609 . . . . 0.0 109.815 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.88 -24.88 62.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.681 -0.637 . . . . 0.0 110.033 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -24.83 57.33 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.547 -0.72 . . . . 0.0 110.458 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.403 ' CD1' ' CG ' ' A' ' 72' ' ' LEU . 32.8 mm -79.16 -34.86 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.354 -0.842 . . . . 0.0 109.601 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.1 m -75.55 -30.8 59.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.729 -0.607 . . . . 0.0 109.684 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 39.0 mmtt -74.68 -32.59 62.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.689 -0.632 . . . . 0.0 109.678 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . 0.402 ' CD1' ' CD2' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -71.61 -35.83 70.6 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.566 -0.709 . . . . 0.0 109.424 179.459 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.2 -40.8 94.68 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.64 -0.663 . . . . 0.0 109.407 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -70.83 -32.05 68.96 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.687 -0.633 . . . . 0.0 109.378 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -67.64 -31.88 72.19 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -65.46 -30.67 71.48 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.726 -0.608 . . . . 0.0 109.676 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -62.2 -43.47 98.76 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.713 -0.617 . . . . 0.0 109.829 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -61.54 -40.73 95.74 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.777 -0.577 . . . . 0.0 109.842 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.93 -32.53 63.55 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.533 -0.729 . . . . 0.0 109.558 179.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 . . . . . 0 N--CA 1.492 1.671 0 O-C-N 121.791 -0.568 . . . . 0.0 109.747 179.471 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 121.085 0.469 . . . . 0.0 110.021 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -75.22 -37.46 61.09 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.61 -0.681 . . . . 0.0 109.91 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -74.01 -30.55 62.51 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.733 -0.604 . . . . 0.0 109.672 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 79.0 m -72.71 -29.94 63.79 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.677 -0.639 . . . . 0.0 109.71 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -68.94 -27.74 66.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.647 -0.658 . . . . 0.0 110.051 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -68.24 -33.21 73.96 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.45 -0.781 . . . . 0.0 110.14 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -75.65 -33.86 60.47 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.678 -0.639 . . . . 0.0 109.722 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.7 mt -71.82 -28.25 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.768 -0.583 . . . . 0.0 109.617 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.23 -38.27 78.43 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.558 -0.714 . . . . 0.0 109.796 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.3 tptp -68.74 -29.89 68.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.584 -0.697 . . . . 0.0 109.766 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.4 mt -68.58 -32.17 71.88 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.69 -0.631 . . . . 0.0 110.023 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -68.29 -33.46 74.39 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.64 -0.663 . . . . 0.0 109.829 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -75.34 -30.07 60.14 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.655 -0.653 . . . . 0.0 109.814 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -74.61 -30.12 61.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.698 -0.626 . . . . 0.0 109.905 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 28.8 tp -74.94 -34.01 62.04 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.661 -0.649 . . . . 0.0 109.901 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 22.0 mt -74.97 -32.31 61.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.674 -0.641 . . . . 0.0 109.743 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.68 -29.75 62.48 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.71 -0.618 . . . . 0.0 109.767 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.45 -41.13 56.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.712 -0.617 . . . . 0.0 109.614 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -71.05 -29.19 65.02 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.65 -0.656 . . . . 0.0 109.743 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -71.11 -29.65 65.53 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.593 -0.692 . . . . 0.0 109.716 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -68.03 -42.23 80.94 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.678 -0.639 . . . . 0.0 109.867 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -66.91 -28.96 68.73 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.546 -0.721 . . . . 0.0 109.864 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -68.76 -30.94 69.65 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.644 -0.66 . . . . 0.0 109.95 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -65.04 -38.07 89.65 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.606 -0.684 . . . . 0.0 109.784 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.0 mt -61.25 -33.84 74.18 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.707 -0.621 . . . . 0.0 109.98 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -63.35 -46.06 88.33 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.511 -0.743 . . . . 0.0 109.905 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 42.4 mt -69.31 -28.63 66.43 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.734 -0.604 . . . . 0.0 109.862 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -100.52 7.95 43.79 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.673 -0.642 . . . . 0.0 110.997 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.0 tp . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.304 -179.99 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.402 ' CD1' ' CB ' ' B' ' 171' ' ' GLU . 0.1 OUTLIER -141.86 -84.08 0.19 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.51 -0.994 . . . . 0.0 110.454 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 66.7 m -127.84 19.35 6.62 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.064 -1.022 . . . . 0.0 110.819 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 16.7 tptt 50.71 25.92 2.29 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.237 -0.915 . . . . 0.0 110.652 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -148.96 -46.74 0.14 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.643 -0.661 . . . . 0.0 109.453 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . 0.402 ' CB ' ' CD1' ' B' ' 167' ' ' LEU . 1.1 mt-10 -66.3 -34.75 78.7 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.248 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 5.5 tt -77.63 -29.35 51.75 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.5 mm -68.56 -31.07 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.702 -0.624 . . . . 0.0 109.358 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -76.29 -30.31 57.73 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.672 -0.643 . . . . 0.0 109.835 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -75.05 -30.1 60.92 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.718 -0.614 . . . . 0.0 109.847 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -31.19 65.91 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.636 -0.665 . . . . 0.0 109.848 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.72 -29.97 56.44 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.956 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -76.81 -30.1 56.26 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.608 -0.683 . . . . 0.0 109.829 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 71.1 t -74.48 -29.69 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.616 -0.677 . . . . 0.0 109.687 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -71.63 -28.8 64.02 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.583 -0.698 . . . . 0.0 109.99 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 22.1 mtp180 -74.88 -29.49 61.03 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.591 -0.693 . . . . 0.0 110.031 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -74.64 -34.44 62.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.725 -0.609 . . . . 0.0 110.039 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 78.3 mt -71.18 -28.77 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.715 -0.616 . . . . 0.0 109.768 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.6 m -72.17 -33.59 67.82 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.59 -0.694 . . . . 0.0 109.803 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 11.2 ttt -75.46 -36.86 60.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.62 -0.675 . . . . 0.0 109.733 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.5 t -74.88 -30.58 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.7 -0.625 . . . . 0.0 109.528 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -75.48 -28.77 59.34 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.716 -0.615 . . . . 0.0 109.915 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -74.44 -28.98 61.29 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.648 -0.657 . . . . 0.0 109.992 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.27 -36.71 63.84 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.637 -0.665 . . . . 0.0 109.952 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.459 HG23 HD13 ' B' ' 190' ' ' ILE . 82.0 mt -72.1 -31.55 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.621 -0.674 . . . . 0.0 109.607 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 3.7 m -71.36 -35.85 71.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.698 -0.626 . . . . 0.0 109.571 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 14.7 mmtt -75.52 -32.47 60.49 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.517 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.0 -17.65 58.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.695 -0.628 . . . . 0.0 110.426 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 7.3 tptt -85.53 -27.0 25.87 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.349 -0.844 . . . . 0.0 109.545 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -76.45 -32.84 58.66 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.624 -0.673 . . . . 0.0 110.006 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -25.07 62.92 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.495 -0.753 . . . . 0.0 109.896 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -70.39 -30.07 66.88 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.509 -0.744 . . . . 0.0 109.591 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.61 -46.69 87.1 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.596 -0.69 . . . . 0.0 109.513 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -61.74 -36.94 82.44 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.738 -0.601 . . . . 0.0 109.899 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 19.6 tp -75.47 -35.32 60.89 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.603 -0.686 . . . . 0.0 109.658 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 . . . . . 0 N--CA 1.493 1.716 0 O-C-N 121.66 -0.65 . . . . 0.0 109.641 179.44 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 mp . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 121.094 0.473 . . . . 0.0 109.97 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -67.23 -30.63 70.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.543 -0.723 . . . . 0.0 110.007 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -75.03 -39.23 61.18 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.608 -0.682 . . . . 0.0 109.87 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 47.3 m -72.21 -30.75 65.23 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.655 -0.653 . . . . 0.0 109.638 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -71.72 -27.47 63.02 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.647 -0.658 . . . . 0.0 109.967 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -69.64 -34.84 74.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.626 -0.671 . . . . 0.0 110.175 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 -75.67 -35.27 60.42 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.612 -0.68 . . . . 0.0 109.652 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.3 mt -72.34 -27.52 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.781 -0.574 . . . . 0.0 109.554 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 9.6 tt -71.13 -38.88 72.27 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.635 -0.666 . . . . 0.0 109.915 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -35.02 79.51 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.596 -0.69 . . . . 0.0 109.676 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.719 -0.613 . . . . 0.0 109.825 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.9 -36.13 83.38 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.607 -0.683 . . . . 0.0 109.977 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -76.1 -30.98 58.48 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.634 -0.666 . . . . 0.0 109.724 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tttm -77.19 -31.71 55.55 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.715 -0.616 . . . . 0.0 109.774 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 36.4 tp -77.74 -30.65 51.73 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.624 -0.672 . . . . 0.0 109.681 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.79 -30.94 56.66 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.678 -0.639 . . . . 0.0 109.639 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.32 -29.99 61.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.593 -0.692 . . . . 0.0 109.956 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.34 -38.2 56.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.639 -0.663 . . . . 0.0 109.631 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -71.69 -29.07 64.17 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.589 -0.694 . . . . 0.0 109.748 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -71.4 -29.47 64.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.581 -0.7 . . . . 0.0 109.866 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -70.8 -43.57 68.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.619 -0.676 . . . . 0.0 109.852 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -62.96 -29.31 70.71 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.587 -0.696 . . . . 0.0 109.748 179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -63.44 -31.14 72.21 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.622 -0.674 . . . . 0.0 109.848 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -62.8 -32.82 74.08 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.672 -0.643 . . . . 0.0 109.852 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.39 -35.93 78.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.647 -0.658 . . . . 0.0 109.81 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -64.18 -29.24 70.36 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.682 -0.636 . . . . 0.0 110.052 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 tp -65.85 -30.12 70.68 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.58 -0.7 . . . . 0.0 110.004 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.58 27.38 9.23 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.601 -0.687 . . . . 0.0 110.289 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 51.2 tp . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 118.045 -0.978 . . . . 0.0 110.168 179.923 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -140.84 -84.07 0.21 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.578 -0.954 . . . . 0.0 110.561 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -128.64 19.66 6.16 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.143 -0.973 . . . . 0.0 110.9 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 7.6 tptm 50.76 26.09 2.4 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.21 -0.931 . . . . 0.0 110.604 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -149.33 -45.87 0.14 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.627 -0.67 . . . . 0.0 109.694 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.45 -35.85 81.33 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.804 -0.759 . . . . 0.0 109.292 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 10.2 tp -76.9 -28.79 55.45 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 178.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.7 mm -66.59 -31.38 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.616 -0.677 . . . . 0.0 109.196 179.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -74.98 -31.08 61.35 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.124 -0.63 . . . . 0.0 109.775 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -75.03 -34.72 61.91 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.681 -0.637 . . . . 0.0 109.77 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -30.67 68.03 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.743 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -67.15 -35.26 79.33 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.666 -0.647 . . . . 0.0 109.727 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.51 -30.73 59.92 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.72 -0.612 . . . . 0.0 109.686 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 69.3 t -76.67 -30.96 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.702 -0.624 . . . . 0.0 109.569 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . 0.41 ' O ' ' OG1' ' B' ' 184' ' ' THR . 7.9 t70 -75.24 -29.72 60.31 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.728 -0.608 . . . . 0.0 109.907 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -73.47 -30.16 62.99 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.691 -0.631 . . . . 0.0 109.851 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -72.53 -36.91 68.41 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.652 -0.655 . . . . 0.0 109.965 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.0 mt -70.02 -30.52 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.705 -0.622 . . . . 0.0 109.652 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 184' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 1.8 m -68.58 -35.04 76.82 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.673 -0.642 . . . . 0.0 109.652 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -46.63 74.79 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.582 -0.699 . . . . 0.0 109.659 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 60.5 t -70.57 -33.03 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.634 -0.666 . . . . 0.0 109.307 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -72.86 -29.95 63.6 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.775 -0.578 . . . . 0.0 109.675 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 37.5 mm-40 -68.89 -30.27 68.73 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.636 -0.665 . . . . 0.0 109.781 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.55 -36.83 63.11 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.594 -0.691 . . . . 0.0 109.841 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 79.4 mt -69.54 -30.58 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.627 -0.671 . . . . 0.0 109.523 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 20.4 m -66.67 -40.29 88.53 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.701 -0.624 . . . . 0.0 109.612 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -72.32 -31.53 65.75 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 120.087 -0.645 . . . . 0.0 109.495 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.39 -35.41 68.41 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.756 -0.59 . . . . 0.0 109.418 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -68.5 -43.09 77.6 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.693 -0.63 . . . . 0.0 109.497 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -67.3 -32.0 72.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.667 -0.646 . . . . 0.0 109.327 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -34.89 79.25 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -63.01 -30.37 71.55 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.795 -0.566 . . . . 0.0 109.637 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.42 -46.24 90.93 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.705 -0.622 . . . . 0.0 109.743 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -62.09 -46.2 90.11 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.714 -0.617 . . . . 0.0 109.843 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 4.9 tp -69.48 -34.34 74.19 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.623 -0.673 . . . . 0.0 109.822 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.649 -0.657 . . . . 0.0 109.811 179.507 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.1 tp . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 121.115 0.483 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -76.29 -31.71 58.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.579 -0.701 . . . . 0.0 110.082 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -76.78 -30.8 56.63 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.596 -0.69 . . . . 0.0 109.798 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.9 m -75.16 -30.04 60.62 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.686 -0.634 . . . . 0.0 109.755 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.1 mmtt -72.33 -27.21 62.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.624 -0.672 . . . . 0.0 110.137 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -72.86 -35.32 67.18 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.562 -0.711 . . . . 0.0 110.206 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.1 tp60 -76.07 -35.09 59.56 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.502 -0.748 . . . . 0.0 109.706 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.6 mt -75.39 -28.62 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.771 -0.58 . . . . 0.0 109.503 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.3 tt -75.19 -36.93 61.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.625 -0.672 . . . . 0.0 109.601 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -66.31 -29.45 69.65 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.469 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.6 mt -62.04 -33.03 73.62 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.695 -0.628 . . . . 0.0 109.899 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -61.6 -36.04 79.56 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.523 -0.736 . . . . 0.0 109.888 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -77.31 -31.46 54.66 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.71 -0.618 . . . . 0.0 109.353 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.3 -30.67 62.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.705 -0.622 . . . . 0.0 109.621 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -74.01 -34.89 64.32 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.667 -0.646 . . . . 0.0 109.647 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tp -71.83 -36.71 70.3 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.693 -0.629 . . . . 0.0 109.61 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.69 -30.38 71.06 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.745 -0.597 . . . . 0.0 109.481 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.6 -41.88 98.08 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.707 -0.621 . . . . 0.0 109.828 179.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -67.58 -30.26 69.84 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.614 -0.679 . . . . 0.0 109.753 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -30.18 69.42 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.688 -0.632 . . . . 0.0 109.765 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.33 -49.29 57.09 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.657 -0.652 . . . . 0.0 109.782 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.9 ttpt -66.96 -31.27 71.73 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.578 -0.701 . . . . 0.0 109.494 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -70.12 -30.24 67.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.753 -0.592 . . . . 0.0 109.775 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -67.43 -29.72 69.28 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.571 -0.706 . . . . 0.0 109.886 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.47 -39.55 88.85 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.579 -0.701 . . . . 0.0 109.922 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -61.14 -29.26 69.67 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.546 -0.721 . . . . 0.0 110.14 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.9 tp -70.32 -27.65 64.54 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.628 -0.67 . . . . 0.0 110.199 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -119.84 26.99 8.96 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.528 -0.733 . . . . 0.0 110.412 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 29.2 tp . . . . . 0 N--CA 1.496 1.861 0 CA-C-O 117.933 -1.032 . . . . 0.0 109.989 179.9 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.43 -77.59 0.25 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.553 -0.969 . . . . 0.0 110.536 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 18.1 t -136.48 18.62 3.12 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.105 -0.997 . . . . 0.0 110.876 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 40.6 tptt 50.67 25.95 2.28 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.238 -0.914 . . . . 0.0 110.562 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -148.23 -46.66 0.16 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.692 -0.63 . . . . 0.0 109.386 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.18 -32.56 72.88 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.21 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 3.9 tt -78.96 -29.28 43.88 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.8 mm -68.61 -30.55 47.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.721 -0.612 . . . . 0.0 109.4 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -72.67 -30.55 64.36 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.6 -0.688 . . . . 0.0 109.803 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -74.67 -31.7 62.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.619 -0.676 . . . . 0.0 109.701 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.6 mtt -70.16 -30.83 68.08 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.763 -0.586 . . . . 0.0 109.869 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -76.95 -30.94 56.25 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.635 -0.666 . . . . 0.0 109.886 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -29.84 57.37 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.661 -0.649 . . . . 0.0 109.735 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 73.9 t -74.39 -28.45 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.6 -0.688 . . . . 0.0 109.81 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -74.65 -36.72 62.86 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.613 -0.68 . . . . 0.0 110.047 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 15.3 mtt85 -70.09 -26.32 63.93 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.639 -0.663 . . . . 0.0 109.977 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -72.87 -36.1 67.31 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.515 -0.741 . . . . 0.0 110.142 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 87.3 mt -67.89 -27.94 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.57 -0.707 . . . . 0.0 109.874 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 7.8 m -67.97 -34.61 76.89 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.559 -0.713 . . . . 0.0 109.787 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 mtm -73.78 -37.71 64.9 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.6 -0.688 . . . . 0.0 109.742 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.7 t -73.29 -30.42 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.642 -0.661 . . . . 0.0 109.616 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.56 -29.22 61.27 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.6 -0.688 . . . . 0.0 109.991 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -30.85 63.37 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.651 -0.655 . . . . 0.0 109.939 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -32.57 69.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.625 -0.672 . . . . 0.0 109.942 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.462 HD11 HG23 ' B' ' 190' ' ' ILE . 78.1 mt -75.3 -30.71 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.546 -0.721 . . . . 0.0 109.739 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 27.6 m -75.53 -35.86 60.62 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.632 -0.667 . . . . 0.0 109.654 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 28.5 mtmt -73.48 -34.19 65.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.662 -0.649 . . . . 0.0 109.538 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.28 -35.6 76.21 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -64.15 -47.32 80.37 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -67.43 -31.93 72.45 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -64.83 -34.18 77.77 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -63.41 -30.85 71.91 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 120.223 -0.591 . . . . 0.0 109.48 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -60.98 -45.89 92.96 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.655 -0.653 . . . . 0.0 109.885 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -61.82 -39.51 92.04 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.745 -0.597 . . . . 0.0 109.739 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 13.7 tp -74.89 -30.52 61.33 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.65 -0.656 . . . . 0.0 109.582 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.644 -0.66 . . . . 0.0 109.761 179.441 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 tt . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 121.112 0.482 . . . . 0.0 110.082 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -64.58 -31.41 72.61 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.626 -0.671 . . . . 0.0 110.067 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -72.25 -33.15 67.29 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.595 -0.69 . . . . 0.0 109.924 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.8 m -70.56 -38.51 74.15 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.689 -0.632 . . . . 0.0 109.76 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -63.99 -27.04 68.86 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.625 -0.672 . . . . 0.0 109.943 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -66.82 -39.58 87.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.532 -0.73 . . . . 0.0 110.204 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.0 tp60 -76.07 -31.48 58.8 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.608 -0.682 . . . . 0.0 109.624 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.427 HD11 HG22 ' A' ' 69' ' ' ILE . 90.8 mt -77.42 -28.12 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.743 -0.598 . . . . 0.0 109.533 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 24.5 tp -75.14 -38.12 61.14 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.585 -0.697 . . . . 0.0 109.536 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -65.54 -30.95 71.76 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.623 -0.673 . . . . 0.0 109.565 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mt -62.64 -35.72 80.54 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.655 -0.653 . . . . 0.0 110.06 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -61.99 -35.69 79.24 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.598 -0.689 . . . . 0.0 110.033 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -76.16 -30.66 58.18 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.612 -0.68 . . . . 0.0 109.731 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.6 tttt -75.81 -28.95 58.51 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.658 -0.651 . . . . 0.0 109.888 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.7 tp -76.83 -32.37 57.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.676 -0.64 . . . . 0.0 109.984 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.64 -31.56 57.45 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.652 -0.655 . . . . 0.0 109.792 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.24 -27.71 59.6 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.699 -0.626 . . . . 0.0 110.068 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.1 tp -76.55 -31.66 57.72 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.543 -0.723 . . . . 0.0 110.086 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -75.07 -30.48 60.99 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.642 -0.661 . . . . 0.0 109.784 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -71.91 -28.13 63.29 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.689 -0.632 . . . . 0.0 109.81 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -68.76 -37.5 79.4 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.565 -0.709 . . . . 0.0 110.012 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -70.32 -29.65 66.42 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.474 -0.766 . . . . 0.0 109.923 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -69.67 -29.83 67.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.591 -0.693 . . . . 0.0 109.75 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.0 tm0? -64.85 -34.19 77.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.647 -0.658 . . . . 0.0 109.959 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.24 -38.62 91.7 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.586 -0.696 . . . . 0.0 109.858 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.421 ' CG ' ' HE1' ' B' ' 176' ' ' MET . 9.6 m-85 -60.76 -28.59 68.84 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.628 -0.67 . . . . 0.0 110.141 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 66.7 mt -72.85 -28.72 62.7 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.572 -0.705 . . . . 0.0 110.138 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -116.99 25.82 10.23 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.628 -0.67 . . . . 0.0 110.433 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.805 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.903 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.66 -80.03 0.13 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.476 -1.014 . . . . 0.0 110.524 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 168' ' ' SER . . . . . 0.406 ' O ' ' OG ' ' B' ' 168' ' ' SER . 3.1 t -134.18 19.2 3.72 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.234 -0.916 . . . . 0.0 110.919 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 25.4 tptt 50.63 25.92 2.24 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.175 -0.953 . . . . 0.0 110.598 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -148.2 -46.66 0.16 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.722 -0.611 . . . . 0.0 109.354 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.77 -32.16 72.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.593 -0.692 . . . . 0.0 109.32 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.3 tt -78.95 -28.17 43.66 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 49.6 mm -70.6 -31.41 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.652 -0.655 . . . . 0.0 109.418 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 52.9 tp60 -71.07 -28.22 64.2 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.666 -0.646 . . . . 0.0 109.939 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -70.34 -28.62 65.28 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.622 -0.674 . . . . 0.0 110.151 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.421 ' HE1' ' CG ' ' A' ' 87' ' ' PHE . 0.4 OUTLIER -75.27 -31.84 60.87 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.49 -0.757 . . . . 0.0 110.049 179.845 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -73.18 -30.02 63.25 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.614 -0.679 . . . . 0.0 109.967 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -77.69 -30.52 51.94 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.645 -0.659 . . . . 0.0 109.865 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 65.7 t -76.8 -30.31 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.698 -0.626 . . . . 0.0 109.738 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -76.98 -29.64 55.61 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.7 -0.625 . . . . 0.0 109.989 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.5 -28.32 59.13 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.655 -0.653 . . . . 0.0 109.971 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -74.96 -33.85 61.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.613 -0.68 . . . . 0.0 110.052 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 89.1 mt -71.47 -28.23 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.589 -0.694 . . . . 0.0 109.817 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.7 m -71.51 -34.73 70.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.57 -0.706 . . . . 0.0 109.918 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -39.21 62.87 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.597 -0.689 . . . . 0.0 109.775 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 60.2 t -74.34 -29.89 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.569 -0.707 . . . . 0.0 109.564 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -76.34 -28.48 56.89 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.623 -0.673 . . . . 0.0 109.958 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -75.13 -28.06 60.04 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.539 -0.725 . . . . 0.0 110.11 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.89 -29.22 61.95 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.585 -0.697 . . . . 0.0 110.022 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.43 HG23 HD12 ' B' ' 190' ' ' ILE . 81.0 mt -76.04 -34.28 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.632 -0.667 . . . . 0.0 109.71 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 86.9 p -70.57 -30.95 67.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.74 -0.6 . . . . 0.0 109.501 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 25.2 mmtt -77.36 -33.86 55.2 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.638 -0.664 . . . . 0.0 109.591 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.5 -31.52 65.42 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.594 -0.691 . . . . 0.0 109.27 179.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -66.96 -41.27 87.18 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.614 -0.679 . . . . 0.0 109.476 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -71.32 -31.77 67.81 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.676 -0.64 . . . . 0.0 109.284 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 9.7 ttpt -67.88 -32.39 72.85 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -64.77 -30.07 71.06 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.706 -0.621 . . . . 0.0 109.485 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.77 -46.07 91.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.652 -0.655 . . . . 0.0 109.81 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -61.92 -37.72 85.71 Favored 'General case' 0 N--CA 1.496 1.842 0 C-N-CA 120.228 -0.589 . . . . 0.0 109.807 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.6 tp -73.59 -33.61 64.69 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.583 -0.698 . . . . 0.0 109.673 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 . . . . . 0 N--CA 1.493 1.695 0 O-C-N 121.684 -0.635 . . . . 0.0 109.707 179.608 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 121.044 0.45 . . . . 0.0 110.059 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -72.23 -34.29 68.2 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.035 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -75.06 -31.33 61.24 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.635 -0.665 . . . . 0.0 109.779 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 56.7 m -72.52 -29.79 63.91 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.717 -0.614 . . . . 0.0 109.76 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -69.15 -26.98 65.14 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.619 -0.676 . . . . 0.0 110.149 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -70.36 -31.89 69.35 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.586 -0.697 . . . . 0.0 110.328 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.1 tp60 -77.51 -34.25 54.12 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.492 -0.755 . . . . 0.0 109.847 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 81.1 mt -74.08 -26.98 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.721 -0.612 . . . . 0.0 109.56 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.9 mt -72.38 -37.27 68.8 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.5 -0.75 . . . . 0.0 109.882 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -65.26 -30.63 71.53 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.585 -0.697 . . . . 0.0 109.846 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -68.72 -29.27 67.65 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.65 -0.656 . . . . 0.0 110.049 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -69.44 -33.74 73.39 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.546 -0.721 . . . . 0.0 110.033 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -30.0 58.56 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.646 -0.659 . . . . 0.0 109.87 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -76.19 -29.42 57.66 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.686 -0.634 . . . . 0.0 109.986 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -76.76 -32.12 57.51 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.585 -0.697 . . . . 0.0 109.863 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.6 mp -76.55 -32.56 58.27 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.747 -0.595 . . . . 0.0 109.782 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.1 -28.73 61.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.698 -0.626 . . . . 0.0 109.811 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.0 -36.69 64.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.619 -0.676 . . . . 0.0 109.89 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -69.25 -28.37 66.27 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.593 -0.692 . . . . 0.0 110.014 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -70.94 -27.92 64.11 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.564 -0.71 . . . . 0.0 110.052 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -44.18 64.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.532 -0.73 . . . . 0.0 109.804 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.6 ttpp -62.78 -27.66 69.45 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.513 -0.742 . . . . 0.0 109.673 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -63.95 -32.95 74.66 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.565 -0.71 . . . . 0.0 110.023 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -64.49 -34.88 79.24 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.534 -0.729 . . . . 0.0 109.792 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.22 -35.22 80.1 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.599 -0.688 . . . . 0.0 109.896 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -60.75 -35.45 76.42 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.585 -0.697 . . . . 0.0 110.029 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mt -62.81 -30.31 71.38 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.637 -0.664 . . . . 0.0 109.674 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -96.77 -26.79 15.01 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.693 -0.63 . . . . 0.0 110.095 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.4 ' CD1' ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.005 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.494 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.5 -28.62 5.29 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.589 -0.947 . . . . 0.0 110.615 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 8.3 t -165.84 18.12 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.349 -0.845 . . . . 0.0 111.62 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 48.66 26.58 1.26 Allowed 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.095 -1.003 . . . . 0.0 111.291 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -154.44 -46.56 0.09 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.723 -0.611 . . . . 0.0 110.109 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -74.12 -35.38 64.12 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.921 -0.712 . . . . 0.0 109.291 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 19.3 tp -76.01 -26.48 56.71 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . 0.4 ' CD1' ' CD1' ' A' ' 90' ' ' LEU . 49.1 mm -69.22 -32.85 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -70.44 -30.18 66.96 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.716 -0.615 . . . . 0.0 109.869 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -67.22 -32.24 73.16 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.612 -0.68 . . . . 0.0 109.858 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -31.51 67.81 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.713 -0.617 . . . . 0.0 109.746 179.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.79 -30.27 63.96 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.707 -0.621 . . . . 0.0 109.856 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -39.94 61.96 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.619 -0.676 . . . . 0.0 109.926 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 61.2 t -72.09 -30.97 38.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.675 -0.641 . . . . 0.0 109.458 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.73 -30.09 65.25 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.664 -0.648 . . . . 0.0 109.748 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -67.33 -32.75 73.92 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.645 -0.659 . . . . 0.0 109.768 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -74.14 -35.87 64.1 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.58 -0.7 . . . . 0.0 109.942 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.5 mt -72.99 -29.76 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.703 -0.623 . . . . 0.0 109.705 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 53.7 m -74.15 -32.7 63.24 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.633 -0.667 . . . . 0.0 109.806 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.0 mtt -74.33 -39.27 62.94 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.669 -0.644 . . . . 0.0 109.705 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -72.33 -30.83 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.586 -0.696 . . . . 0.0 109.511 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -72.72 -29.7 63.58 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.711 -0.618 . . . . 0.0 109.905 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -29.89 66.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.641 -0.662 . . . . 0.0 109.899 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.06 -34.05 63.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.706 -0.621 . . . . 0.0 109.989 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.444 HG23 HD13 ' B' ' 190' ' ' ILE . 72.9 mt -73.86 -31.77 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.583 -0.698 . . . . 0.0 109.742 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 89.8 p -72.21 -34.88 68.69 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.615 -0.678 . . . . 0.0 109.462 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 4.0 mmmt -76.35 -32.51 58.69 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.366 179.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.08 -31.37 67.73 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 179.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.9 tptt -68.83 -46.68 67.94 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.592 -0.693 . . . . 0.0 109.651 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 3.2 tptp -66.58 -31.47 72.19 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.563 -0.71 . . . . 0.0 109.287 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -65.25 -34.87 79.37 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -65.3 -29.11 69.84 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.688 -0.633 . . . . 0.0 109.676 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -62.16 -40.19 95.16 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.629 -0.669 . . . . 0.0 109.76 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -62.49 -34.63 77.22 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.79 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 11.0 tp -76.88 -30.69 56.33 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.653 -0.655 . . . . 0.0 109.702 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.613 -0.68 . . . . 0.0 109.713 179.612 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mm? . . . . . 0 N--CA 1.495 1.778 0 CA-C-O 121.028 0.442 . . . . 0.0 109.842 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -63.24 -41.82 99.13 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.666 -0.646 . . . . 0.0 109.997 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -72.16 -37.55 69.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.667 -0.646 . . . . 0.0 109.642 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 89.7 m -73.62 -30.9 63.25 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.757 -0.59 . . . . 0.0 109.413 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -69.9 -27.66 64.98 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 120.166 -0.614 . . . . 0.0 109.92 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.47 -38.54 81.16 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.587 -0.695 . . . . 0.0 110.084 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -75.99 -36.02 59.36 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.612 -0.68 . . . . 0.0 109.606 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.1 mt -75.61 -26.2 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.777 -0.577 . . . . 0.0 109.644 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 tt -76.03 -33.89 59.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.549 -0.72 . . . . 0.0 109.812 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.9 mmtm -70.41 -32.97 70.82 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.601 -0.687 . . . . 0.0 109.655 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.9 mt -65.8 -29.96 70.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.679 -0.638 . . . . 0.0 109.707 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.11 -44.18 96.39 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.648 -0.658 . . . . 0.0 109.82 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.08 -32.5 72.87 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.693 -0.63 . . . . 0.0 109.428 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -67.53 -35.2 78.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.773 -0.579 . . . . 0.0 109.743 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -71.19 -31.64 67.88 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.719 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.65 -38.72 67.58 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.718 -0.614 . . . . 0.0 109.572 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.17 -30.57 71.08 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.714 -0.617 . . . . 0.0 109.742 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -70.33 -46.75 63.55 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.708 -0.62 . . . . 0.0 109.734 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -64.28 -31.04 72.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.633 -0.667 . . . . 0.0 109.602 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.75 -29.43 69.95 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.688 -0.633 . . . . 0.0 109.781 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -64.62 -47.65 77.78 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.656 -0.653 . . . . 0.0 109.669 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 tptm -63.1 -30.77 71.86 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.671 -0.643 . . . . 0.0 109.619 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.6 t60 -64.93 -34.31 78.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.744 -0.598 . . . . 0.0 109.832 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -70.52 -37.35 74.11 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.709 -0.619 . . . . 0.0 109.745 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.1 -29.42 69.74 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.711 -0.618 . . . . 0.0 109.763 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -29.53 69.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.57 -0.706 . . . . 0.0 109.829 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.0 mp -76.62 -28.83 56.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.702 -0.624 . . . . 0.0 110.044 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -95.72 1.61 53.51 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.578 -0.701 . . . . 0.0 111.071 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.272 -179.96 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.26 -79.48 0.16 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.561 -0.964 . . . . 0.0 110.471 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 35.5 t -134.35 18.85 3.66 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.19 -0.944 . . . . 0.0 110.799 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 7.4 tptm 50.76 25.9 2.32 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.222 -0.924 . . . . 0.0 110.558 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -148.44 -46.49 0.15 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.612 -0.68 . . . . 0.0 109.417 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.39 -33.08 74.44 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.286 179.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.2 tt -78.5 -28.42 46.33 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 178.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.7 mm -68.5 -30.82 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -71.76 -30.27 65.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.648 -0.658 . . . . 0.0 109.979 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -74.72 -32.9 62.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.636 -0.665 . . . . 0.0 109.716 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.4 mtt -70.13 -29.77 66.78 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.692 -0.63 . . . . 0.0 109.983 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -73.81 -35.12 64.83 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.584 -0.697 . . . . 0.0 110.044 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -75.55 -29.93 59.54 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.636 -0.665 . . . . 0.0 109.876 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 68.4 t -76.05 -29.88 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.608 -0.682 . . . . 0.0 109.653 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -75.73 -35.93 60.09 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.653 -0.654 . . . . 0.0 109.834 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.4 mtt85 -71.46 -28.45 63.96 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.632 -0.668 . . . . 0.0 109.723 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -70.19 -32.96 71.14 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.531 -0.731 . . . . 0.0 109.953 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 76.0 mt -70.88 -29.05 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.568 -0.707 . . . . 0.0 109.766 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.9 m -71.34 -34.73 70.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.574 -0.704 . . . . 0.0 109.742 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.22 -43.85 66.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.615 -0.678 . . . . 0.0 109.731 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 73.4 t -71.95 -31.53 40.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.577 -0.702 . . . . 0.0 109.426 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.49 -30.18 59.79 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.659 -0.651 . . . . 0.0 109.704 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 12.0 tp-100 -73.03 -30.13 63.52 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.643 -0.66 . . . . 0.0 109.843 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -37.44 73.73 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.683 -0.636 . . . . 0.0 109.823 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 75.8 mt -71.26 -31.15 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.63 -0.668 . . . . 0.0 109.554 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 6.4 m -68.49 -35.0 76.9 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.679 -0.638 . . . . 0.0 109.517 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 3.5 mmmm -74.73 -37.05 62.64 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.702 -0.624 . . . . 0.0 109.393 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.92 -31.82 68.56 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.635 -0.665 . . . . 0.0 109.367 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.7 tptm -66.56 -40.25 88.92 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.724 -0.61 . . . . 0.0 109.446 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -64.37 -31.62 72.9 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.666 -0.646 . . . . 0.0 109.43 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -63.74 -36.39 83.73 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.671 -0.643 . . . . 0.0 109.462 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -62.83 -30.03 71.18 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.774 -0.579 . . . . 0.0 109.632 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.54 -44.24 97.41 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.646 -0.659 . . . . 0.0 109.894 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -63.55 -39.98 95.82 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.699 -0.626 . . . . 0.0 109.699 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.6 tp -70.8 -40.64 72.4 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.655 -0.653 . . . . 0.0 109.721 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 . . . . . 0 N--CA 1.494 1.73 0 O-C-N 121.656 -0.653 . . . . 0.0 109.668 179.472 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.0 tp . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.099 0.476 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.16 -32.38 61.28 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.534 -0.729 . . . . 0.0 110.127 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -75.89 -36.79 59.36 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.629 -0.669 . . . . 0.0 109.735 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 89.6 m -71.87 -30.51 65.5 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.734 -0.603 . . . . 0.0 109.446 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -67.1 -28.91 68.56 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.593 -0.692 . . . . 0.0 109.767 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -63.49 -40.17 96.38 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.623 -0.673 . . . . 0.0 110.058 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -74.22 -34.54 63.71 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.653 -0.654 . . . . 0.0 109.609 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.8 mt -74.63 -27.05 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.744 -0.598 . . . . 0.0 109.578 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.3 tt -73.01 -31.56 64.55 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.544 -0.723 . . . . 0.0 109.843 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -30.88 70.94 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.509 -0.744 . . . . 0.0 109.843 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.9 mt -65.02 -29.1 69.99 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.624 -0.673 . . . . 0.0 110.036 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -66.76 -35.32 79.83 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.653 -0.654 . . . . 0.0 110.076 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.5 -32.8 58.53 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.603 -0.686 . . . . 0.0 109.826 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.7 tmtm? -77.73 -30.19 51.53 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.729 -0.607 . . . . 0.0 109.586 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 27.8 tp -79.16 -30.19 43.42 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.665 -0.647 . . . . 0.0 109.78 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.4 mp -77.68 -31.28 52.41 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.634 -0.666 . . . . 0.0 109.719 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.26 -28.66 59.9 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.655 -0.653 . . . . 0.0 109.875 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.6 tp -76.48 -36.24 57.94 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.603 -0.686 . . . . 0.0 109.893 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -73.04 -30.46 63.74 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.614 -0.679 . . . . 0.0 109.694 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -70.85 -27.95 64.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.677 -0.64 . . . . 0.0 109.875 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -39.67 81.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.571 -0.706 . . . . 0.0 109.935 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -68.99 -29.72 67.98 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.592 -0.693 . . . . 0.0 109.91 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -69.91 -29.75 67.01 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.7 -0.625 . . . . 0.0 109.943 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -67.15 -36.27 81.48 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.66 -0.65 . . . . 0.0 109.861 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mt -59.99 -36.59 77.51 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.659 -0.651 . . . . 0.0 110.01 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -63.6 -51.66 64.31 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.618 -0.676 . . . . 0.0 109.666 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.6 mt -62.14 -27.36 68.89 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.696 -0.627 . . . . 0.0 109.611 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -107.78 21.12 17.88 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.621 -0.674 . . . . 0.0 110.417 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.4 mt . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.445 -179.961 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.67 -61.9 1.86 Allowed 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.545 -0.974 . . . . 0.0 111.596 -179.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 5.3 t -149.14 14.74 0.9 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.995 -1.065 . . . . 0.0 111.328 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 19.6 tptt 49.94 26.21 1.92 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.081 -1.012 . . . . 0.0 110.867 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -150.86 -46.48 0.12 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.695 -0.628 . . . . 0.0 109.753 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.76 -42.64 85.8 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.355 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 9.8 tp -71.44 -28.78 64.21 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.0 mm -66.35 -32.1 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -74.94 -31.17 61.43 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.734 -0.604 . . . . 0.0 109.637 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -71.64 -29.95 65.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.692 -0.63 . . . . 0.0 109.805 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -68.06 -32.31 72.57 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.657 -0.652 . . . . 0.0 109.938 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -72.65 -34.49 67.3 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.616 -0.677 . . . . 0.0 109.933 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.41 -29.68 61.62 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.823 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 67.6 t -74.44 -30.17 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.638 -0.664 . . . . 0.0 109.75 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -71.94 -30.84 65.73 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.671 -0.643 . . . . 0.0 110.045 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -28.8 61.31 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.635 -0.666 . . . . 0.0 109.933 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -74.63 -37.24 62.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.587 -0.696 . . . . 0.0 109.928 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 90.3 mt -71.19 -29.66 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.689 -0.632 . . . . 0.0 109.592 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 65.5 m -70.71 -33.79 71.23 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.664 -0.648 . . . . 0.0 109.664 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.0 mtt -70.18 -44.54 68.52 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.637 -0.664 . . . . 0.0 109.686 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 67.4 t -66.92 -30.98 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.676 -0.64 . . . . 0.0 109.563 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.88 -30.69 68.19 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.654 -0.653 . . . . 0.0 109.808 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -36.59 80.32 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.663 -0.648 . . . . 0.0 109.712 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -38.56 82.06 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.633 -0.667 . . . . 0.0 109.85 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 72.9 mt -70.62 -37.09 68.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.623 -0.673 . . . . 0.0 109.667 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 32.5 m -68.87 -33.39 73.72 Favored 'General case' 0 N--CA 1.496 1.842 0 C-N-CA 120.192 -0.603 . . . . 0.0 109.605 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -77.01 -33.03 57.51 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.629 -0.67 . . . . 0.0 109.488 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.31 -33.14 65.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.68 -0.638 . . . . 0.0 109.324 179.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 16.5 tptt -65.4 -38.69 90.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.567 -0.708 . . . . 0.0 109.394 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -67.57 -31.24 71.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.627 -0.67 . . . . 0.0 109.336 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -37.1 86.01 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.664 -0.648 . . . . 0.0 109.422 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -62.79 -30.35 71.4 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.702 -0.624 . . . . 0.0 109.691 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -61.52 -41.2 96.95 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.672 -0.643 . . . . 0.0 109.874 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -62.29 -41.83 98.83 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.24 -0.584 . . . . 0.0 109.849 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.3 tp -72.36 -30.66 64.91 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.69 -0.631 . . . . 0.0 109.765 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 . . . . . 0 N--CA 1.493 1.714 0 O-C-N 121.679 -0.638 . . . . 0.0 109.832 179.602 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 N--CA 1.495 1.81 0 CA-C-O 121.153 0.501 . . . . 0.0 109.923 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -65.75 -30.0 70.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.53 -0.731 . . . . 0.0 110.009 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -48.99 66.1 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.59 -0.694 . . . . 0.0 109.976 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 26.6 m -67.02 -30.61 70.75 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.612 -0.68 . . . . 0.0 109.472 179.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -68.97 -28.12 66.34 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.681 -0.637 . . . . 0.0 109.883 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -65.19 -39.08 92.37 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.553 -0.717 . . . . 0.0 109.943 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.73 -41.09 65.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.615 -0.678 . . . . 0.0 109.42 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.402 HG21 HD12 ' A' ' 69' ' ' ILE . 87.4 mt -66.43 -27.21 39.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 mt -62.65 -41.32 98.99 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.588 -0.695 . . . . 0.0 109.629 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -65.14 -30.35 71.27 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.53 -0.731 . . . . 0.0 109.621 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 12.3 mt -73.05 -29.02 62.66 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.691 -0.63 . . . . 0.0 109.95 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.78 -34.71 72.07 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.599 -0.688 . . . . 0.0 109.881 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -74.03 -29.94 62.18 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.619 -0.676 . . . . 0.0 109.73 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -73.66 -30.02 62.67 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.637 -0.664 . . . . 0.0 109.916 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.0 tp -75.32 -32.51 60.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.638 -0.664 . . . . 0.0 109.935 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.54 -30.94 57.32 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.633 -0.667 . . . . 0.0 109.748 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.23 -28.84 60.06 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.688 -0.632 . . . . 0.0 109.845 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -75.08 -36.95 61.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.536 -0.728 . . . . 0.0 109.823 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -70.63 -29.85 66.34 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.538 -0.726 . . . . 0.0 109.802 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -69.78 -27.85 65.25 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.693 -0.629 . . . . 0.0 109.973 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -40.37 83.8 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.544 -0.723 . . . . 0.0 109.849 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -69.14 -30.46 68.72 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.474 -0.766 . . . . 0.0 109.627 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.4 t-80 -67.19 -29.62 69.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.655 -0.653 . . . . 0.0 109.826 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -63.06 -36.17 82.7 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.624 -0.672 . . . . 0.0 109.936 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.52 -32.56 73.44 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.582 -0.699 . . . . 0.0 109.887 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -66.9 -29.48 69.37 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.658 -0.651 . . . . 0.0 109.996 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.0 mt -66.86 -29.29 69.17 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.601 -0.687 . . . . 0.0 110.049 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -120.14 29.28 7.59 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.58 -0.7 . . . . 0.0 110.161 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 27.7 tp . . . . . 0 N--CA 1.497 1.906 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.053 179.983 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.74 -82.62 0.21 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.681 -0.893 . . . . 0.0 110.413 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 59.8 p -129.5 19.52 5.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.13 -0.981 . . . . 0.0 110.825 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 5.7 tptm 50.61 25.99 2.26 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.272 -0.893 . . . . 0.0 110.616 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -148.79 -46.0 0.15 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.648 -0.657 . . . . 0.0 109.605 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.33 -33.16 73.79 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.92 -0.712 . . . . 0.0 109.322 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 2.7 tt -78.11 -28.37 48.59 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 178.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.8 mm -67.54 -30.76 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.736 -0.602 . . . . 0.0 109.381 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -72.04 -29.73 64.46 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.668 -0.645 . . . . 0.0 109.926 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -75.44 -30.95 60.16 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.611 -0.681 . . . . 0.0 109.8 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.92 -29.14 63.99 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.734 -0.604 . . . . 0.0 109.84 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -70.42 -29.96 66.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.592 -0.692 . . . . 0.0 110.027 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.9 ttp180 -71.99 -36.36 69.75 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.617 -0.677 . . . . 0.0 109.923 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 58.4 t -67.22 -29.82 47.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.707 -0.62 . . . . 0.0 109.881 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . 0.408 ' O ' ' OG1' ' B' ' 184' ' ' THR . 8.1 t0 -69.12 -28.95 66.92 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.632 -0.667 . . . . 0.0 110.141 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.36 -30.0 63.01 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.654 -0.654 . . . . 0.0 110.066 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -74.63 -35.74 62.9 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.597 -0.689 . . . . 0.0 109.956 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.9 mt -71.82 -30.85 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.705 -0.622 . . . . 0.0 109.56 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 184' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 4.7 m -69.71 -35.14 74.78 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.63 -0.669 . . . . 0.0 109.617 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.7 ttp -66.61 -44.84 81.0 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.654 -0.654 . . . . 0.0 109.815 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 64.6 t -68.96 -30.65 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.628 -0.67 . . . . 0.0 109.476 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -70.18 -28.51 65.38 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.67 -0.644 . . . . 0.0 110.021 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -67.47 -32.86 73.99 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.582 -0.699 . . . . 0.0 110.041 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.05 -33.65 57.22 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.663 -0.648 . . . . 0.0 109.67 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 75.2 mt -76.01 -27.91 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.615 -0.678 . . . . 0.0 109.705 179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.33 -30.48 63.38 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.632 -0.667 . . . . 0.0 109.572 179.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 19.8 mmtt -76.27 -37.11 58.0 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.596 -0.69 . . . . 0.0 109.749 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.03 -30.79 67.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.615 -0.678 . . . . 0.0 109.428 179.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.1 tptm -67.56 -38.26 83.88 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.635 -0.665 . . . . 0.0 109.614 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.3 tptt -69.62 -30.28 67.98 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.575 -0.703 . . . . 0.0 109.533 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -67.52 -32.77 73.8 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.603 -0.685 . . . . 0.0 109.606 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -65.27 -30.91 71.82 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.692 -0.63 . . . . 0.0 109.684 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -43.42 98.88 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.765 -0.584 . . . . 0.0 109.93 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -46.76 87.84 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.696 -0.627 . . . . 0.0 109.942 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 4.8 tp -70.27 -32.87 70.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.649 -0.657 . . . . 0.0 109.725 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.642 -0.661 . . . . 0.0 109.878 179.617 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 121.091 0.472 . . . . 0.0 110.168 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -70.68 -29.32 65.6 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.55 -0.719 . . . . 0.0 110.184 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -74.74 -40.22 61.39 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.58 -0.7 . . . . 0.0 109.973 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.7 m -71.48 -29.75 65.19 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.729 -0.607 . . . . 0.0 109.723 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.5 mmtp -72.5 -28.48 62.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.649 -0.657 . . . . 0.0 109.925 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -34.6 73.12 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.59 -0.694 . . . . 0.0 109.979 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -37.17 65.64 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.668 -0.645 . . . . 0.0 109.706 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.5 mt -68.77 -27.77 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.714 -0.616 . . . . 0.0 109.619 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.22 -35.93 80.62 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.58 -0.7 . . . . 0.0 109.936 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.0 mttt -70.03 -30.18 67.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.6 -0.687 . . . . 0.0 109.96 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -70.86 -28.7 64.76 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.61 -0.681 . . . . 0.0 109.964 179.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.34 -35.82 76.3 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.535 -0.728 . . . . 0.0 110.099 179.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -73.11 -31.7 64.49 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.716 -0.615 . . . . 0.0 109.827 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -75.04 -34.71 61.89 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.687 -0.633 . . . . 0.0 109.788 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.0 tp -74.19 -30.42 62.21 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.663 -0.648 . . . . 0.0 109.703 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.5 tp -74.8 -35.34 62.5 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.74 -0.6 . . . . 0.0 109.69 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.97 -29.82 68.12 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.707 -0.621 . . . . 0.0 109.758 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.8 mp -69.81 -43.1 72.76 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.767 -0.583 . . . . 0.0 109.813 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -66.64 -29.14 69.09 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.657 -0.652 . . . . 0.0 109.89 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -69.33 -30.46 68.51 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.557 -0.714 . . . . 0.0 109.826 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.4 -48.26 50.99 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.619 -0.676 . . . . 0.0 109.729 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.5 tttp -63.87 -29.52 70.7 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.587 -0.696 . . . . 0.0 109.568 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -66.08 -29.98 70.41 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.675 -0.641 . . . . 0.0 109.948 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -64.15 -40.62 96.52 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.638 -0.664 . . . . 0.0 109.86 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.8 mt -60.41 -33.5 72.58 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.557 -0.715 . . . . 0.0 110.066 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -63.8 -47.13 82.09 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.59 -0.694 . . . . 0.0 109.786 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.54 -28.63 68.69 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.722 -0.611 . . . . 0.0 109.678 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.48 13.06 36.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.679 -0.638 . . . . 0.0 110.81 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 27.7 tp . . . . . 0 N--CA 1.499 1.984 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.315 -179.92 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -144.64 -68.93 0.3 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.556 -0.967 . . . . 0.0 110.67 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 13.1 t -145.44 16.41 1.48 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.225 -0.922 . . . . 0.0 110.974 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.7 tptm 50.65 26.06 2.32 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.119 -0.988 . . . . 0.0 110.615 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -149.14 -46.58 0.14 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.606 -0.684 . . . . 0.0 109.491 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -66.26 -37.13 84.76 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.979 -0.688 . . . . 0.0 109.395 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.2 -28.66 60.08 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.5 mm -66.84 -30.49 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.67 -0.644 . . . . 0.0 109.341 179.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -74.56 -30.12 61.62 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.68 -0.638 . . . . 0.0 109.847 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -74.38 -29.3 61.49 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.639 -0.663 . . . . 0.0 109.979 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.49 -29.63 63.8 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.68 -0.638 . . . . 0.0 109.952 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -75.79 -28.96 58.58 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.657 -0.652 . . . . 0.0 110.138 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.91 -31.76 56.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.582 -0.699 . . . . 0.0 109.898 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 66.4 t -74.93 -29.29 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.668 -0.645 . . . . 0.0 109.774 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . 0.403 ' O ' ' OG1' ' B' ' 184' ' ' THR . 14.6 t70 -73.7 -28.26 61.63 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.59 -0.694 . . . . 0.0 110.089 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.09 -31.38 64.32 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.625 -0.672 . . . . 0.0 110.101 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -73.53 -37.65 65.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.609 -0.682 . . . . 0.0 110.004 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 85.1 mt -68.57 -28.1 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.704 -0.623 . . . . 0.0 109.702 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 184' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 2.7 m -67.46 -34.54 77.39 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.492 -0.755 . . . . 0.0 109.85 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -48.26 69.41 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.552 -0.718 . . . . 0.0 109.833 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.5 t -64.44 -28.93 45.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.61 -0.681 . . . . 0.0 109.816 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -70.81 -28.94 65.0 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.638 -0.664 . . . . 0.0 110.068 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -68.95 -31.31 70.09 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.548 -0.72 . . . . 0.0 110.047 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -40.53 65.48 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.703 -0.623 . . . . 0.0 109.893 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 77.2 mt -70.5 -28.51 35.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.687 -0.633 . . . . 0.0 109.819 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.0 m -73.85 -36.03 64.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.554 -0.716 . . . . 0.0 109.842 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -77.17 -31.08 55.22 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.615 -0.678 . . . . 0.0 109.611 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.78 -21.76 51.18 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.576 -0.702 . . . . 0.0 110.159 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.8 tptm -81.35 -27.54 34.87 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.325 -0.86 . . . . 0.0 109.673 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 27.4 tptt -75.67 -35.3 60.42 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.54 -0.725 . . . . 0.0 109.94 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 13.8 pttt -69.04 -25.42 64.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.511 -0.743 . . . . 0.0 109.892 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -71.8 -29.96 65.01 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.521 -0.737 . . . . 0.0 109.603 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -62.38 -41.91 99.01 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.705 -0.622 . . . . 0.0 109.751 179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.75 -38.79 91.94 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.733 -0.604 . . . . 0.0 109.639 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.6 tp -75.7 -32.33 60.04 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.61 -0.681 . . . . 0.0 109.508 179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.658 -0.651 . . . . 0.0 109.738 179.534 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.7 tp . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 121.182 0.515 . . . . 0.0 110.048 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -69.97 -48.65 57.43 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.479 -0.763 . . . . 0.0 109.982 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.92 -30.94 70.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.73 -0.606 . . . . 0.0 109.797 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 84.1 m -74.67 -30.71 61.68 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.69 -0.631 . . . . 0.0 109.742 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -71.41 -27.18 63.13 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.603 -0.686 . . . . 0.0 110.064 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -72.41 -35.1 68.3 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.598 -0.688 . . . . 0.0 110.22 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 -76.22 -35.07 59.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.69 -0.631 . . . . 0.0 109.792 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.4 ' CD1' ' NE2' ' B' ' 197' ' ' GLN . 62.2 mt -75.2 -27.14 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.683 -0.636 . . . . 0.0 109.494 179.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.83 -34.55 62.35 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.58 -0.7 . . . . 0.0 109.887 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -71.41 -33.51 69.51 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.564 -0.71 . . . . 0.0 109.613 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.6 mt -66.92 -33.0 74.64 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.655 -0.653 . . . . 0.0 109.853 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -67.67 -36.85 81.47 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.613 -0.679 . . . . 0.0 109.878 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -71.21 -32.0 68.3 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.63 -0.669 . . . . 0.0 109.412 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -67.86 -36.05 79.61 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.701 -0.624 . . . . 0.0 109.825 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 21.4 tp -68.49 -30.09 68.85 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.644 -0.66 . . . . 0.0 109.844 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.5 mt -75.07 -38.84 61.17 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.643 -0.661 . . . . 0.0 109.771 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.75 -28.99 66.25 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.688 -0.633 . . . . 0.0 109.902 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.9 tp -72.88 -37.25 67.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.587 -0.696 . . . . 0.0 110.022 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -70.04 -30.65 67.98 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.558 -0.713 . . . . 0.0 109.689 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -28.42 67.46 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.738 -0.601 . . . . 0.0 109.839 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -45.04 80.3 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.641 -0.662 . . . . 0.0 109.778 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.05 -30.86 71.85 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.605 -0.684 . . . . 0.0 109.665 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -65.32 -30.93 71.82 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.723 -0.61 . . . . 0.0 109.823 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -65.27 -32.33 73.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.594 -0.691 . . . . 0.0 109.839 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.28 -33.92 76.83 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.642 -0.661 . . . . 0.0 109.71 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -60.85 -34.8 75.14 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.642 -0.661 . . . . 0.0 109.862 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.7 mp -69.86 -29.38 66.6 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.732 -0.605 . . . . 0.0 109.775 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -95.09 -15.74 23.18 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.631 -0.668 . . . . 0.0 110.634 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 16.8 tp . . . . . 0 N--CA 1.501 2.094 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.746 -179.749 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.371 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.13 -52.17 37.32 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.581 -0.952 . . . . 0.0 111.746 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 25.2 p -153.07 15.23 0.54 Allowed 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.119 -0.988 . . . . 0.0 111.532 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 27.3 tptt 49.78 26.19 1.81 Allowed 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.077 -1.014 . . . . 0.0 110.893 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -150.5 -47.56 0.12 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.674 -0.641 . . . . 0.0 109.739 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -74.54 -31.56 62.16 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.053 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 2.9 tt -76.47 -28.18 56.41 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.0 mm -68.49 -30.2 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.642 -0.661 . . . . 0.0 109.624 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -70.89 -29.43 65.51 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.67 -0.644 . . . . 0.0 109.984 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -75.71 -29.66 59.04 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.674 -0.642 . . . . 0.0 110.065 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -75.53 -29.38 59.43 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.625 -0.672 . . . . 0.0 110.023 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.2 -31.29 58.38 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.617 -0.677 . . . . 0.0 110.05 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -28.51 58.67 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.67 -0.644 . . . . 0.0 110.001 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 60.1 t -76.12 -31.94 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.62 -0.675 . . . . 0.0 109.723 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -73.54 -29.92 62.75 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.591 -0.693 . . . . 0.0 109.917 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.2 -29.77 63.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.724 -0.61 . . . . 0.0 109.894 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -72.72 -38.82 67.33 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.653 -0.655 . . . . 0.0 109.953 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 88.1 mt -66.74 -28.02 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.694 -0.629 . . . . 0.0 109.702 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.0 m -67.26 -35.78 80.24 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.601 -0.687 . . . . 0.0 109.889 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.8 ttt -72.13 -37.52 69.42 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.648 -0.658 . . . . 0.0 109.856 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.0 -30.69 32.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.591 -0.693 . . . . 0.0 109.618 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -74.12 -28.62 61.44 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.726 -0.608 . . . . 0.0 110.077 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -29.33 61.77 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.603 -0.686 . . . . 0.0 110.044 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -37.63 61.15 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.7 -0.625 . . . . 0.0 109.94 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.415 HD11 HG22 ' B' ' 190' ' ' ILE . 81.4 mt -72.51 -30.52 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.602 -0.686 . . . . 0.0 109.635 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 17.8 m -71.65 -34.94 70.18 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.631 -0.668 . . . . 0.0 109.604 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.6 mmtp -75.34 -37.77 60.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.644 -0.66 . . . . 0.0 109.383 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.6 -30.26 65.6 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.743 -0.598 . . . . 0.0 109.455 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 17.1 tptt -70.29 -41.03 73.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.699 -0.626 . . . . 0.0 109.622 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.9 mmtm -67.14 -31.28 71.6 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.631 -0.668 . . . . 0.0 109.33 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -63.75 -36.15 82.94 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.681 -0.637 . . . . 0.0 109.293 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . 0.4 ' NE2' ' CD1' ' A' ' 69' ' ' ILE . 47.2 tt0 -63.07 -30.23 71.43 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.773 -0.58 . . . . 0.0 109.58 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -60.99 -41.95 97.47 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.691 -0.631 . . . . 0.0 109.911 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -61.75 -49.52 76.06 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.664 -0.647 . . . . 0.0 109.895 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 19.5 tp -68.27 -29.86 68.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.621 -0.675 . . . . 0.0 109.685 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 0.0 109.929 179.693 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 121.113 0.482 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -64.28 -31.54 72.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.641 -0.662 . . . . 0.0 110.001 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -70.44 -47.75 59.22 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.598 -0.689 . . . . 0.0 109.92 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.9 m -66.49 -31.36 72.05 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.739 -0.601 . . . . 0.0 109.538 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.92 -27.23 65.58 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.672 -0.642 . . . . 0.0 109.896 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -66.54 -36.02 81.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.498 -0.751 . . . . 0.0 109.988 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.0 tp60 -76.39 -34.56 58.85 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.567 -0.708 . . . . 0.0 109.563 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.9 mt -73.26 -27.51 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.691 -0.63 . . . . 0.0 109.491 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.1 tp -71.77 -38.78 70.29 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.556 -0.715 . . . . 0.0 109.953 179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.3 mmtt -65.64 -35.44 80.79 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.543 -0.723 . . . . 0.0 109.728 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.2 mt -69.54 -27.96 65.61 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.72 -0.612 . . . . 0.0 109.809 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -69.91 -38.91 76.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.579 -0.701 . . . . 0.0 109.975 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -67.38 -41.38 85.11 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.681 -0.637 . . . . 0.0 109.62 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.7 tptt -64.32 -35.23 80.18 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.77 -0.581 . . . . 0.0 109.713 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.5 tp -73.49 -31.41 63.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.679 -0.638 . . . . 0.0 109.529 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 tp -70.51 -34.83 72.76 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.693 -0.629 . . . . 0.0 109.702 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.04 -30.78 62.58 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.721 -0.612 . . . . 0.0 109.68 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.16 -37.76 57.53 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.649 -0.657 . . . . 0.0 109.643 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -71.96 -29.75 64.59 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.617 -0.677 . . . . 0.0 109.686 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.5 -29.68 66.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 109.72 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -68.48 -43.67 76.41 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.612 -0.68 . . . . 0.0 109.744 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -64.7 -29.93 70.93 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.555 -0.716 . . . . 0.0 109.647 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -64.33 -32.56 74.22 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.699 -0.625 . . . . 0.0 109.829 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -73.57 -35.33 65.43 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.672 -0.642 . . . . 0.0 109.715 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.401 ' CD2' ' CD2' ' B' ' 172' ' ' LEU . 3.2 mt -70.87 -33.32 70.5 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.69 -0.631 . . . . 0.0 109.685 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.27 -33.12 73.79 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.715 -0.616 . . . . 0.0 109.718 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 tp -79.16 -30.0 43.31 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.643 -0.661 . . . . 0.0 109.764 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -89.11 -8.7 53.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.626 -0.672 . . . . 0.0 110.848 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.4 tp . . . . . 0 N--CA 1.5 2.026 0 O-C-N 121.093 -1.004 . . . . 0.0 110.46 -179.869 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.307 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -117.75 -31.16 5.23 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.684 -0.892 . . . . 0.0 110.32 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 1.4 m -167.53 18.08 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.375 -0.828 . . . . 0.0 111.808 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 24.4 tptt 48.3 26.98 1.21 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.04 -1.038 . . . . 0.0 110.99 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.32 -47.24 0.11 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.774 -0.579 . . . . 0.0 109.695 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.79 -37.02 76.18 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.259 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . 0.401 ' CD2' ' CD2' ' A' ' 86' ' ' LEU . 3.2 mt -74.2 -28.14 61.13 Favored 'General case' 0 N--CA 1.493 1.679 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.1 mm -68.25 -31.84 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.687 -0.633 . . . . 0.0 109.404 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -74.43 -31.35 62.25 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.757 -0.589 . . . . 0.0 109.955 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -75.06 -34.21 61.79 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.62 -0.675 . . . . 0.0 109.885 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -27.23 63.15 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.611 -0.681 . . . . 0.0 109.75 179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.05 -31.71 69.47 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.553 -0.717 . . . . 0.0 110.104 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.58 -29.32 46.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.607 -0.683 . . . . 0.0 109.952 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 76.0 t -79.29 -25.8 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.639 -0.663 . . . . 0.0 109.53 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . 0.4 ' O ' ' OG1' ' B' ' 184' ' ' THR . 36.2 t70 -78.16 -38.7 43.0 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.463 -0.773 . . . . 0.0 110.073 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 10.3 ptt85 -73.09 -24.8 60.7 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 119.868 -0.733 . . . . 0.0 110.158 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -80.78 -37.02 31.02 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.511 -0.743 . . . . 0.0 109.87 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 76.0 mt -76.52 -27.32 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.611 -0.681 . . . . 0.0 109.556 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 184' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 72.2 m -76.62 -30.98 57.12 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.496 -0.752 . . . . 0.0 109.676 179.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.5 mtp -76.07 -39.32 55.68 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.619 -0.676 . . . . 0.0 109.666 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.3 t -72.98 -29.9 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.628 -0.67 . . . . 0.0 109.499 179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -72.75 -28.15 62.45 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.539 -0.726 . . . . 0.0 109.984 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.94 -34.48 69.07 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.635 -0.666 . . . . 0.0 109.985 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -40.67 64.04 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.622 -0.674 . . . . 0.0 109.684 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.406 HD12 HG22 ' B' ' 190' ' ' ILE . 84.2 mt -71.04 -30.54 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.654 -0.654 . . . . 0.0 109.477 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 50.9 m -69.26 -35.57 76.21 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.688 -0.633 . . . . 0.0 109.41 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.9 mmmt -76.53 -36.4 57.72 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.75 -30.01 65.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.683 -0.636 . . . . 0.0 109.531 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -69.24 -37.75 78.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.613 -0.679 . . . . 0.0 109.764 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.6 -31.23 71.13 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.562 -0.711 . . . . 0.0 109.467 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -64.13 -36.49 84.2 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.659 -0.65 . . . . 0.0 109.742 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -63.77 -30.59 71.67 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.667 -0.646 . . . . 0.0 109.867 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.39 -38.61 90.28 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.59 -0.693 . . . . 0.0 109.897 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -62.22 -41.47 98.42 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.715 -0.615 . . . . 0.0 109.9 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.5 tp -73.14 -32.37 64.85 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.587 -0.695 . . . . 0.0 109.687 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.685 -0.635 . . . . 0.0 109.812 179.533 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.771 0 CA-C-O 121.161 0.505 . . . . 0.0 109.982 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -64.18 -30.0 71.08 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.66 -0.65 . . . . 0.0 109.954 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -68.45 -51.41 43.91 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.615 -0.678 . . . . 0.0 109.866 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 79.7 m -63.45 -32.08 73.42 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.637 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.41 -29.09 68.5 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.647 -0.658 . . . . 0.0 109.76 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.7 -36.7 84.72 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.66 -0.65 . . . . 0.0 109.956 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 36.6 tp60 -73.46 -35.75 65.76 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.652 -0.655 . . . . 0.0 109.708 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.439 HD12 HG21 ' A' ' 69' ' ' ILE . 84.5 mt -71.0 -28.31 32.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.656 -0.653 . . . . 0.0 109.553 179.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 9.8 tt -68.71 -37.5 79.54 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.492 -0.755 . . . . 0.0 109.806 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -65.01 -37.96 89.35 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.66 -0.65 . . . . 0.0 109.701 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 12.3 mt -62.37 -29.55 70.55 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.689 -0.632 . . . . 0.0 109.939 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 tm-20 -63.3 -42.84 99.09 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.537 -0.727 . . . . 0.0 109.945 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.19 -34.48 74.97 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.671 -0.643 . . . . 0.0 109.559 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.01 -36.9 69.84 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.733 -0.605 . . . . 0.0 109.595 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.8 tp -75.11 -31.36 61.11 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.626 -0.671 . . . . 0.0 109.582 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tt -76.06 -32.2 59.16 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.738 -0.601 . . . . 0.0 109.604 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.26 -27.09 61.37 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.1 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.48 -27.07 41.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.46 -0.775 . . . . 0.0 109.813 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -76.34 -36.58 58.16 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.582 -0.699 . . . . 0.0 109.976 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.76 -24.62 64.46 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 119.889 -0.724 . . . . 0.0 109.822 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.05 -41.8 81.5 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.495 -0.753 . . . . 0.0 109.478 179.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.4 ttpm? -68.29 -31.05 70.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.593 -0.692 . . . . 0.0 109.435 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -65.5 -30.08 70.81 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.687 -0.633 . . . . 0.0 109.734 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -61.79 -34.72 76.41 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.63 -0.669 . . . . 0.0 109.726 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.66 -30.31 66.88 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.635 -0.665 . . . . 0.0 109.81 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -69.79 -30.51 68.07 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.602 -0.686 . . . . 0.0 110.019 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.4 tp -67.5 -31.61 71.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.576 -0.703 . . . . 0.0 109.888 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -117.38 29.84 7.64 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.648 -0.657 . . . . 0.0 109.987 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.498 1.945 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.305 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.369 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.35 -82.6 0.22 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.556 -0.967 . . . . 0.0 110.453 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 8.4 t -129.48 20.74 5.64 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.946 . . . . 0.0 110.848 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.8 tptm 50.76 25.94 2.33 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.238 -0.914 . . . . 0.0 110.729 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -150.99 -45.58 0.12 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.694 -0.628 . . . . 0.0 109.724 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -67.7 -31.12 70.86 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 120.003 -0.679 . . . . 0.0 109.621 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 2.8 tt -80.94 -30.57 35.22 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.622 -0.674 . . . . 0.0 109.341 179.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . 0.437 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.0 mp -72.53 -31.29 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -64.7 -32.62 74.38 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -74.16 -32.76 63.25 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -65.23 -29.46 70.26 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.785 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -72.12 -31.94 66.48 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.566 -0.709 . . . . 0.0 110.021 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.03 -30.17 58.36 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.617 -0.677 . . . . 0.0 109.838 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 66.2 t -74.54 -29.57 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.673 -0.642 . . . . 0.0 109.689 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -72.64 -28.67 62.88 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.591 -0.693 . . . . 0.0 110.049 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -71.92 -29.52 64.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.591 -0.693 . . . . 0.0 110.02 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -72.85 -38.87 66.93 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.542 -0.724 . . . . 0.0 110.044 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 80.8 mt -68.53 -29.03 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 C-N-CA 120.172 -0.611 . . . . 0.0 109.678 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 24.6 m -68.72 -32.88 72.98 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.689 -0.632 . . . . 0.0 109.849 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.92 -47.81 60.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.556 -0.715 . . . . 0.0 109.724 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 65.6 t -70.42 -31.95 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.62 -0.675 . . . . 0.0 109.402 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -74.81 -28.89 60.9 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.771 -0.581 . . . . 0.0 109.715 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -72.59 -29.94 63.95 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.612 -0.68 . . . . 0.0 109.956 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -72.26 -34.72 68.45 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.639 -0.663 . . . . 0.0 109.841 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.432 HG23 HD12 ' B' ' 190' ' ' ILE . 80.5 mt -70.63 -31.3 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.666 -0.646 . . . . 0.0 109.511 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 4.8 m -67.31 -40.17 86.0 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.629 -0.67 . . . . 0.0 109.524 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -72.3 -34.37 68.08 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.678 -0.639 . . . . 0.0 109.337 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.01 -10.97 59.85 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.682 -0.636 . . . . 0.0 110.558 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 18.4 tptt -91.72 -28.7 17.26 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.245 -0.91 . . . . 0.0 109.227 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.0 tptm -75.61 -32.68 60.38 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.702 -0.624 . . . . 0.0 109.733 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.23 -28.58 68.18 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.493 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -69.27 -29.45 67.35 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.653 -0.654 . . . . 0.0 109.47 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -61.22 -41.72 97.35 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.641 -0.662 . . . . 0.0 109.789 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -62.37 -37.83 87.22 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.727 -0.608 . . . . 0.0 109.641 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 7.2 tp -75.08 -30.67 61.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.683 -0.636 . . . . 0.0 109.527 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 . . . . . 0 N--CA 1.493 1.716 0 O-C-N 121.708 -0.62 . . . . 0.0 109.688 179.651 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 121.083 0.468 . . . . 0.0 110.163 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -70.4 -36.1 73.84 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.619 -0.676 . . . . 0.0 110.157 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -74.7 -34.58 62.64 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.63 -0.669 . . . . 0.0 109.773 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 88.2 m -74.55 -30.55 61.79 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.705 -0.622 . . . . 0.0 109.665 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.13 -27.19 62.46 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.669 -0.645 . . . . 0.0 110.012 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -72.1 -36.23 69.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.483 -0.76 . . . . 0.0 110.187 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -72.32 -39.81 67.93 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.641 -0.662 . . . . 0.0 109.717 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 46.3 mt -66.74 -27.64 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.45 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.49 -41.44 96.46 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.623 -0.673 . . . . 0.0 109.484 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -69.96 -29.62 66.78 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.587 -0.695 . . . . 0.0 109.633 179.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.6 mt -71.11 -28.38 64.27 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.726 -0.609 . . . . 0.0 109.917 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -75.84 -34.49 60.09 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.595 -0.691 . . . . 0.0 109.929 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -31.73 68.7 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 120.182 -0.607 . . . . 0.0 109.543 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -64.58 -33.42 75.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.733 -0.604 . . . . 0.0 109.743 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 20.2 tp -72.07 -28.77 63.54 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.637 -0.665 . . . . 0.0 109.953 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 mt -75.04 -34.89 61.93 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.667 -0.646 . . . . 0.0 109.924 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.48 -31.54 65.47 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.583 -0.698 . . . . 0.0 109.949 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.5 tp -75.06 -37.25 61.71 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.711 -0.618 . . . . 0.0 109.812 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -72.26 -30.42 64.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.601 -0.687 . . . . 0.0 109.563 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -69.18 -29.2 67.14 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.208 -0.597 . . . . 0.0 109.795 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.44 -45.13 76.94 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.549 -0.719 . . . . 0.0 109.826 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.4 tttm -62.92 -29.49 70.82 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.495 -0.753 . . . . 0.0 109.563 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -62.57 -32.87 73.92 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.675 -0.641 . . . . 0.0 109.784 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -65.88 -30.8 71.46 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.682 -0.636 . . . . 0.0 109.722 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.62 -33.09 74.29 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.607 -0.683 . . . . 0.0 109.65 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -61.81 -35.69 78.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.541 -0.724 . . . . 0.0 109.89 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.7 mp -74.0 -30.29 62.4 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.735 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -85.04 -21.89 29.23 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.741 -0.599 . . . . 0.0 110.414 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.2 tp . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.574 -179.879 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.33 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.406 ' CD1' ' CB ' ' B' ' 171' ' ' GLU . 0.0 OUTLIER -141.32 -83.5 0.21 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.572 -0.958 . . . . 0.0 110.654 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.2 m -128.79 19.62 6.08 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.148 -0.97 . . . . 0.0 110.994 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.3 tptt 50.71 25.81 2.25 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.228 -0.92 . . . . 0.0 110.539 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -147.95 -46.38 0.16 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.714 -0.616 . . . . 0.0 109.394 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . 0.406 ' CB ' ' CD1' ' B' ' 167' ' ' LEU . 4.0 mm-40 -68.69 -32.93 73.1 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 119.9 -0.72 . . . . 0.0 109.276 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 13.8 tp -77.5 -29.17 52.41 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 49.3 mm -65.92 -31.6 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.669 -0.644 . . . . 0.0 109.322 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -71.28 -29.65 65.31 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.753 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -72.07 -42.35 66.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.636 -0.665 . . . . 0.0 109.772 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.82 -33.99 77.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.684 -0.635 . . . . 0.0 109.651 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.34 -30.22 57.55 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.643 -0.661 . . . . 0.0 109.807 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -77.19 -30.0 54.59 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.668 -0.645 . . . . 0.0 109.865 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 72.2 t -75.83 -30.03 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.587 -0.696 . . . . 0.0 109.592 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -74.08 -29.7 61.99 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.681 -0.637 . . . . 0.0 109.966 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -73.55 -29.43 62.44 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.65 -0.656 . . . . 0.0 109.957 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -73.28 -38.06 66.05 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.568 -0.708 . . . . 0.0 109.949 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . 0.44 HG22 HD11 ' B' ' 183' ' ' ILE . 90.2 mt -67.39 -30.0 47.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.633 -0.667 . . . . 0.0 109.634 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.3 m -66.07 -35.69 81.19 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.597 -0.689 . . . . 0.0 109.743 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -50.34 58.24 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.648 -0.658 . . . . 0.0 109.643 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.6 t -63.85 -31.9 54.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.601 -0.687 . . . . 0.0 109.314 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -65.52 -34.85 79.24 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.7 -0.625 . . . . 0.0 109.947 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -63.89 -29.98 71.11 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.642 -0.661 . . . . 0.0 109.824 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.15 -27.68 61.8 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.669 -0.644 . . . . 0.0 109.969 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.409 HD13 HG21 ' B' ' 190' ' ' ILE . 45.0 mm -75.72 -41.99 40.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.606 -0.684 . . . . 0.0 109.525 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 51.8 m -68.66 -29.19 67.61 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.704 -0.622 . . . . 0.0 109.699 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 54.0 mmtt -74.27 -42.81 59.0 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.615 -0.678 . . . . 0.0 109.807 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.15 -31.09 65.65 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.471 -0.768 . . . . 0.0 109.283 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -70.26 -37.76 74.98 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.662 -0.649 . . . . 0.0 109.392 179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.3 mmtt -70.08 -31.52 69.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.592 -0.692 . . . . 0.0 109.319 179.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -65.01 -34.24 77.97 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -64.41 -30.25 71.3 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.661 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.83 -43.16 99.41 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.703 -0.623 . . . . 0.0 109.804 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -62.59 -40.15 95.98 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.75 -0.594 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.4 tp -73.23 -32.39 64.72 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.69 -0.631 . . . . 0.0 109.687 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.555 -0.716 . . . . 0.0 109.836 179.601 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 CA-C-O 121.025 0.441 . . . . 0.0 110.065 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -72.7 -34.67 67.3 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.586 -0.696 . . . . 0.0 110.232 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -75.04 -33.37 61.73 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.671 -0.643 . . . . 0.0 109.9 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.8 m -75.31 -30.37 60.33 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.633 -0.667 . . . . 0.0 109.631 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -73.04 -26.58 61.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.686 -0.634 . . . . 0.0 110.057 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -72.8 -32.48 65.58 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.528 -0.732 . . . . 0.0 110.179 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -76.05 -36.38 59.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.659 -0.65 . . . . 0.0 109.691 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.9 mt -70.67 -27.66 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.682 -0.636 . . . . 0.0 109.63 179.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.1 tt -68.43 -36.81 79.59 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.513 -0.742 . . . . 0.0 109.821 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -69.77 -30.09 67.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.64 -0.663 . . . . 0.0 109.843 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.2 mt -70.0 -28.57 65.62 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.702 -0.624 . . . . 0.0 110.028 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -72.35 -32.1 66.19 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.596 -0.69 . . . . 0.0 110.03 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.43 -30.9 60.17 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.604 -0.685 . . . . 0.0 109.78 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.78 -32.5 62.06 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.71 -0.619 . . . . 0.0 109.785 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.94 -31.01 61.4 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.576 -0.702 . . . . 0.0 109.654 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.1 mp -74.64 -35.29 62.88 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.625 -0.672 . . . . 0.0 109.812 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.37 -30.61 64.86 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.651 -0.655 . . . . 0.0 109.77 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.9 tp -73.66 -37.9 65.12 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.642 -0.661 . . . . 0.0 109.817 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 15.6 tp60 -70.46 -30.95 67.91 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.63 -0.668 . . . . 0.0 109.625 179.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.11 -30.13 69.22 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.62 -0.675 . . . . 0.0 109.742 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -66.01 -46.53 77.61 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.664 -0.647 . . . . 0.0 109.698 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.3 tttt -64.0 -28.98 70.17 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.502 -0.749 . . . . 0.0 109.443 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -63.83 -31.38 72.54 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.671 -0.643 . . . . 0.0 109.932 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -65.28 -31.25 72.3 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.508 -0.745 . . . . 0.0 109.704 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.24 -32.84 73.32 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.674 -0.641 . . . . 0.0 109.588 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -61.65 -35.18 77.21 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.638 -0.664 . . . . 0.0 109.898 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.3 tp -63.45 -29.63 70.88 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.587 -0.695 . . . . 0.0 109.768 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -94.97 -23.46 17.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.666 -0.646 . . . . 0.0 110.379 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.6 tp . . . . . 0 N--CA 1.502 2.147 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.74 -179.942 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.46 -61.98 1.56 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.677 -0.896 . . . . 0.0 109.2 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 52.1 m -153.53 37.09 0.46 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.322 0.582 . . . . 0.0 109.498 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 28.0 tptt 52.44 26.62 4.31 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.606 -0.684 . . . . 0.0 110.346 -179.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -153.72 -43.7 0.09 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.619 -0.675 . . . . 0.0 110.397 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.77 -29.59 70.23 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.53 -28.98 24.56 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . 0.422 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.7 mp -76.83 -30.97 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -66.0 -34.6 78.48 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -78.0 -32.57 51.25 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 178.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -29.98 67.94 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 120.184 -0.606 . . . . 0.0 109.526 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -74.12 -27.48 60.89 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.598 -0.689 . . . . 0.0 110.006 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.2 -41.07 58.6 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.549 -0.719 . . . . 0.0 109.967 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 10.5 p -70.33 -26.96 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.606 -0.684 . . . . 0.0 109.999 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -76.04 -29.08 57.93 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.519 -0.738 . . . . 0.0 109.961 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 5.6 mtp-105 -73.42 -29.35 62.52 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.653 -0.654 . . . . 0.0 110.05 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -72.56 -36.97 68.35 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.573 -0.704 . . . . 0.0 109.9 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 88.3 mt -66.38 -28.63 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.652 -0.655 . . . . 0.0 109.664 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.4 m -65.43 -30.95 71.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.598 -0.689 . . . . 0.0 109.677 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -42.97 61.22 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.783 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.5 t -71.78 -31.23 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.645 -0.659 . . . . 0.0 109.46 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.9 -29.06 60.88 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.648 -0.658 . . . . 0.0 109.836 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -72.87 -29.64 63.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.707 -0.62 . . . . 0.0 109.999 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -73.26 -36.45 66.36 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.597 -0.689 . . . . 0.0 109.842 179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.454 HG22 HD11 ' B' ' 190' ' ' ILE . 78.0 mt -71.49 -31.35 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.674 -0.641 . . . . 0.0 109.584 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 44.8 m -69.95 -37.62 75.88 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.682 -0.636 . . . . 0.0 109.65 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -71.59 -37.42 71.0 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.614 -0.679 . . . . 0.0 109.495 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.38 -11.85 60.13 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.731 -0.606 . . . . 0.0 110.601 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.55 -28.56 19.52 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.17 -0.956 . . . . 0.0 109.41 179.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -32.19 55.68 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.665 -0.647 . . . . 0.0 109.89 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.96 -28.25 63.32 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.49 -0.756 . . . . 0.0 109.652 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -68.13 -30.54 69.71 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.642 -0.661 . . . . 0.0 109.657 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -62.65 -44.17 96.95 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.757 -0.589 . . . . 0.0 109.951 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -61.36 -40.63 95.0 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.045 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 29.1 tp -70.38 -40.98 73.65 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.607 -0.683 . . . . 0.0 109.746 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.494 1.768 0 O-C-N 121.653 -0.654 . . . . 0.0 109.637 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 tt . . . . . 0 N--CA 1.495 1.814 0 CA-C-O 121.078 0.466 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -70.4 -36.03 73.82 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.608 -0.683 . . . . 0.0 109.981 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.53 -30.67 61.86 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.618 -0.676 . . . . 0.0 109.788 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 83.4 m -73.71 -30.62 62.95 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.655 -0.653 . . . . 0.0 109.587 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -69.81 -28.88 66.09 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.604 -0.685 . . . . 0.0 110.06 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -70.89 -33.22 70.36 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.57 -0.706 . . . . 0.0 110.155 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -72.43 -34.87 68.13 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.674 -0.641 . . . . 0.0 109.941 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.3 mt -68.43 -27.58 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.664 -0.647 . . . . 0.0 109.787 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.8 tt -69.88 -44.31 70.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.553 -0.717 . . . . 0.0 109.783 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -65.11 -30.9 71.88 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.598 -0.689 . . . . 0.0 109.668 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.6 mt -66.54 -29.42 69.49 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.634 -0.666 . . . . 0.0 109.978 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -68.46 -45.8 71.49 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.604 -0.685 . . . . 0.0 110.029 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -63.93 -31.08 72.14 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.662 -0.649 . . . . 0.0 109.593 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.1 tttm -64.37 -35.19 80.07 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.635 -0.665 . . . . 0.0 109.913 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.9 tp -66.18 -33.75 76.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.626 -0.671 . . . . 0.0 109.824 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 mt -73.09 -37.9 66.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.728 -0.607 . . . . 0.0 109.552 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.33 -28.44 68.67 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.701 -0.624 . . . . 0.0 109.884 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.07 -43.57 74.31 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.651 -0.655 . . . . 0.0 109.883 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -66.17 -32.81 74.46 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.62 -0.675 . . . . 0.0 109.713 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.9 -28.55 69.03 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.747 -0.596 . . . . 0.0 109.755 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.5 -44.39 94.47 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.664 -0.647 . . . . 0.0 109.735 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -65.81 -29.91 70.46 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.602 -0.686 . . . . 0.0 109.752 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -67.95 -34.17 76.06 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.578 -0.701 . . . . 0.0 109.903 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -68.9 -46.59 67.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.648 -0.658 . . . . 0.0 109.705 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.11 -29.58 70.43 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.658 -0.651 . . . . 0.0 109.832 179.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.16 -34.15 77.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.62 -0.675 . . . . 0.0 109.822 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.73 -30.4 71.5 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.6 -0.688 . . . . 0.0 109.858 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -85.26 -17.66 36.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.676 -0.64 . . . . 0.0 110.673 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.402 ' CD1' ' CD1' ' B' ' 173' ' ' ILE . 49.4 tp . . . . . 0 N--CA 1.5 2.058 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.743 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.15 -61.71 1.55 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.541 -0.976 . . . . 0.0 109.165 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 88.5 p -154.5 37.3 0.42 Allowed 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 36.7 tptt 52.15 26.31 3.81 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.548 -0.72 . . . . 0.0 110.363 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -152.86 -43.9 0.1 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.616 -0.678 . . . . 0.0 110.291 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.85 -29.24 70.05 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 119.753 -0.779 . . . . 0.0 109.666 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.21 -29.09 24.97 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.603 -0.685 . . . . 0.0 109.168 178.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . 0.42 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.9 mp -78.38 -31.7 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.307 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -67.58 -33.88 75.91 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -78.89 -32.32 45.77 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -30.02 65.1 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.734 -0.604 . . . . 0.0 109.638 179.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.27 -33.49 61.27 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.57 -0.707 . . . . 0.0 109.827 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -71.67 -29.03 64.16 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.651 -0.656 . . . . 0.0 109.895 179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 64.6 t -69.51 -32.7 53.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.616 -0.677 . . . . 0.0 109.612 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -63.73 -37.26 86.71 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.666 -0.646 . . . . 0.0 109.81 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 5.7 mtp-105 -69.94 -29.4 66.54 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.748 -0.595 . . . . 0.0 109.722 179.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.85 -32.35 70.7 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.676 -0.64 . . . . 0.0 109.869 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 86.6 mt -72.4 -33.17 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.676 -0.64 . . . . 0.0 109.616 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 58.9 m -71.96 -33.23 68.02 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.692 -0.63 . . . . 0.0 109.649 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.74 -41.46 71.78 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.644 -0.66 . . . . 0.0 109.602 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 63.2 t -68.28 -37.76 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 119.995 -0.682 . . . . 0.0 109.246 179.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.4 -33.57 75.83 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.805 -0.559 . . . . 0.0 109.893 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -29.91 70.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.648 -0.658 . . . . 0.0 109.858 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -72.91 -21.55 60.88 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.594 -0.691 . . . . 0.0 110.371 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 35.3 mm -79.55 -39.04 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.413 -0.804 . . . . 0.0 109.603 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.27 -30.2 64.61 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.623 -0.673 . . . . 0.0 109.734 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 13.8 mmtm -75.28 -36.15 61.23 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.692 -0.63 . . . . 0.0 109.85 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.08 -21.47 59.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.579 -0.7 . . . . 0.0 110.242 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.6 tptt -80.45 -28.59 37.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 109.575 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 14.9 tptt -74.26 -40.05 62.6 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.638 -0.664 . . . . 0.0 109.76 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 2.6 pttp -64.64 -26.11 68.25 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.532 -0.73 . . . . 0.0 109.639 179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -69.81 -30.64 68.21 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.513 -0.742 . . . . 0.0 109.569 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -43.59 98.48 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.684 -0.635 . . . . 0.0 109.764 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -61.71 -31.18 71.32 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.777 -0.577 . . . . 0.0 109.66 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -77.41 -38.16 50.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.69 -0.631 . . . . 0.0 109.534 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 . . . . . 0 N--CA 1.493 1.687 0 O-C-N 121.687 -0.633 . . . . 0.0 109.598 179.434 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.1 tt . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 121.059 0.456 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -63.95 -42.77 97.2 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.686 -0.634 . . . . 0.0 109.986 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -72.02 -30.77 65.54 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.72 -0.612 . . . . 0.0 109.636 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 66.7 m -73.59 -28.43 61.83 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.793 -0.567 . . . . 0.0 109.793 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.4 mmtp -72.06 -26.47 62.19 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.489 -0.757 . . . . 0.0 110.382 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -74.94 -31.85 61.6 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.542 -0.724 . . . . 0.0 110.433 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -76.23 -34.4 59.22 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.63 -0.669 . . . . 0.0 109.785 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.401 ' CD1' ' NE2' ' B' ' 197' ' ' GLN . 69.3 mt -71.5 -26.13 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.653 -0.655 . . . . 0.0 109.679 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.6 tt -71.12 -40.77 71.25 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.477 -0.765 . . . . 0.0 109.929 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.5 tppt? -62.62 -31.07 71.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.557 -0.715 . . . . 0.0 109.69 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 11.3 mt -62.67 -29.6 70.77 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.714 -0.616 . . . . 0.0 109.915 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -66.58 -39.28 88.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.625 -0.672 . . . . 0.0 109.847 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.03 -30.23 63.59 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.654 -0.654 . . . . 0.0 109.53 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -29.72 63.98 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.678 -0.639 . . . . 0.0 109.908 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 25.9 tp -74.1 -33.67 63.68 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.63 -0.669 . . . . 0.0 109.899 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.8 mt -74.32 -33.1 63.08 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.666 -0.646 . . . . 0.0 109.632 179.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.88 -29.21 66.36 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.725 -0.609 . . . . 0.0 109.706 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.64 -42.75 77.56 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.655 -0.653 . . . . 0.0 109.79 179.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -65.73 -29.05 69.52 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.468 -0.77 . . . . 0.0 109.876 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.0 tm-20 -68.41 -28.24 66.91 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.646 -0.659 . . . . 0.0 110.044 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -70.23 -45.76 65.86 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.557 -0.714 . . . . 0.0 109.87 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.1 tttm -63.7 -29.56 70.77 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.509 -0.744 . . . . 0.0 109.945 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -67.38 -29.3 68.78 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.59 -0.694 . . . . 0.0 109.943 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -36.15 83.18 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.533 -0.729 . . . . 0.0 109.945 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 mt -64.29 -34.36 77.96 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.638 -0.664 . . . . 0.0 109.992 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -65.59 -26.49 67.87 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.619 -0.676 . . . . 0.0 110.332 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.8 -28.24 64.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.575 -0.703 . . . . 0.0 110.267 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -117.29 26.19 9.93 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.557 -0.714 . . . . 0.0 110.467 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.8 tp . . . . . 0 N--CA 1.498 1.943 0 CA-C-O 117.957 -1.02 . . . . 0.0 110.171 -179.982 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.378 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 2.5 pp -139.85 -46.35 0.44 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.67 -0.9 . . . . 0.0 110.637 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 33.9 p -153.46 14.56 0.5 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.31 -0.868 . . . . 0.0 111.499 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 9.5 tptm 49.53 26.37 1.7 Allowed 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.012 -1.055 . . . . 0.0 111.051 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -152.92 -46.83 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.665 -0.647 . . . . 0.0 110.047 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.58 -36.73 65.59 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 179.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.09 -28.05 61.19 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.3 mm -67.54 -31.04 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.694 -0.629 . . . . 0.0 109.385 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -72.38 -29.09 63.44 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.681 -0.637 . . . . 0.0 109.916 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -72.55 -32.17 65.85 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.621 -0.674 . . . . 0.0 110.026 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.3 mtt -70.37 -30.19 67.05 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.695 -0.628 . . . . 0.0 109.888 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -69.39 -30.87 68.94 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.644 -0.66 . . . . 0.0 109.863 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.13 -45.48 66.76 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.701 -0.625 . . . . 0.0 109.695 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 58.5 t -61.96 -30.45 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.827 -0.545 . . . . 0.0 109.773 179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -67.85 -31.73 71.75 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.658 -0.651 . . . . 0.0 109.863 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.19 -30.39 63.5 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.698 -0.626 . . . . 0.0 109.715 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -70.89 -34.69 71.82 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.664 -0.647 . . . . 0.0 109.815 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.5 mt -73.66 -30.6 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.721 -0.612 . . . . 0.0 109.654 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 53.1 m -73.31 -34.76 65.88 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.674 -0.641 . . . . 0.0 109.626 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 tpp -72.13 -39.18 69.02 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.605 -0.685 . . . . 0.0 109.677 179.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 64.8 t -70.89 -32.07 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.641 -0.662 . . . . 0.0 109.423 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -70.77 -30.01 66.39 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.684 -0.635 . . . . 0.0 109.894 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -30.2 62.72 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.694 -0.629 . . . . 0.0 109.871 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -37.11 68.56 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.688 -0.632 . . . . 0.0 109.8 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 77.3 mt -72.95 -31.29 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.666 -0.646 . . . . 0.0 109.607 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.57 -34.7 65.26 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.656 -0.653 . . . . 0.0 109.662 179.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -73.1 -38.56 66.31 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.655 -0.653 . . . . 0.0 109.536 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -32.23 73.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.668 -0.645 . . . . 0.0 109.351 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -66.76 -47.23 72.86 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.66 -0.65 . . . . 0.0 109.387 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -64.21 -31.09 72.16 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 120.051 -0.66 . . . . 0.0 109.244 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 19.0 ttpt -62.79 -37.22 85.82 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.691 -0.631 . . . . 0.0 109.418 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . 0.401 ' NE2' ' CD1' ' A' ' 69' ' ' ILE . 5.5 tt0 -63.12 -30.16 71.37 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.722 -0.611 . . . . 0.0 109.66 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -61.04 -40.96 95.61 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.605 -0.685 . . . . 0.0 109.882 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -36.43 83.97 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.753 -0.592 . . . . 0.0 109.644 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 14.0 tp -75.68 -31.02 59.55 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.658 -0.651 . . . . 0.0 109.632 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 . . . . . 0 N--CA 1.493 1.717 0 O-C-N 121.638 -0.664 . . . . 0.0 109.723 179.581 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.5 tp . . . . . 0 N--CA 1.496 1.863 0 CA-C-O 121.043 0.449 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.71 -29.83 69.19 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.583 -0.698 . . . . 0.0 110.119 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -70.5 -46.13 64.3 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.623 -0.673 . . . . 0.0 109.886 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 21.0 m -62.93 -31.12 72.13 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.731 -0.606 . . . . 0.0 109.724 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -65.02 -28.27 69.38 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.628 -0.67 . . . . 0.0 109.93 179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -62.57 -39.75 94.68 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.609 -0.682 . . . . 0.0 110.104 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.4 tp60 -75.41 -30.69 60.15 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.6 -0.687 . . . . 0.0 109.632 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.7 mt -77.37 -27.04 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.785 -0.572 . . . . 0.0 109.712 179.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.1 mt -75.37 -32.69 60.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.458 -0.776 . . . . 0.0 109.826 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -31.62 70.41 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.567 -0.708 . . . . 0.0 109.822 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.3 mt -69.73 -28.96 66.25 Favored 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.898 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.28 -33.11 73.75 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.6 -0.688 . . . . 0.0 110.003 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -76.48 -33.23 58.68 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.557 -0.715 . . . . 0.0 109.71 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.8 tttt -75.35 -29.93 60.07 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.705 -0.622 . . . . 0.0 109.807 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.7 tp -77.22 -31.03 54.94 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.671 -0.643 . . . . 0.0 109.798 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mp -76.34 -33.57 58.97 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.642 -0.661 . . . . 0.0 109.634 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.92 -29.3 63.02 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.696 -0.627 . . . . 0.0 109.994 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.8 tp -75.14 -38.39 61.01 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.592 -0.693 . . . . 0.0 109.922 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -71.23 -29.69 65.43 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.734 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -69.99 -28.98 65.96 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.688 -0.632 . . . . 0.0 109.861 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -67.61 -43.04 81.42 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.522 -0.736 . . . . 0.0 109.863 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -62.3 -28.46 69.75 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.559 -0.713 . . . . 0.0 109.779 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -62.95 -31.86 73.05 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.619 -0.676 . . . . 0.0 109.875 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -40.04 94.61 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.675 -0.64 . . . . 0.0 109.9 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.81 -35.5 76.65 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.629 -0.67 . . . . 0.0 110.127 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -61.3 -36.89 81.33 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.517 -0.739 . . . . 0.0 109.968 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mp -77.05 -29.17 55.06 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.703 -0.623 . . . . 0.0 109.684 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -95.18 -0.22 53.45 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.65 -0.656 . . . . 0.0 110.965 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.5 tp . . . . . 0 N--CA 1.498 1.964 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.245 -179.865 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 1.3 pp -139.03 -48.73 0.5 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.624 -0.927 . . . . 0.0 110.753 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 4.0 m -155.22 13.55 0.37 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.261 -0.9 . . . . 0.0 111.752 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 15.1 tptt 49.34 26.28 1.54 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.999 -1.063 . . . . 0.0 111.066 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -151.86 -47.26 0.11 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.684 -0.635 . . . . 0.0 109.829 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.38 -33.5 63.08 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.6 tt -75.56 -26.66 58.15 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 178.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.7 mm -69.4 -30.65 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.561 -0.712 . . . . 0.0 109.523 179.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -73.11 -28.57 62.34 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.714 -0.616 . . . . 0.0 110.15 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -74.86 -29.22 60.96 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.6 -0.687 . . . . 0.0 110.079 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -73.4 -29.96 62.95 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.581 -0.699 . . . . 0.0 109.921 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -77.25 -29.98 54.25 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.609 -0.682 . . . . 0.0 109.94 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.49 -31.13 47.63 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.646 -0.659 . . . . 0.0 109.787 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 67.0 t -77.96 -31.06 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.633 -0.667 . . . . 0.0 109.521 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -76.31 -29.0 57.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.654 -0.654 . . . . 0.0 109.811 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.38 -29.09 61.4 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.654 -0.654 . . . . 0.0 109.715 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -71.55 -31.4 66.97 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.579 -0.701 . . . . 0.0 110.039 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 83.9 mt -72.62 -29.64 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.628 -0.67 . . . . 0.0 109.706 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.4 -33.13 72.56 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.619 -0.675 . . . . 0.0 109.853 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 49.0 mtp -71.49 -45.76 61.61 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.589 -0.694 . . . . 0.0 109.768 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.1 t -71.57 -31.5 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.648 -0.658 . . . . 0.0 109.383 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -74.51 -28.8 61.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.73 -0.606 . . . . 0.0 109.782 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -72.62 -29.72 63.72 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.558 -0.714 . . . . 0.0 110.044 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -36.43 65.71 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.683 -0.635 . . . . 0.0 109.935 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 75.6 mt -71.29 -31.05 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.639 -0.663 . . . . 0.0 109.573 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 3.2 m -67.77 -37.59 82.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.704 -0.623 . . . . 0.0 109.541 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -74.94 -32.46 61.76 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.622 -0.674 . . . . 0.0 109.4 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.39 -31.56 67.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.631 -0.668 . . . . 0.0 109.295 179.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 11.9 tptm -68.81 -46.3 69.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.629 -0.669 . . . . 0.0 109.407 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.67 -29.67 70.67 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 119.967 -0.693 . . . . 0.0 109.151 179.12 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -62.52 -36.55 82.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.604 -0.685 . . . . 0.0 109.208 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.15 -31.16 72.24 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -58.93 -42.78 90.54 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.684 -0.635 . . . . 0.0 109.986 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.64 -39.46 93.92 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.737 -0.602 . . . . 0.0 109.596 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 15.1 tp -74.41 -28.54 61.13 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.676 -0.64 . . . . 0.0 109.666 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.544 -0.723 . . . . 0.0 109.906 179.693 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 121.069 0.461 . . . . 0.0 109.999 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -73.86 -33.1 63.95 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.63 -0.669 . . . . 0.0 109.932 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -74.45 -38.82 62.87 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.66 -0.65 . . . . 0.0 109.752 179.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 58.5 m -71.85 -32.62 67.7 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.723 -0.611 . . . . 0.0 109.434 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -68.14 -29.45 68.36 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.581 179.406 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -63.0 -36.86 84.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.611 -0.681 . . . . 0.0 109.827 179.668 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -75.48 -34.69 60.91 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.466 179.501 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.1 mt -72.12 -28.57 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.734 -0.604 . . . . 0.0 109.397 179.274 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.8 tp -69.21 -40.45 78.0 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.589 -0.694 . . . . 0.0 109.748 179.583 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.23 -31.89 73.15 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.533 -0.729 . . . . 0.0 109.696 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.4 mt -69.69 -30.37 68.01 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.685 -0.634 . . . . 0.0 109.773 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -69.49 -34.24 74.05 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.598 -0.689 . . . . 0.0 109.758 179.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -75.25 -31.7 60.88 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.695 -0.628 . . . . 0.0 109.508 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.15 -30.53 66.57 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.523 179.546 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -74.05 -31.3 62.82 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.61 -0.681 . . . . 0.0 109.714 179.605 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 tp -73.26 -37.85 66.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.673 -0.642 . . . . 0.0 109.693 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.36 -30.9 70.83 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.602 179.483 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.76 -46.31 63.19 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.676 -0.64 . . . . 0.0 109.639 179.529 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -66.18 -29.3 69.56 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.661 -0.649 . . . . 0.0 109.644 179.453 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -68.95 -30.27 68.68 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.661 -0.649 . . . . 0.0 109.788 179.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -69.93 -47.05 63.93 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.668 -0.645 . . . . 0.0 109.808 179.692 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.4 tttt -62.28 -29.87 70.73 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.522 -0.736 . . . . 0.0 109.603 179.441 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -62.98 -31.83 73.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.662 -0.649 . . . . 0.0 109.743 179.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -67.2 -32.09 72.92 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.661 -0.649 . . . . 0.0 109.744 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.57 -31.62 71.82 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.6 -0.687 . . . . 0.0 109.755 179.687 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -62.36 -35.45 79.18 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.615 -0.678 . . . . 0.0 109.88 179.659 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.44 -30.5 64.65 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.671 -0.643 . . . . 0.0 109.696 179.569 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -88.72 -18.51 27.69 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.647 -0.658 . . . . 0.0 110.519 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 32.8 tp . . . . . 0 N--CA 1.501 2.097 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.646 -179.914 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.401 ' CD1' ' N ' ' B' ' 172' ' ' LEU . 0.4 OUTLIER -109.96 -62.51 1.5 Allowed 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.63 -0.923 . . . . 0.0 109.088 179.975 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 6.2 t -154.41 35.99 0.42 Allowed 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.315 0.579 . . . . 0.0 109.528 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 5.9 tptm 51.87 26.07 3.39 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.524 -0.735 . . . . 0.0 110.118 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -147.61 -45.39 0.17 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.707 -0.621 . . . . 0.0 109.962 -179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.68 -30.27 71.28 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 119.618 -0.833 . . . . 0.0 109.2 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . 0.401 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 0.3 OUTLIER -81.65 -27.53 34.06 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.63 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.93 -30.82 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.753 -0.592 . . . . 0.0 109.498 179.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.95 -30.31 66.56 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.636 -0.665 . . . . 0.0 109.946 179.77 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -76.83 -29.25 55.84 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.623 -0.673 . . . . 0.0 109.871 179.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -75.63 -28.31 58.76 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.653 -0.654 . . . . 0.0 110.056 179.761 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.75 -32.22 57.61 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.583 -0.698 . . . . 0.0 110.057 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -75.22 -29.99 60.46 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.611 -0.681 . . . . 0.0 109.889 179.711 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 68.9 t -73.75 -29.43 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.646 -0.659 . . . . 0.0 109.717 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . 0.408 ' O ' ' OG1' ' B' ' 184' ' ' THR . 1.2 m-20 -70.42 -29.21 65.76 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.558 -0.714 . . . . 0.0 110.029 179.755 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 -74.36 -28.9 61.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.602 -0.686 . . . . 0.0 110.118 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -75.73 -34.34 60.32 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.533 -0.73 . . . . 0.0 110.155 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 83.4 mt -74.0 -29.07 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.628 -0.67 . . . . 0.0 109.768 179.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 184' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 3.6 m -73.92 -33.92 64.15 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.613 -0.68 . . . . 0.0 109.714 179.549 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.28 -39.2 78.52 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.664 -0.648 . . . . 0.0 109.77 179.662 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.66 -29.89 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.673 -0.642 . . . . 0.0 109.598 179.612 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -71.17 -28.63 64.38 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.603 -0.685 . . . . 0.0 110.07 179.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -69.72 -33.96 73.22 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.562 -0.711 . . . . 0.0 109.995 179.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -37.93 62.17 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.64 -0.663 . . . . 0.0 109.702 179.74 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 78.7 mt -73.29 -28.91 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.659 -0.651 . . . . 0.0 109.683 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 23.5 p -73.39 -34.76 65.7 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.571 -0.706 . . . . 0.0 109.759 179.504 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -77.36 -33.02 55.38 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.611 -0.681 . . . . 0.0 109.473 179.399 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.4 -30.42 61.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.712 -0.617 . . . . 0.0 109.387 179.353 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.0 tptm -68.42 -36.57 79.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.595 -0.691 . . . . 0.0 109.528 179.483 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 8.5 tptp -68.49 -30.25 69.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.663 -0.648 . . . . 0.0 109.547 179.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -35.63 81.24 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.612 -0.68 . . . . 0.0 109.484 179.525 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -63.4 -30.74 71.82 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.747 -0.596 . . . . 0.0 109.8 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.97 -41.73 98.34 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.71 -0.619 . . . . 0.0 109.91 179.71 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -61.99 -45.76 92.2 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.741 -0.599 . . . . 0.0 109.969 179.756 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 4.4 tp -70.32 -32.84 70.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.621 -0.674 . . . . 0.0 109.716 179.586 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 . . . . . 0 N--CA 1.494 1.726 0 O-C-N 121.678 -0.639 . . . . 0.0 109.895 179.619 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.07 0.462 . . . . 0.0 110.113 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -72.94 -33.15 65.75 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.578 -0.701 . . . . 0.0 110.1 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -75.84 -30.03 58.8 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.653 -0.654 . . . . 0.0 109.908 179.762 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 88.2 m -75.84 -29.59 58.67 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.654 -0.654 . . . . 0.0 109.875 179.621 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -73.83 -26.7 60.73 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.575 -0.703 . . . . 0.0 110.162 179.68 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.86 -33.28 62.08 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.597 -0.689 . . . . 0.0 110.133 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -76.38 -37.29 57.41 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.661 -0.649 . . . . 0.0 109.698 179.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.3 mt -72.6 -26.82 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.719 -0.613 . . . . 0.0 109.62 179.399 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.5 mt -72.91 -36.51 67.29 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.541 -0.724 . . . . 0.0 109.734 179.587 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -71.18 -31.06 67.2 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.611 -0.68 . . . . 0.0 109.718 179.605 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.0 mt -69.37 -30.57 68.59 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.774 -0.579 . . . . 0.0 109.831 179.667 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -69.21 -31.32 69.84 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.602 -0.686 . . . . 0.0 109.847 179.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.52 -32.73 54.26 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.603 -0.686 . . . . 0.0 109.626 179.583 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -76.06 -33.19 59.58 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.695 -0.628 . . . . 0.0 109.58 179.581 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.7 tp -74.96 -30.16 61.13 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.676 -0.64 . . . . 0.0 109.734 179.549 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tt -75.43 -36.2 60.82 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.667 -0.646 . . . . 0.0 109.71 179.562 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.72 -30.72 67.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.677 -0.639 . . . . 0.0 109.735 179.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.2 tp -69.32 -37.27 77.66 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.696 -0.628 . . . . 0.0 109.709 179.619 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -71.65 -30.09 65.35 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.598 -0.689 . . . . 0.0 109.639 179.359 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.52 -29.91 67.63 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.578 -0.701 . . . . 0.0 109.855 179.555 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.62 -42.8 81.76 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.634 -0.666 . . . . 0.0 109.885 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.3 ttpp -62.03 -29.61 70.4 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.555 -0.716 . . . . 0.0 109.769 179.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -62.48 -32.17 73.02 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.737 -0.602 . . . . 0.0 109.874 179.713 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -68.75 -37.7 79.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.639 -0.663 . . . . 0.0 109.714 179.68 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.08 -30.08 71.17 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.678 -0.639 . . . . 0.0 109.711 179.668 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -62.47 -36.1 81.41 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.626 -0.671 . . . . 0.0 109.824 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.72 -28.86 69.72 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.638 -0.664 . . . . 0.0 110.007 179.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -87.68 -23.98 24.03 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.542 -0.723 . . . . 0.0 110.418 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 29.4 tp . . . . . 0 N--CA 1.5 2.034 0 CA-C-O 118.018 -0.991 . . . . 0.0 110.575 -179.871 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.402 ' CD1' ' N ' ' B' ' 172' ' ' LEU . 0.4 OUTLIER -109.07 -61.98 1.54 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.561 -0.964 . . . . 0.0 109.01 179.897 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 93.7 p -155.27 35.41 0.38 Allowed 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 121.381 0.61 . . . . 0.0 109.451 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 4.8 tptm 51.88 26.16 3.46 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.526 -0.734 . . . . 0.0 110.146 -178.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -148.4 -44.84 0.15 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.679 -0.638 . . . . 0.0 109.916 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -30.4 71.49 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 119.612 -0.835 . . . . 0.0 109.27 179.514 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . 0.402 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 0.9 OUTLIER -83.48 -28.88 28.43 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 178.567 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.0 mm -68.07 -30.96 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.058 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -70.3 -29.96 66.84 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.675 -0.641 . . . . 0.0 109.903 179.617 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -77.45 -32.96 54.83 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.618 -0.676 . . . . 0.0 109.771 179.683 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.68 -30.25 59.31 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.675 -0.641 . . . . 0.0 109.746 179.595 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -76.57 -30.53 57.07 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.634 -0.666 . . . . 0.0 109.859 179.767 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -77.43 -33.85 54.79 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.628 -0.67 . . . . 0.0 109.799 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 67.5 t -76.84 -30.65 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.632 -0.668 . . . . 0.0 109.476 179.497 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -75.41 -29.25 59.7 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.656 -0.653 . . . . 0.0 109.865 179.503 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -29.64 62.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.609 -0.682 . . . . 0.0 109.992 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -75.06 -33.18 61.68 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.601 -0.687 . . . . 0.0 109.984 179.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 89.2 mt -72.25 -30.05 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.66 -0.65 . . . . 0.0 109.739 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.63 -35.13 72.76 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.669 -0.644 . . . . 0.0 109.789 179.556 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.5 ttt -67.55 -41.84 83.6 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.567 -0.708 . . . . 0.0 109.802 179.618 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.5 t -70.79 -30.41 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.674 -0.641 . . . . 0.0 109.638 179.629 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -74.0 -29.9 62.2 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.584 -0.698 . . . . 0.0 109.964 179.697 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -72.36 -29.68 64.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.52 -0.738 . . . . 0.0 109.918 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -38.69 65.31 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.677 -0.64 . . . . 0.0 109.843 179.774 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 76.0 mt -70.82 -30.5 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.745 -0.597 . . . . 0.0 109.616 179.722 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.6 m -71.09 -36.72 72.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.649 -0.657 . . . . 0.0 109.603 179.557 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 16.5 mmtm -74.88 -31.95 61.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.642 -0.661 . . . . 0.0 109.584 179.478 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.62 -14.42 59.33 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.694 -0.629 . . . . 0.0 110.438 179.358 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.7 tptp -87.65 -28.27 21.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.236 -0.915 . . . . 0.0 109.404 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.16 -34.92 56.39 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.583 -0.698 . . . . 0.0 109.753 179.523 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.67 -27.62 65.18 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 119.785 -0.766 . . . . 0.0 109.538 179.454 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -69.29 -29.77 67.71 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.54 -0.725 . . . . 0.0 109.458 179.174 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -61.19 -43.58 98.65 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.705 -0.622 . . . . 0.0 109.707 179.52 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -61.58 -34.05 74.94 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.746 -0.596 . . . . 0.0 109.616 179.369 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 23.5 tp -78.12 -31.97 50.19 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 N--CA 1.493 1.689 0 O-C-N 121.715 -0.615 . . . . 0.0 109.581 179.447 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.3 tt . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 121.104 0.478 . . . . 0.0 109.89 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -64.52 -35.69 81.79 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.573 -0.705 . . . . 0.0 109.9 179.888 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -73.7 -35.43 65.15 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.582 -0.699 . . . . 0.0 109.794 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.6 m -71.72 -31.32 66.58 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.741 -0.6 . . . . 0.0 109.604 179.476 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -68.07 -28.34 67.28 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.725 -0.609 . . . . 0.0 109.89 179.625 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -65.99 -34.73 78.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.59 -0.694 . . . . 0.0 110.006 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.6 tp60 -77.64 -31.71 52.87 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.679 -0.638 . . . . 0.0 109.64 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 82.0 mt -77.01 -28.8 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.732 -0.605 . . . . 0.0 109.562 179.496 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 25.4 tp -74.35 -33.89 63.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.598 -0.689 . . . . 0.0 109.632 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -29.94 70.0 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.574 -0.704 . . . . 0.0 109.745 179.626 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 14.2 mt -65.02 -30.98 72.0 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.642 -0.661 . . . . 0.0 110.046 179.796 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.98 -38.87 92.66 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.565 -0.709 . . . . 0.0 110.004 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -73.9 -31.76 63.26 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.548 179.574 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -76.07 -34.96 59.57 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.706 -0.621 . . . . 0.0 109.663 179.58 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.57 -30.65 61.8 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.58 -0.7 . . . . 0.0 109.607 179.464 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.9 tt -74.39 -34.69 63.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.634 -0.666 . . . . 0.0 109.726 179.552 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.37 69.56 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.676 -0.64 . . . . 0.0 109.723 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -72.16 -43.17 65.02 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.617 -0.677 . . . . 0.0 109.756 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -67.62 -29.05 68.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.684 -0.635 . . . . 0.0 109.872 179.486 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -70.1 -30.01 67.11 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.583 -0.698 . . . . 0.0 109.847 179.671 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -69.63 -45.65 68.0 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.599 -0.688 . . . . 0.0 109.711 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -61.87 -27.63 68.93 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.531 -0.731 . . . . 0.0 109.606 179.204 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -62.57 -30.01 71.01 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.592 -0.693 . . . . 0.0 109.771 179.561 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -61.34 -43.93 98.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.535 -0.728 . . . . 0.0 109.856 179.685 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.74 -33.65 76.13 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.703 -0.623 . . . . 0.0 109.394 179.436 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -62.03 -35.14 77.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.685 -0.634 . . . . 0.0 109.872 179.817 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.68 -27.17 69.05 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.981 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -106.33 12.73 29.55 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.62 -0.675 . . . . 0.0 110.803 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 58.8 tp . . . . . 0 N--CA 1.499 1.983 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.12 -179.866 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.409 ' CD1' ' N ' ' B' ' 168' ' ' SER . 2.5 pp -140.43 -46.05 0.42 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.616 -0.932 . . . . 0.0 110.501 -179.808 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 168' ' ' SER . . . . . 0.409 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 38.6 m -153.93 13.99 0.46 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.285 -0.884 . . . . 0.0 111.466 179.925 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 24.3 tptp 49.31 26.6 1.62 Allowed 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.085 -1.01 . . . . 0.0 111.02 -179.825 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -151.4 -47.43 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.735 -0.603 . . . . 0.0 109.738 179.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -74.01 -35.28 64.39 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.27 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -77.12 -29.72 54.89 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.774 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.0 mm -69.51 -29.98 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.393 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -74.1 -31.46 62.81 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.651 -0.656 . . . . 0.0 109.852 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -74.57 -32.76 62.5 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.658 -0.651 . . . . 0.0 109.837 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -29.4 64.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.729 -0.607 . . . . 0.0 109.772 179.523 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.18 -29.76 66.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.557 -0.715 . . . . 0.0 110.054 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 8.0 mtm180 -73.28 -37.08 66.39 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.679 -0.638 . . . . 0.0 109.936 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 59.2 t -73.57 -31.46 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.654 -0.654 . . . . 0.0 109.479 179.594 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -72.2 -29.19 63.74 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.712 -0.617 . . . . 0.0 109.919 179.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.52 -31.98 70.53 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.592 -0.692 . . . . 0.0 109.947 179.768 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.06 -35.06 66.63 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.666 -0.646 . . . . 0.0 109.926 179.779 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . 0.457 HD11 HG21 ' B' ' 183' ' ' ILE . 86.0 mt -69.51 -30.24 44.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.545 179.6 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.91 -30.98 71.66 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.636 -0.665 . . . . 0.0 109.808 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.6 mtt -68.5 -50.24 53.72 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.685 -0.634 . . . . 0.0 109.843 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -68.21 -30.89 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.578 -0.701 . . . . 0.0 109.564 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -75.23 -28.4 59.88 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.655 -0.653 . . . . 0.0 109.94 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -74.15 -28.89 61.53 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.564 -0.71 . . . . 0.0 110.036 179.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.03 -36.6 64.43 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.545 -0.722 . . . . 0.0 109.97 179.801 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 84.0 mt -68.99 -30.48 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.669 -0.644 . . . . 0.0 109.668 179.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.7 m -68.37 -40.94 81.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.63 -0.669 . . . . 0.0 109.559 179.513 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt -73.31 -33.44 65.17 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.682 -0.636 . . . . 0.0 109.4 179.426 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.37 -30.44 64.7 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.701 -0.625 . . . . 0.0 109.398 179.322 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.4 tppt? -69.75 -42.42 73.9 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.644 -0.66 . . . . 0.0 109.727 179.587 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.41 -31.83 73.19 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.561 -0.712 . . . . 0.0 109.383 179.493 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 2.0 ttpp -63.75 -37.12 86.16 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.697 -0.627 . . . . 0.0 109.452 179.476 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -62.28 -29.9 70.75 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.763 -0.586 . . . . 0.0 109.767 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -61.97 -44.97 95.62 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.707 -0.62 . . . . 0.0 109.886 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -63.1 -37.9 89.06 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.698 -0.626 . . . . 0.0 109.82 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.4 tp -73.22 -36.22 66.44 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.612 -0.68 . . . . 0.0 109.719 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 . . . . . 0 N--CA 1.493 1.706 0 O-C-N 121.599 -0.688 . . . . 0.0 109.76 179.639 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.6 tt . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.072 0.463 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -66.45 -39.33 88.79 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.6 -0.688 . . . . 0.0 109.93 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -71.95 -29.88 64.73 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.729 -0.607 . . . . 0.0 109.811 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 74.9 m -73.06 -29.77 63.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.625 -0.672 . . . . 0.0 109.884 179.658 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.79 -27.47 63.93 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.568 -0.707 . . . . 0.0 110.1 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -76.11 -28.1 57.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.508 -0.745 . . . . 0.0 110.235 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 72.8 tp60 -77.7 -33.24 53.24 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.566 -0.709 . . . . 0.0 109.852 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 68.1 mt -74.12 -28.42 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.718 -0.613 . . . . 0.0 109.577 179.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.24 -37.22 66.44 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.547 -0.72 . . . . 0.0 109.647 179.537 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.9 tptt -62.8 -29.58 70.82 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.535 -0.728 . . . . 0.0 109.633 179.443 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 10.9 mt -61.47 -29.6 70.07 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.684 -0.635 . . . . 0.0 109.903 179.593 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.2 -38.55 89.57 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.6 -0.688 . . . . 0.0 109.719 179.603 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.04 -31.68 58.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.636 -0.665 . . . . 0.0 109.268 179.259 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -75.38 -31.97 60.65 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.763 -0.585 . . . . 0.0 109.702 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 22.3 tp -76.36 -31.41 58.05 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.606 -0.684 . . . . 0.0 109.647 179.469 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 tp -74.81 -33.95 62.29 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 120.263 -0.575 . . . . 0.0 109.61 179.485 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.4 -31.42 69.77 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.721 -0.612 . . . . 0.0 109.735 179.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.34 -44.01 69.04 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.678 -0.639 . . . . 0.0 109.668 179.589 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -66.42 -30.5 70.87 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.715 179.505 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -67.77 -31.7 71.77 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.682 -0.636 . . . . 0.0 109.779 179.709 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.07 -44.72 88.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.614 -0.679 . . . . 0.0 109.636 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.3 tttm -64.05 -28.82 70.05 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 120.044 -0.662 . . . . 0.0 109.543 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -65.78 -28.69 69.2 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.689 -0.632 . . . . 0.0 110.118 179.749 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -37.51 78.62 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.526 -0.734 . . . . 0.0 109.748 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 mt -62.87 -29.06 70.46 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.663 -0.648 . . . . 0.0 109.845 179.635 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -62.14 -42.32 99.13 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.5 -0.75 . . . . 0.0 109.508 179.64 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.86 -30.58 69.12 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-O 121.382 0.61 . . . . 0.0 109.515 179.152 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -85.9 -19.54 30.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.675 -0.641 . . . . 0.0 110.53 179.565 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.03 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.712 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.405 ' CD1' ' N ' ' B' ' 167' ' ' LEU . 0.1 OUTLIER -131.19 -63.17 0.86 Allowed 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.616 -0.932 . . . . 0.0 109.158 179.95 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 4.2 m -144.56 37.08 1.2 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 121.343 0.592 . . . . 0.0 109.559 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 17.0 tptt 51.92 25.74 3.25 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.483 -0.761 . . . . 0.0 110.17 -179.009 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -146.7 -45.11 0.18 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.661 -0.649 . . . . 0.0 109.953 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -64.62 -32.43 74.08 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.554 -0.859 . . . . 0.0 109.148 179.399 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.35 -28.35 38.09 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.583 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 47.2 mm -73.9 -30.7 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.641 -0.662 . . . . 0.0 109.623 179.698 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -73.69 -29.26 62.18 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.619 -0.676 . . . . 0.0 110.13 179.897 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 42.6 m-20 -73.35 -27.54 61.55 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.603 -0.685 . . . . 0.0 110.204 179.875 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.2 mtt -74.51 -28.94 61.21 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.553 -0.717 . . . . 0.0 110.276 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.77 -28.42 55.67 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.577 -0.702 . . . . 0.0 110.163 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 8.4 ttp180 -77.93 -34.45 51.24 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.595 -0.69 . . . . 0.0 109.918 179.861 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 84.2 t -73.58 -29.17 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.671 -0.643 . . . . 0.0 109.479 179.445 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -68.82 -29.56 67.93 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.69 -0.631 . . . . 0.0 109.919 179.592 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 30.8 mtp180 -75.39 -27.78 59.21 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.59 -0.694 . . . . 0.0 109.969 179.681 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -75.49 -34.27 60.85 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.557 -0.715 . . . . 0.0 110.064 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . 0.485 HG22 HD12 ' B' ' 183' ' ' ILE . 88.1 mt -71.49 -28.76 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.824 179.675 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -33.53 71.94 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.584 -0.697 . . . . 0.0 109.771 179.555 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 5.0 ttm -69.53 -45.49 68.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.651 -0.656 . . . . 0.0 109.856 179.794 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 61.6 t -70.18 -31.03 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.609 -0.682 . . . . 0.0 109.611 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -74.91 -28.98 60.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.672 -0.643 . . . . 0.0 109.876 179.598 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -73.3 -28.94 62.38 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.607 -0.683 . . . . 0.0 110.001 179.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -35.55 65.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.662 -0.649 . . . . 0.0 110.013 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.4 HG22 HD12 ' B' ' 190' ' ' ILE . 77.2 mt -70.57 -29.76 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.628 -0.67 . . . . 0.0 109.834 179.931 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.12 -39.66 68.67 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.672 -0.643 . . . . 0.0 109.791 179.664 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -73.92 -30.81 62.77 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.598 -0.689 . . . . 0.0 109.487 179.481 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.11 -31.03 65.66 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.614 -0.679 . . . . 0.0 109.38 179.282 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -46.63 66.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.602 -0.686 . . . . 0.0 109.456 179.411 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -68.03 -31.54 71.28 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.597 -0.689 . . . . 0.0 109.203 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 15.3 ttpt -65.7 -33.34 75.66 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.703 -0.623 . . . . 0.0 109.436 179.267 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -65.16 -29.98 70.86 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.751 -0.593 . . . . 0.0 109.707 179.544 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -62.83 -42.5 99.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.65 -0.656 . . . . 0.0 109.916 179.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -61.13 -45.46 94.57 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.67 -0.644 . . . . 0.0 109.927 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 13.4 tp -72.2 -30.14 64.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.581 -0.7 . . . . 0.0 109.673 179.638 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 . . . . . 0 N--CA 1.494 1.73 0 O-C-N 121.622 -0.674 . . . . 0.0 109.725 179.587 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 tp . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 121.076 0.465 . . . . 0.0 109.973 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.29 -38.79 88.58 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.552 -0.717 . . . . 0.0 110.035 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -73.44 -36.41 65.92 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.725 -0.609 . . . . 0.0 109.704 179.575 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.8 m -74.06 -31.03 62.69 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.697 -0.627 . . . . 0.0 109.517 179.415 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -70.88 -26.67 63.35 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.677 -0.639 . . . . 0.0 109.965 179.51 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -69.11 -35.61 76.61 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.554 -0.716 . . . . 0.0 110.206 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -75.95 -37.06 59.05 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.551 -0.718 . . . . 0.0 109.681 179.665 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 90.1 mt -71.96 -26.61 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.692 -0.63 . . . . 0.0 109.603 179.256 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.4 tt -70.73 -37.21 73.47 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.493 -0.755 . . . . 0.0 109.884 179.591 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -67.85 -38.04 82.64 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.613 -0.679 . . . . 0.0 109.688 179.649 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.4 mt -63.95 -29.6 70.75 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.733 -0.604 . . . . 0.0 109.898 179.714 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -65.22 -38.34 90.12 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.645 -0.659 . . . . 0.0 109.798 179.767 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -73.36 -32.87 64.76 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.383 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.9 tttt -69.76 -36.37 75.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.68 -0.638 . . . . 0.0 109.593 179.529 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.1 tp -70.39 -30.01 66.79 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.626 -0.671 . . . . 0.0 109.731 179.421 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -73.29 -37.76 66.13 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.716 -0.615 . . . . 0.0 109.727 179.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.16 -30.26 70.19 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.716 -0.615 . . . . 0.0 109.826 179.675 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.3 mp -70.99 -43.79 67.27 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.687 -0.633 . . . . 0.0 109.829 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -66.2 -29.59 69.88 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.618 -0.676 . . . . 0.0 109.785 179.755 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -68.78 -30.5 69.1 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.572 -0.705 . . . . 0.0 109.77 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -48.72 56.81 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.635 -0.666 . . . . 0.0 109.777 179.729 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -63.69 -30.34 71.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.556 -0.715 . . . . 0.0 109.591 179.462 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -65.59 -34.6 78.62 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.676 -0.64 . . . . 0.0 109.817 179.613 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -67.25 -37.76 84.05 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.725 -0.609 . . . . 0.0 109.713 179.61 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.3 mt -62.3 -38.45 89.44 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.646 -0.659 . . . . 0.0 109.762 179.66 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -60.9 -42.58 98.29 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.544 -0.722 . . . . 0.0 109.963 179.917 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.8 mt -67.47 -30.08 69.7 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.742 -0.599 . . . . 0.0 109.676 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.53 -15.7 34.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.689 -0.632 . . . . 0.0 110.692 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 30.5 tp . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.521 -179.859 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.404 ' CD1' ' CB ' ' B' ' 171' ' ' GLU . 1.6 pp -50.32 -46.37 55.51 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.793 -0.827 . . . . 0.0 111.607 179.868 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 34.8 t -151.74 16.36 0.68 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.258 -0.902 . . . . 0.0 111.115 -179.987 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 26.0 tptt 49.94 26.36 1.97 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.131 -0.981 . . . . 0.0 111.021 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -153.37 -46.4 0.09 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.648 -0.657 . . . . 0.0 110.03 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . 0.404 ' CB ' ' CD1' ' B' ' 167' ' ' LEU . 0.0 OUTLIER -74.64 -30.29 61.58 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.904 -0.718 . . . . 0.0 109.294 179.59 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.3 tt -79.13 -28.88 42.93 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.711 -0.618 . . . . 0.0 109.672 179.117 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . 0.445 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.3 mp -76.82 -35.25 24.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -64.44 -31.39 72.58 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.905 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -75.83 -34.58 60.11 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.109 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.48 -31.76 71.28 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.645 179.524 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -76.93 -30.65 56.19 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.545 -0.722 . . . . 0.0 109.851 179.588 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 -74.8 -30.11 61.31 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.661 -0.65 . . . . 0.0 109.781 179.579 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 66.5 t -72.12 -29.47 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.691 -0.63 . . . . 0.0 109.831 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.94 -31.38 67.95 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.543 -0.723 . . . . 0.0 109.985 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -30.03 63.61 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.739 -0.601 . . . . 0.0 109.828 179.746 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 47.6 tt0 -74.04 -41.17 62.19 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.639 -0.663 . . . . 0.0 109.901 179.716 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . 0.425 HG23 HD11 ' B' ' 183' ' ' ILE . 84.0 mt -67.89 -28.37 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.674 -0.641 . . . . 0.0 109.505 179.482 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 35.2 m -66.74 -32.13 73.23 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.55 -0.719 . . . . 0.0 109.691 179.475 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.4 mtt -67.28 -50.28 60.97 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.716 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.9 t -65.13 -30.25 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.653 -0.655 . . . . 0.0 109.565 179.568 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -71.12 -29.61 65.46 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.672 -0.643 . . . . 0.0 109.932 179.734 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -30.5 69.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.618 -0.676 . . . . 0.0 109.861 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -37.42 56.75 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.604 -0.685 . . . . 0.0 109.612 179.689 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 70.9 mt -73.38 -28.98 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.651 -0.656 . . . . 0.0 109.593 179.673 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.2 m -73.18 -34.29 65.92 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.544 -0.722 . . . . 0.0 109.548 179.508 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -37.38 62.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.677 -0.639 . . . . 0.0 109.491 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.54 -30.69 68.56 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.58 -0.7 . . . . 0.0 109.403 179.238 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -67.49 -42.93 82.1 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.633 -0.667 . . . . 0.0 109.663 179.54 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -68.74 -33.54 74.09 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.577 -0.702 . . . . 0.0 109.338 179.397 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.42 -32.62 74.31 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.032 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -65.49 -30.24 70.98 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.477 179.288 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -60.48 -42.47 96.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.684 -0.635 . . . . 0.0 109.868 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -45.42 93.6 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.679 -0.638 . . . . 0.0 109.689 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.0 tp -72.95 -30.9 64.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.707 -0.621 . . . . 0.0 109.422 179.231 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.69 -0.631 . . . . 0.0 109.928 179.511 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 18.6 tp . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 121.093 0.473 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.82 -32.61 69.72 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.555 -0.716 . . . . 0.0 110.02 179.964 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -75.16 -34.19 61.57 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.638 -0.664 . . . . 0.0 109.816 179.669 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 35.9 m -73.53 -30.41 63.06 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.703 -0.623 . . . . 0.0 109.677 179.608 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -71.59 -27.76 63.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.611 -0.68 . . . . 0.0 110.05 179.611 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -70.0 -30.19 67.45 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.571 -0.706 . . . . 0.0 110.156 179.886 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.41 -37.14 60.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.578 -0.701 . . . . 0.0 109.914 179.797 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.9 mt -70.26 -27.77 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.671 -0.643 . . . . 0.0 109.697 179.611 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 21.4 tp -69.75 -35.06 74.64 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.563 -0.711 . . . . 0.0 109.895 179.679 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -67.98 -28.78 67.73 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.526 -0.734 . . . . 0.0 109.911 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 11.7 mt -68.57 -31.4 70.58 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.599 -0.688 . . . . 0.0 110.108 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -66.42 -37.31 84.92 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.583 -0.698 . . . . 0.0 110.039 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -74.9 -28.53 60.67 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.608 -0.682 . . . . 0.0 109.916 179.662 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -77.53 -29.8 52.52 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.64 -0.662 . . . . 0.0 109.899 179.78 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.1 tp -77.05 -30.71 55.73 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.602 -0.686 . . . . 0.0 109.97 179.837 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.4 mt -79.3 -31.03 43.16 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.625 -0.672 . . . . 0.0 109.74 179.666 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -77.08 -28.4 54.57 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.699 -0.625 . . . . 0.0 109.827 179.487 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.8 tp -76.06 -33.75 59.59 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.62 -0.675 . . . . 0.0 109.918 179.704 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -72.45 -31.16 65.22 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.578 -0.701 . . . . 0.0 109.586 179.372 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -67.89 -29.04 68.05 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.719 -0.613 . . . . 0.0 109.787 179.416 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.17 -44.98 82.48 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.544 -0.722 . . . . 0.0 109.864 179.772 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -62.89 -29.48 70.8 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.568 -0.707 . . . . 0.0 109.799 179.686 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -65.69 -38.59 89.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.616 -0.678 . . . . 0.0 109.844 179.721 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -64.99 -46.64 80.6 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.656 -0.653 . . . . 0.0 109.67 179.596 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.52 -29.28 69.89 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.645 -0.659 . . . . 0.0 109.776 179.493 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.38 -35.58 81.36 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.59 -0.694 . . . . 0.0 109.537 179.619 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.93 -30.59 64.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.724 -0.61 . . . . 0.0 109.409 179.294 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -75.44 -18.51 59.86 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.711 -0.618 . . . . 0.0 110.494 179.55 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 28.0 tp . . . . . 0 N--CA 1.5 2.068 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.643 -179.939 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.402 ' CD1' ' N ' ' B' ' 172' ' ' LEU . 0.2 OUTLIER -126.96 -62.91 1.09 Allowed 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.537 -0.978 . . . . 0.0 109.132 179.901 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 9.0 t -144.36 37.2 1.23 Allowed 'General case' 0 N--CA 1.489 1.484 0 CA-C-O 121.238 0.542 . . . . 0.0 109.576 179.747 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 10.1 tptt 51.76 26.14 3.32 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.569 -0.707 . . . . 0.0 110.138 -178.976 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -147.19 -44.99 0.17 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.691 -0.63 . . . . 0.0 109.834 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.12 -32.32 73.97 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.383 179.599 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . 0.402 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 0.1 OUTLIER -79.45 -27.34 41.64 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.438 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.6 mm -70.07 -30.37 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.629 -0.67 . . . . 0.0 109.605 179.501 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -74.93 -27.82 60.36 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.566 -0.709 . . . . 0.0 110.225 179.97 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -77.37 -29.42 53.26 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.543 -0.723 . . . . 0.0 110.14 179.91 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -29.64 55.58 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.627 -0.671 . . . . 0.0 109.93 179.771 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.08 -29.37 54.94 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.66 -0.65 . . . . 0.0 110.026 179.914 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.11 -29.05 54.62 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.547 -0.72 . . . . 0.0 109.971 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 67.3 t -76.04 -29.32 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.582 -0.699 . . . . 0.0 109.792 179.701 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -74.69 -28.64 60.91 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.608 -0.682 . . . . 0.0 110.176 179.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -29.2 60.82 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.609 -0.682 . . . . 0.0 110.026 179.925 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -76.6 -36.18 57.66 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.61 -0.681 . . . . 0.0 110.058 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 87.6 mt -73.77 -27.88 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.715 -0.616 . . . . 0.0 109.762 179.604 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 29.5 m -73.98 -33.02 63.69 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.502 -0.748 . . . . 0.0 109.769 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 2.9 tpt -76.6 -36.75 57.31 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.626 -0.671 . . . . 0.0 109.585 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 73.1 t -75.15 -31.17 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.689 -0.632 . . . . 0.0 109.455 179.343 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -74.74 -29.17 61.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.644 -0.66 . . . . 0.0 109.847 179.678 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -73.72 -29.55 62.32 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.621 -0.674 . . . . 0.0 109.937 179.726 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -71.53 -35.43 70.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.706 -0.621 . . . . 0.0 109.819 179.798 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.405 HD12 HG21 ' B' ' 190' ' ' ILE . 79.0 mt -68.74 -37.89 78.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.576 -0.703 . . . . 0.0 109.849 179.832 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 56.1 p -66.9 -35.07 79.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.629 -0.67 . . . . 0.0 109.446 179.442 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 6.2 mmmm -75.86 -36.05 59.71 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.316 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.81 -14.61 60.3 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.682 -0.636 . . . . 0.0 110.458 179.358 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.9 tppt? -87.08 -29.25 22.03 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.238 -0.914 . . . . 0.0 109.355 179.334 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -76.53 -35.15 58.46 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 120.192 -0.603 . . . . 0.0 109.88 179.475 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -28.04 65.42 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 119.769 -0.773 . . . . 0.0 109.555 179.41 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -72.04 -30.28 65.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.597 -0.689 . . . . 0.0 109.223 179.032 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -35.79 80.55 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.73 -0.606 . . . . 0.0 109.786 179.637 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.06 -44.24 94.85 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.523 -0.736 . . . . 0.0 109.045 179.096 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 18.0 tp -68.02 -29.06 67.97 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.355 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.72 -0.613 . . . . 0.0 109.872 179.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 121.152 0.501 . . . . 0.0 109.95 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -76.05 -31.98 59.08 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.655 -0.653 . . . . 0.0 109.933 179.82 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.28 -34.71 59.1 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.716 -0.615 . . . . 0.0 109.675 179.565 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.1 m -74.82 -34.17 62.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.651 -0.656 . . . . 0.0 109.454 179.4 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.4 mttt -69.68 -27.78 65.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.686 -0.634 . . . . 0.0 109.746 179.405 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -67.19 -34.55 77.75 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.513 -0.742 . . . . 0.0 109.912 179.726 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -76.24 -32.44 58.88 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.661 -0.649 . . . . 0.0 109.557 179.544 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.4 ' CD1' ' CG ' ' B' ' 197' ' ' GLN . 75.1 mt -72.66 -28.3 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.719 -0.613 . . . . 0.0 109.557 179.335 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 tt -69.27 -38.4 78.37 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.621 -0.674 . . . . 0.0 109.846 179.659 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.2 tmtm? -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.592 -0.693 . . . . 0.0 109.846 179.728 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -64.55 -32.84 74.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.711 -0.618 . . . . 0.0 109.912 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -38.89 91.71 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.594 -0.691 . . . . 0.0 109.83 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.34 -32.07 64.34 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.642 -0.662 . . . . 0.0 109.518 179.455 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.3 tptm -73.19 -33.63 65.52 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.717 -0.614 . . . . 0.0 109.659 179.577 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 20.8 tp -76.02 -32.09 59.2 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.671 -0.643 . . . . 0.0 109.587 179.491 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -76.73 -34.48 58.11 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.747 -0.596 . . . . 0.0 109.558 179.396 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.42 -29.14 62.38 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.708 -0.62 . . . . 0.0 109.79 179.472 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.1 tp -75.8 -36.6 59.69 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.662 -0.649 . . . . 0.0 109.817 179.68 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -76.2 -23.09 54.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.68 -0.637 . . . . 0.0 110.138 179.439 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -81.32 -26.75 35.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.455 -0.778 . . . . 0.0 109.573 179.187 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -76.43 -41.46 47.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.577 -0.702 . . . . 0.0 110.003 179.632 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.28 -24.84 64.92 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.627 179.339 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -66.29 -31.04 71.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.552 -0.717 . . . . 0.0 109.446 179.184 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.01 -31.46 72.6 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.616 -0.677 . . . . 0.0 109.595 179.465 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -34.96 77.41 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.672 -0.643 . . . . 0.0 109.755 179.548 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -61.87 -36.36 81.02 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.596 -0.69 . . . . 0.0 109.975 179.684 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 tp -64.16 -29.86 70.95 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.677 -0.64 . . . . 0.0 109.95 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -82.41 -13.1 57.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.652 -0.655 . . . . 0.0 110.799 179.822 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.5 tp . . . . . 0 N--CA 1.501 2.098 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.598 -179.946 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.98 -63.13 1.44 Allowed 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.583 -0.951 . . . . 0.0 108.946 -179.957 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.6 t -152.83 33.55 0.49 Allowed 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.277 0.56 . . . . 0.0 109.543 179.684 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 9.6 tptm 51.34 26.73 3.22 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.515 -0.741 . . . . 0.0 110.072 -179.065 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -149.03 -43.21 0.14 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.633 -0.667 . . . . 0.0 110.339 -179.785 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.0 -40.83 96.98 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.667 179.77 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.4 mt -76.18 -28.53 57.33 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.8 mm -67.5 -31.06 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.328 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -75.53 -32.73 60.58 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.714 179.766 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -73.78 -35.0 64.89 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.67 -0.644 . . . . 0.0 109.566 179.45 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -29.54 69.04 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.729 -0.607 . . . . 0.0 109.966 179.628 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -77.17 -25.34 51.8 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.625 -0.672 . . . . 0.0 110.132 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -77.86 -31.5 51.45 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.562 -0.711 . . . . 0.0 110.194 179.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 34.5 m -77.21 -24.53 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.573 -0.705 . . . . 0.0 110.294 179.966 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -82.44 -29.71 30.5 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.405 -0.809 . . . . 0.0 109.836 179.653 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -77.49 -27.93 52.03 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.696 -0.627 . . . . 0.0 109.842 179.576 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -77.54 -34.54 53.86 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.537 -0.727 . . . . 0.0 110.021 179.705 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 76.9 mt -74.26 -27.0 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.551 -0.718 . . . . 0.0 109.692 179.574 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 28.1 m -71.61 -31.43 66.89 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.525 -0.735 . . . . 0.0 109.552 179.256 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.26 -44.37 53.17 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.61 -0.681 . . . . 0.0 109.497 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 70.5 t -71.45 -31.83 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.679 -0.638 . . . . 0.0 109.289 179.331 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -72.99 -29.06 62.75 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.704 -0.623 . . . . 0.0 109.797 179.565 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -72.43 -32.17 66.09 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.677 -0.639 . . . . 0.0 109.918 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.46 -29.85 67.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.715 -0.616 . . . . 0.0 109.983 179.803 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.408 HD13 HG23 ' B' ' 190' ' ' ILE . 79.7 mt -73.95 -30.27 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.602 -0.686 . . . . 0.0 109.762 179.775 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 97.7 p -71.73 -40.28 69.53 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.627 -0.671 . . . . 0.0 109.519 179.315 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 9.8 mtpp -71.35 -30.19 65.87 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.589 -0.695 . . . . 0.0 109.455 179.341 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.19 -37.65 72.13 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.668 -0.645 . . . . 0.0 109.341 179.366 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.93 -42.37 97.39 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.625 -0.672 . . . . 0.0 109.486 179.453 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.04 -30.64 71.2 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.46 179.337 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt -64.35 -34.31 77.85 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.686 -0.634 . . . . 0.0 109.33 179.296 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . 0.4 ' CG ' ' CD1' ' A' ' 69' ' ' ILE . 4.0 mm-40 -64.49 -31.35 72.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.77 -0.581 . . . . 0.0 109.465 179.38 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -60.22 -40.47 90.27 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.655 -0.653 . . . . 0.0 109.894 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -62.03 -39.64 93.0 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 120.286 -0.566 . . . . 0.0 109.793 179.605 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.78 -31.88 65.2 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.689 -0.632 . . . . 0.0 109.59 179.575 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 . . . . . 0 N--CA 1.493 1.69 0 O-C-N 121.623 -0.673 . . . . 0.0 109.753 179.645 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tp . . . . . 0 N--CA 1.496 1.831 0 CA-C-O 121.005 0.431 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.1 tp10 -70.46 -30.16 66.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.563 -0.711 . . . . 0.0 110.111 179.985 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -73.55 -43.1 60.72 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.637 -0.664 . . . . 0.0 109.84 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.8 m -67.45 -30.55 70.3 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.701 -0.625 . . . . 0.0 109.596 179.503 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -67.6 -27.9 67.29 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.628 -0.67 . . . . 0.0 109.909 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.84 -40.6 91.92 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.507 -0.745 . . . . 0.0 110.119 179.872 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -73.75 -36.99 65.2 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.609 -0.682 . . . . 0.0 109.579 179.64 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 75.7 mt -73.02 -27.98 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.707 -0.62 . . . . 0.0 109.399 179.261 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.58 -34.91 72.7 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.61 -0.681 . . . . 0.0 109.764 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -62.96 -36.13 82.43 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.557 -0.714 . . . . 0.0 109.753 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 15.5 mt -63.05 -28.61 70.21 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.61 -0.681 . . . . 0.0 109.919 179.696 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.02 -41.16 99.47 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.575 -0.703 . . . . 0.0 110.002 179.822 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.46 -32.19 66.06 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.683 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -77.17 -33.97 56.4 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.728 -0.607 . . . . 0.0 109.631 179.635 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.4 tp -75.72 -29.67 59.0 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.651 -0.656 . . . . 0.0 109.706 179.454 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tt -76.27 -34.77 59.14 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.716 -0.615 . . . . 0.0 109.649 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.31 -29.69 65.32 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.634 -0.666 . . . . 0.0 109.792 179.49 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.83 -40.19 69.26 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.63 -0.669 . . . . 0.0 109.725 179.736 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -69.45 -30.39 68.29 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.579 -0.7 . . . . 0.0 109.696 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -69.02 -29.5 67.67 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.738 -0.601 . . . . 0.0 109.769 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -65.75 -41.62 91.91 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.642 -0.661 . . . . 0.0 109.826 179.879 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -67.9 -29.69 68.84 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.59 -0.694 . . . . 0.0 109.791 179.623 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -68.29 -31.42 70.85 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.687 -0.633 . . . . 0.0 109.861 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 51.6 tp60 -68.15 -35.83 78.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.594 -0.691 . . . . 0.0 109.731 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.8 mt -63.43 -32.2 73.58 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.661 -0.649 . . . . 0.0 109.851 179.702 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -61.5 -38.85 88.81 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.555 -0.716 . . . . 0.0 109.789 179.73 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 44.4 mt -73.73 -30.66 62.96 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.709 -0.619 . . . . 0.0 109.663 179.492 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -86.9 -16.99 34.32 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.59 -0.694 . . . . 0.0 110.688 179.65 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.4 tp . . . . . 0 N--CA 1.5 2.061 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.646 179.996 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.409 ' CD1' ' N ' ' B' ' 168' ' ' SER . 2.9 pp -139.54 -44.59 0.45 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.617 -0.931 . . . . 0.0 110.54 -179.911 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 168' ' ' SER . . . . . 0.409 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 20.5 t -153.85 15.16 0.49 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.407 -0.808 . . . . 0.0 111.299 -179.99 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.9 tptm 49.51 26.44 1.7 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.095 -1.003 . . . . 0.0 111.059 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.63 -46.77 0.1 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.695 -0.628 . . . . 0.0 110.064 179.991 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -73.49 -37.29 65.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.575 -0.703 . . . . 0.0 109.119 179.483 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.3 tt -74.39 -27.59 60.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.746 -0.597 . . . . 0.0 109.408 178.821 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.3 mm -69.53 -33.68 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.591 -0.693 . . . . 0.0 109.277 179.388 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -70.7 -30.56 67.15 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.711 -0.618 . . . . 0.0 109.722 179.538 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -70.03 -41.37 74.37 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.68 -0.637 . . . . 0.0 109.86 179.594 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.35 -32.63 73.44 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.704 -0.623 . . . . 0.0 109.888 179.669 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -73.07 -29.41 62.93 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.71 -0.619 . . . . 0.0 109.969 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -73.03 -33.13 65.53 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.627 -0.671 . . . . 0.0 109.966 179.863 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 61.3 t -71.23 -30.68 41.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.622 -0.674 . . . . 0.0 109.668 179.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.26 -30.45 68.57 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 120.123 -0.631 . . . . 0.0 109.891 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -76.16 -28.35 57.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.678 -0.639 . . . . 0.0 109.941 179.585 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -76.35 -34.16 58.96 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.564 -0.71 . . . . 0.0 110.016 179.771 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 85.1 mt -74.34 -29.97 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.673 -0.642 . . . . 0.0 109.653 179.676 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 26.3 m -72.52 -30.75 64.75 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.549 -0.72 . . . . 0.0 109.778 179.479 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.4 mtp -73.64 -44.64 56.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.625 -0.672 . . . . 0.0 109.688 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -72.08 -30.84 37.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.585 -0.697 . . . . 0.0 109.399 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -74.4 -29.33 61.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.625 -0.672 . . . . 0.0 109.747 179.358 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.23 -30.95 68.15 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.695 -0.628 . . . . 0.0 109.81 179.609 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -36.04 68.9 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.632 -0.667 . . . . 0.0 109.824 179.638 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 75.7 mt -71.57 -31.05 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.687 -0.633 . . . . 0.0 109.439 179.704 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 11.5 m -68.41 -37.89 80.75 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.633 -0.667 . . . . 0.0 109.474 179.519 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 39.2 mttm -74.85 -36.25 62.35 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 120.098 -0.641 . . . . 0.0 109.37 179.349 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.18 -31.32 65.81 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.167 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? -67.56 -39.75 84.92 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.664 -0.648 . . . . 0.0 109.489 179.407 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -31.74 73.0 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.689 -0.632 . . . . 0.0 109.317 179.284 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -63.48 -37.03 85.75 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.71 -0.619 . . . . 0.0 109.411 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -62.05 -29.8 70.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.775 -0.578 . . . . 0.0 109.66 179.458 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -61.69 -46.28 90.39 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.683 -0.635 . . . . 0.0 109.906 179.662 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -63.87 -40.8 97.4 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.752 -0.592 . . . . 0.0 109.863 179.751 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 21.9 tp -71.71 -32.68 68.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.632 -0.668 . . . . 0.0 109.814 179.692 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 . . . . . 0 N--CA 1.493 1.681 0 O-C-N 121.569 -0.707 . . . . 0.0 109.814 179.718 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.7 tp . . . . . 0 N--CA 1.495 1.811 0 CA-C-O 121.052 0.453 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -63.62 -32.19 73.59 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.653 -0.654 . . . . 0.0 110.081 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -67.8 -52.0 42.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.61 -0.681 . . . . 0.0 109.946 179.667 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.2 m -62.95 -31.92 73.12 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.701 -0.624 . . . . 0.0 109.484 179.504 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -65.46 -28.38 69.17 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.647 -0.658 . . . . 0.0 109.773 179.415 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -62.21 -42.41 99.27 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.572 -0.705 . . . . 0.0 109.935 179.814 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -75.5 -33.26 60.75 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.584 -0.698 . . . . 0.0 109.403 179.417 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -75.63 -26.52 18.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.212 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.8 tp -72.2 -34.04 68.08 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.576 -0.703 . . . . 0.0 109.825 179.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -66.21 -37.48 85.65 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.525 -0.735 . . . . 0.0 109.808 179.696 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.0 mt -64.88 -29.19 70.13 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.695 -0.628 . . . . 0.0 109.92 179.737 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -66.52 -34.37 77.76 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.58 -0.7 . . . . 0.0 109.897 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -76.61 -31.83 57.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.707 -0.621 . . . . 0.0 109.558 179.589 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -76.2 -30.32 57.95 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.811 -0.555 . . . . 0.0 109.716 179.712 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.1 tp -77.11 -31.99 56.21 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.628 -0.67 . . . . 0.0 109.661 179.581 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.98 -34.6 62.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.622 -0.674 . . . . 0.0 109.558 179.502 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.85 -29.99 67.36 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.784 179.452 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.03 -44.27 66.19 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.636 -0.665 . . . . 0.0 109.609 179.575 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -66.81 -30.85 71.14 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.588 -0.695 . . . . 0.0 109.664 179.445 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.8 -30.2 69.57 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.772 -0.58 . . . . 0.0 109.802 179.593 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.68 -44.26 86.79 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.643 -0.661 . . . . 0.0 109.805 179.765 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -62.83 -33.06 74.44 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.574 -0.704 . . . . 0.0 109.619 179.556 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -62.66 -31.26 72.1 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.703 -0.623 . . . . 0.0 109.962 179.772 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -70.9 -35.95 72.51 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.712 -0.617 . . . . 0.0 109.785 179.689 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.89 -30.52 71.52 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.684 -0.635 . . . . 0.0 109.671 179.611 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -62.43 -36.46 82.47 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.661 -0.649 . . . . 0.0 109.8 179.726 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mp -73.07 -29.51 63.01 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.756 -0.59 . . . . 0.0 109.965 179.656 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -85.86 -23.86 26.93 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.67 -0.644 . . . . 0.0 110.345 179.829 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.2 tp . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.471 -179.977 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.406 ' CD1' ' N ' ' B' ' 168' ' ' SER . 3.0 pp -140.76 -43.65 0.39 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.607 -0.937 . . . . 0.0 110.597 -179.77 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 168' ' ' SER . . . . . 0.406 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 33.3 t -153.21 16.55 0.55 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.344 -0.848 . . . . 0.0 111.141 179.851 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 10.6 tptm 49.84 26.37 1.9 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.133 -0.979 . . . . 0.0 111.12 179.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -154.58 -45.86 0.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.628 -0.67 . . . . 0.0 110.331 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.21 -31.04 62.47 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.436 179.8 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.5 tt -79.69 -29.77 40.88 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.671 -0.643 . . . . 0.0 109.606 179.182 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . 0.428 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.3 mp -75.83 -34.33 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 179.322 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -65.09 -32.73 74.58 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -75.56 -33.43 60.64 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.03 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -35.89 74.39 Favored 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.54 179.549 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -72.86 -30.5 64.04 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.651 -0.656 . . . . 0.0 109.81 179.708 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -29.63 64.47 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.641 -0.662 . . . . 0.0 109.888 179.7 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 65.5 t -69.76 -29.91 42.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.589 -0.694 . . . . 0.0 109.805 179.728 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -68.72 -30.4 69.03 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.61 -0.681 . . . . 0.0 109.841 179.819 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.04 -29.49 61.93 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.643 -0.661 . . . . 0.0 109.897 179.783 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -74.81 -37.45 62.32 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.685 -0.634 . . . . 0.0 109.949 179.699 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . 0.418 HG21 HD11 ' B' ' 183' ' ' ILE . 85.9 mt -72.08 -29.25 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.698 -0.626 . . . . 0.0 109.674 179.606 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 25.2 m -72.49 -31.76 65.64 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.56 -0.713 . . . . 0.0 109.847 179.555 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -42.52 65.74 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.592 -0.693 . . . . 0.0 109.796 179.631 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.69 -31.44 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.695 -0.628 . . . . 0.0 109.457 179.584 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -72.13 -29.75 64.37 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.63 -0.669 . . . . 0.0 109.818 179.579 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -30.86 69.54 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.569 -0.707 . . . . 0.0 109.803 179.739 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -75.59 -35.16 60.63 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.666 -0.646 . . . . 0.0 109.766 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.426 HG23 HD11 ' B' ' 190' ' ' ILE . 79.1 mt -73.39 -31.55 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.58 -0.7 . . . . 0.0 109.43 179.616 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.9 m -70.02 -35.94 74.7 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.7 -0.625 . . . . 0.0 109.327 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -75.2 -37.22 61.24 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.594 -0.691 . . . . 0.0 109.283 179.299 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.75 -30.96 66.16 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.677 -0.639 . . . . 0.0 109.436 179.196 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -68.83 -36.93 78.79 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.697 -0.627 . . . . 0.0 109.753 179.587 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -62.8 -30.28 71.35 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.584 -0.698 . . . . 0.0 109.628 179.571 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -39.33 94.45 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.692 -0.63 . . . . 0.0 109.621 179.443 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -62.69 -29.19 70.47 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.716 -0.615 . . . . 0.0 109.704 179.494 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -61.75 -38.12 86.8 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.665 -0.647 . . . . 0.0 109.771 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -68.01 -39.68 83.13 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.707 -0.62 . . . . 0.0 109.727 179.635 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 11.0 tp -74.07 -30.75 62.53 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.632 -0.667 . . . . 0.0 109.685 179.552 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 . . . . . 0 N--CA 1.494 1.732 0 O-C-N 121.604 -0.685 . . . . 0.0 109.852 179.544 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 tt . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 121.168 0.508 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -61.78 -33.25 73.77 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.546 -0.721 . . . . 0.0 110.063 179.911 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.29 -48.84 63.9 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.615 -0.678 . . . . 0.0 109.796 179.782 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.4 m -63.04 -33.53 75.63 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 120.266 -0.573 . . . . 0.0 109.599 179.523 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.89 -28.74 69.75 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.66 -0.65 . . . . 0.0 109.819 179.651 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -63.21 -36.78 84.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.601 -0.687 . . . . 0.0 110.056 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -75.0 -35.85 62.0 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.66 -0.65 . . . . 0.0 109.65 179.656 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.445 HG21 HD11 ' A' ' 69' ' ' ILE . 50.8 mm -72.82 -28.46 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.679 -0.638 . . . . 0.0 109.545 179.434 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.5 tp -73.18 -40.16 65.02 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.555 -0.716 . . . . 0.0 109.875 179.516 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.6 ttpp -69.36 -32.57 71.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.622 -0.674 . . . . 0.0 109.597 179.54 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -69.42 -36.28 76.55 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.721 -0.612 . . . . 0.0 109.719 179.55 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -64.54 -33.46 75.96 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.629 -0.67 . . . . 0.0 109.727 179.712 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -74.38 -31.74 62.48 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.673 -0.642 . . . . 0.0 109.448 179.505 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -68.62 -30.47 69.2 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.768 -0.582 . . . . 0.0 109.747 179.599 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.2 tp -73.0 -34.36 66.35 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.56 -0.713 . . . . 0.0 109.696 179.664 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.82 -36.71 64.99 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.253 -0.579 . . . . 0.0 109.611 179.51 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.54 -29.98 67.7 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.708 -0.62 . . . . 0.0 109.723 179.565 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.64 -44.01 58.02 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.67 -0.644 . . . . 0.0 109.624 179.607 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -68.68 -30.79 69.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.619 -0.675 . . . . 0.0 109.538 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.56 -29.56 68.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.602 -0.686 . . . . 0.0 109.703 179.527 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -67.42 -45.91 74.74 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.693 -0.629 . . . . 0.0 109.88 179.703 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.2 tttm -62.86 -29.98 71.16 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.529 -0.732 . . . . 0.0 109.682 179.466 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -64.18 -29.41 70.52 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.669 -0.644 . . . . 0.0 109.863 179.595 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.97 -39.22 79.58 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.521 -0.737 . . . . 0.0 109.797 179.74 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 mt -61.86 -31.06 71.3 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.544 -0.722 . . . . 0.0 109.873 179.727 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -61.84 -40.41 95.2 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.535 -0.728 . . . . 0.0 109.78 179.748 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.4 mt -72.5 -31.38 65.31 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.684 -0.635 . . . . 0.0 109.486 179.392 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -86.15 -14.76 43.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.756 -0.59 . . . . 0.0 110.634 179.533 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.7 tp . . . . . 0 N--CA 1.5 2.062 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.572 -179.895 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.353 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.411 ' CD1' ' N ' ' B' ' 168' ' ' SER . 2.6 pp -139.83 -45.98 0.44 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.614 -0.933 . . . . 0.0 110.458 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 168' ' ' SER . . . . . 0.411 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 37.4 t -156.82 12.38 0.25 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.343 -0.848 . . . . 0.0 111.931 -179.945 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 39.5 tptt 49.24 26.48 1.53 Allowed 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.085 -1.01 . . . . 0.0 111.197 -179.826 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -152.23 -47.77 0.1 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.761 -0.587 . . . . 0.0 109.647 179.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.29 -34.0 63.41 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.374 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.7 tt -75.18 -27.91 59.85 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.798 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.6 mm -68.54 -31.5 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.6 -0.688 . . . . 0.0 109.374 179.475 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -68.52 -30.11 68.84 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.746 -0.596 . . . . 0.0 109.789 179.657 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -74.94 -29.26 60.89 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.63 -0.669 . . . . 0.0 109.924 179.808 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.03 -24.34 55.19 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.641 -0.662 . . . . 0.0 110.243 179.889 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.75 -27.05 31.33 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.451 -0.781 . . . . 0.0 109.691 179.464 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -37.82 37.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.564 -0.71 . . . . 0.0 109.868 179.729 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 11.3 p -73.92 -25.62 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 C-N-CA 119.88 -0.728 . . . . 0.0 109.831 179.508 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -73.97 -30.5 62.55 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.564 -0.71 . . . . 0.0 109.688 179.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 12.3 mtp180 -72.73 -29.91 63.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.618 -0.676 . . . . 0.0 109.784 179.62 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.09 -31.0 69.42 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.598 -0.689 . . . . 0.0 109.872 179.705 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.9 mt -70.39 -31.39 46.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.696 -0.628 . . . . 0.0 109.629 179.695 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.33 -38.09 71.69 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.678 -0.639 . . . . 0.0 109.708 179.582 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 7.2 ttm -67.66 -39.34 84.54 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.612 -0.68 . . . . 0.0 109.746 179.621 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 70.1 t -72.34 -30.86 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.604 -0.685 . . . . 0.0 109.543 179.622 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -73.13 -28.44 62.25 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.654 -0.654 . . . . 0.0 109.977 179.664 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -72.66 -32.29 65.74 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.638 -0.664 . . . . 0.0 109.998 179.855 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -73.88 -38.88 64.26 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.715 -0.615 . . . . 0.0 109.823 179.807 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.452 HD11 HG23 ' B' ' 190' ' ' ILE . 79.4 mt -71.52 -31.52 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.468 179.577 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.0 m -67.91 -35.36 78.32 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.662 -0.649 . . . . 0.0 109.256 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.3 mmtp -77.92 -33.0 52.0 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 179.181 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.85 -31.5 61.67 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.135 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.54 -40.94 76.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.692 -0.63 . . . . 0.0 109.425 179.4 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -31.0 71.47 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.248 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -63.68 -36.5 84.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.666 -0.646 . . . . 0.0 109.375 179.245 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 31.8 tp60 -62.82 -30.45 71.49 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.793 -0.567 . . . . 0.0 109.692 179.504 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -61.28 -42.75 99.17 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.711 -0.618 . . . . 0.0 109.898 179.685 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -62.3 -43.02 99.8 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.707 -0.621 . . . . 0.0 109.84 179.719 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 14.0 tp -72.66 -30.27 64.13 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.659 -0.651 . . . . 0.0 109.656 179.46 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.608 -0.683 . . . . 0.0 109.889 179.548 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 121.08 0.466 . . . . 0.0 110.223 . . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -75.42 -36.72 60.76 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.573 -0.705 . . . . 0.0 110.113 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -74.49 -30.54 61.86 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.691 -0.63 . . . . 0.0 109.922 179.735 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 70.4 m -74.81 -29.26 61.03 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.617 -0.677 . . . . 0.0 109.832 179.505 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.0 mmtt -72.47 -26.9 61.98 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.612 -0.68 . . . . 0.0 110.219 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.27 -31.89 64.34 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.521 -0.737 . . . . 0.0 110.305 179.986 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.9 tp60 -75.91 -33.36 59.9 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.525 -0.734 . . . . 0.0 109.877 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.3 mt -74.16 -26.87 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.663 -0.648 . . . . 0.0 109.8 179.706 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 tt -74.93 -37.42 62.04 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.487 -0.758 . . . . 0.0 109.499 179.331 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -62.6 -29.91 70.95 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.646 -0.659 . . . . 0.0 109.521 179.202 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.72 -30.01 69.71 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.616 -0.678 . . . . 0.0 109.935 179.654 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -61.99 -38.17 87.58 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.647 -0.658 . . . . 0.0 109.776 179.763 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.96 -31.85 56.87 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.217 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.8 tttm -75.43 -31.56 60.39 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.82 -0.55 . . . . 0.0 109.781 179.561 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 46.9 tp -76.03 -33.36 59.64 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.592 -0.692 . . . . 0.0 109.709 179.633 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.2 tt -75.35 -35.37 61.15 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.728 -0.607 . . . . 0.0 109.473 179.314 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.51 68.19 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 120.228 -0.589 . . . . 0.0 109.656 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.75 -43.92 74.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.616 -0.678 . . . . 0.0 109.828 179.73 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -66.86 -31.12 71.52 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.586 -0.697 . . . . 0.0 109.623 179.586 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -68.05 -28.4 67.35 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.671 -0.643 . . . . 0.0 109.819 179.546 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.5 -43.27 85.76 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.57 -0.706 . . . . 0.0 109.954 179.858 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.8 ttpp -62.62 -30.13 71.12 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.593 -0.692 . . . . 0.0 109.822 179.818 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -64.48 -38.6 91.58 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.564 -0.71 . . . . 0.0 109.75 179.799 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -64.7 -29.43 70.42 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.707 -0.621 . . . . 0.0 109.708 179.59 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.1 -31.74 73.1 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.68 -0.637 . . . . 0.0 109.793 179.822 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -66.48 -45.68 78.85 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.663 -0.648 . . . . 0.0 110.143 179.998 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.8 mp -62.21 -32.71 73.4 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.69 -0.631 . . . . 0.0 109.899 179.777 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -86.71 -22.04 26.28 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.732 -0.605 . . . . 0.0 110.372 179.714 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.957 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.634 -179.907 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.408 ' CD1' ' N ' ' B' ' 168' ' ' SER . 2.8 pp -140.16 -44.92 0.42 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.59 -0.947 . . . . 0.0 110.582 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 168' ' ' SER . . . . . 0.408 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 10.5 t -153.81 15.12 0.49 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.354 -0.841 . . . . 0.0 111.35 -179.99 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.0 tptt 49.64 26.41 1.78 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.091 -1.006 . . . . 0.0 111.048 -179.835 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -152.5 -46.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.697 -0.627 . . . . 0.0 110.052 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.44 -34.62 63.24 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.215 179.45 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.5 tt -75.92 -27.32 57.57 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.864 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.8 mm -68.76 -32.02 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.627 -0.671 . . . . 0.0 109.336 179.331 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -72.98 -28.51 62.44 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.725 -0.609 . . . . 0.0 109.891 179.542 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.48 -29.52 64.92 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.682 -0.636 . . . . 0.0 109.994 179.818 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.28 -30.73 68.88 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.583 -0.698 . . . . 0.0 109.871 179.923 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -77.03 -31.41 56.27 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.707 -0.621 . . . . 0.0 109.718 179.67 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 5.2 tpm_? -74.51 -30.26 61.73 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.675 -0.641 . . . . 0.0 109.784 179.57 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 65.4 t -71.79 -29.78 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.685 -0.635 . . . . 0.0 109.735 179.66 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -78.26 -23.46 47.27 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.614 -0.679 . . . . 0.0 110.306 179.751 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.48 -28.41 37.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.437 -0.789 . . . . 0.0 109.087 179.448 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -72.0 -29.4 64.17 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.49 -0.756 . . . . 0.0 109.952 179.613 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 84.8 mt -73.83 -29.66 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.647 -0.658 . . . . 0.0 109.826 179.808 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 12.9 m -72.86 -30.14 63.74 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.622 -0.674 . . . . 0.0 109.96 179.787 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.7 mtt -73.99 -40.71 62.77 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.673 -0.642 . . . . 0.0 109.906 179.767 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.4 t -71.48 -30.37 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.621 -0.674 . . . . 0.0 109.577 179.718 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -73.34 -28.81 62.27 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.616 -0.677 . . . . 0.0 109.991 179.638 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.39 -28.51 63.04 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.575 -0.703 . . . . 0.0 110.085 179.806 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -30.66 58.54 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.565 -0.71 . . . . 0.0 110.082 179.969 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 76.4 mt -76.79 -31.13 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.583 -0.698 . . . . 0.0 109.789 179.834 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 14.7 m -73.78 -31.27 63.22 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.744 -0.597 . . . . 0.0 109.609 179.37 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 26.1 mmtm -76.63 -34.73 58.31 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.416 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -34.63 73.23 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.307 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -63.96 -45.15 90.42 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.331 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -71.31 -31.11 67.05 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.023 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -69.98 -35.03 74.11 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.222 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.11 -30.1 71.19 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.678 -0.639 . . . . 0.0 109.602 179.464 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -61.41 -43.05 99.53 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.742 -0.598 . . . . 0.0 109.92 179.695 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -61.97 -38.62 89.23 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.673 -0.642 . . . . 0.0 109.908 179.836 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.08 -29.79 60.75 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.607 -0.683 . . . . 0.0 109.766 179.554 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.73 0 O-C-N 121.634 -0.666 . . . . 0.0 109.802 179.676 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 121.13 0.49 . . . . 0.0 110.025 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -72.57 -34.62 67.59 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.552 -0.718 . . . . 0.0 109.917 179.798 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -76.46 -33.54 58.73 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.675 -0.641 . . . . 0.0 109.562 179.521 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.9 m -74.2 -30.8 62.37 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.732 -0.605 . . . . 0.0 109.428 179.351 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -69.76 -27.9 65.32 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.705 -0.622 . . . . 0.0 109.987 179.663 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.94 -37.69 75.93 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.473 -0.767 . . . . 0.0 110.15 179.982 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.13 -40.79 64.64 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.593 -0.692 . . . . 0.0 109.634 179.644 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.442 HD12 HG21 ' A' ' 69' ' ' ILE . 94.7 mt -68.29 -26.92 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.746 -0.596 . . . . 0.0 109.433 179.367 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.4 mt -67.09 -38.55 85.9 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.455 -0.778 . . . . 0.0 109.635 179.433 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -31.15 65.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.532 -0.73 . . . . 0.0 109.614 179.386 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.6 mt -71.69 -34.24 69.47 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.684 -0.635 . . . . 0.0 109.725 179.516 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -67.89 -30.83 70.27 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.587 -0.696 . . . . 0.0 109.746 179.652 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.31 -30.16 57.62 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.678 -0.639 . . . . 0.0 109.674 179.556 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -72.47 -29.15 63.39 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.712 -0.617 . . . . 0.0 109.884 179.667 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.1 tp -70.88 -35.56 72.41 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.515 -0.741 . . . . 0.0 109.838 179.817 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 87.9 mt -75.3 -32.73 61.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.696 -0.628 . . . . 0.0 109.664 179.606 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.83 -30.0 62.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.722 -0.611 . . . . 0.0 109.642 179.444 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.89 -39.7 69.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.677 -0.64 . . . . 0.0 109.694 179.65 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -71.82 -32.17 67.3 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.559 -0.713 . . . . 0.0 109.452 179.404 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -68.15 -29.77 68.74 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.79 -0.569 . . . . 0.0 109.544 179.348 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -62.84 -43.03 99.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.685 -0.635 . . . . 0.0 109.707 179.639 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -66.29 -32.27 73.57 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.554 -0.716 . . . . 0.0 109.484 179.48 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -63.74 -31.61 72.84 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.695 -0.628 . . . . 0.0 109.754 179.459 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -71.08 -35.11 71.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.642 -0.661 . . . . 0.0 109.619 179.566 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.84 -30.18 71.17 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.568 -0.707 . . . . 0.0 109.637 179.559 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -61.93 -40.16 94.56 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.69 -0.631 . . . . 0.0 109.766 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.81 -30.71 71.68 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.704 -0.623 . . . . 0.0 109.738 179.64 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -84.14 -17.41 40.16 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.634 -0.666 . . . . 0.0 110.572 179.696 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.1 tp . . . . . 0 N--CA 1.501 2.097 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.531 -179.939 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 2.9 pp -139.54 -44.2 0.45 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.647 -0.913 . . . . 0.0 110.534 -179.917 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 69.4 m -153.66 15.82 0.51 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.35 -0.843 . . . . 0.0 111.248 179.834 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 8.3 tptt 49.34 26.48 1.6 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.104 -0.998 . . . . 0.0 110.984 -179.789 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -151.65 -46.44 0.11 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.658 -0.651 . . . . 0.0 110.151 -179.926 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -36.55 65.59 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.177 179.609 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.9 tt -74.22 -28.17 61.13 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.894 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . 0.476 HG22 HD11 ' B' ' 173' ' ' ILE . 50.0 mm -66.89 -34.58 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.264 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -72.57 -29.07 63.21 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.611 179.257 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -70.63 -40.38 73.12 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.685 -0.634 . . . . 0.0 109.958 179.634 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.94 -30.77 71.82 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.655 -0.653 . . . . 0.0 109.749 179.87 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -75.45 -28.73 59.42 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.606 -0.684 . . . . 0.0 109.87 179.535 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -73.52 -31.31 63.62 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.563 -0.71 . . . . 0.0 110.139 179.893 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 57.6 t -72.26 -29.58 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.621 -0.674 . . . . 0.0 109.807 179.784 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -72.55 -30.25 64.28 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.55 -0.719 . . . . 0.0 109.928 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 1.3 tpt85 -74.68 -28.99 61.06 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.757 -0.589 . . . . 0.0 109.913 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -73.96 -33.01 63.73 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.612 -0.68 . . . . 0.0 110.018 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 67.5 mt -71.17 -29.23 35.5 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 O-C-N 121.644 -0.66 . . . . 0.0 109.727 179.742 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -34.58 75.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.621 -0.674 . . . . 0.0 109.783 179.651 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.0 ttt -67.99 -46.28 71.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.68 -0.638 . . . . 0.0 109.815 179.674 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 61.3 t -68.54 -30.27 46.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.552 -0.717 . . . . 0.0 109.573 179.66 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -73.7 -29.44 62.28 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.669 -0.644 . . . . 0.0 109.916 179.659 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -72.04 -30.58 65.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.638 -0.664 . . . . 0.0 109.987 179.819 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -40.25 61.99 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.652 -0.655 . . . . 0.0 109.694 179.662 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.443 HD13 HG22 ' B' ' 190' ' ' ILE . 79.7 mt -70.5 -29.78 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.677 -0.639 . . . . 0.0 109.656 179.572 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -34.59 73.79 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.619 -0.675 . . . . 0.0 109.553 179.515 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 55.7 mmtt -75.86 -35.86 59.78 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.677 -0.64 . . . . 0.0 109.654 179.666 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.14 -19.72 56.52 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.694 -0.628 . . . . 0.0 110.257 179.466 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 22.3 mmtt -84.73 -28.43 26.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.279 -0.888 . . . . 0.0 109.455 179.316 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.4 mmtm -78.61 -36.25 44.42 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.733 -0.604 . . . . 0.0 109.734 179.48 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.74 -28.06 63.41 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.494 179.41 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -68.64 -29.22 67.66 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.613 -0.679 . . . . 0.0 109.466 179.253 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -46.69 88.36 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.68 -0.638 . . . . 0.0 109.599 179.525 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -61.38 -35.89 78.75 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.738 -0.601 . . . . 0.0 109.881 179.669 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 6.8 tp -77.65 -31.86 52.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.574 -0.704 . . . . 0.0 109.601 179.412 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.717 -0.615 . . . . 0.0 109.681 179.447 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.8 tt . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 121.085 0.469 . . . . 0.0 110.026 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -67.58 -39.46 84.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.568 -0.708 . . . . 0.0 110.022 179.959 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -73.41 -30.82 63.5 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.675 -0.641 . . . . 0.0 109.753 179.624 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.2 m -74.44 -29.59 61.54 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.632 -0.667 . . . . 0.0 109.714 179.551 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -71.32 -28.12 63.87 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.655 -0.653 . . . . 0.0 110.047 179.711 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -70.21 -33.63 71.91 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.636 -0.665 . . . . 0.0 110.145 179.911 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -76.46 -34.36 58.7 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.651 -0.655 . . . . 0.0 109.857 179.669 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.5 mt -74.85 -27.87 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.667 -0.645 . . . . 0.0 109.683 179.498 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.3 tt -74.12 -29.72 61.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.587 -0.696 . . . . 0.0 109.982 179.666 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -74.74 -38.89 62.13 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.517 -0.739 . . . . 0.0 109.931 179.748 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.401 ' CD2' ' CD1' ' B' ' 193' ' ' LEU . 2.7 tp -70.9 -27.42 63.78 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.603 -0.686 . . . . 0.0 109.922 179.573 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -71.76 -33.25 68.49 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.541 -0.724 . . . . 0.0 109.553 179.371 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -74.31 -30.34 62.01 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.787 -0.571 . . . . 0.0 109.577 179.496 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.8 tttt -72.15 -37.7 69.33 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.586 -0.696 . . . . 0.0 109.824 179.685 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 24.1 tp -66.91 -31.16 71.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.56 -0.712 . . . . 0.0 109.967 179.703 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 tp -76.61 -34.14 58.39 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.683 -0.636 . . . . 0.0 109.849 179.75 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.65 -28.17 60.75 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 120.254 -0.578 . . . . 0.0 109.932 179.558 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.07 -36.12 59.11 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.581 -0.699 . . . . 0.0 109.81 179.751 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -72.78 -29.06 62.98 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.576 -0.702 . . . . 0.0 109.886 179.618 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -72.36 -28.25 62.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.658 -0.651 . . . . 0.0 109.965 179.564 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.24 -41.21 70.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.673 -0.642 . . . . 0.0 110.033 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 tttm -65.19 -29.52 70.34 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.511 -0.743 . . . . 0.0 109.753 179.742 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -64.79 -33.4 75.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.599 -0.688 . . . . 0.0 109.83 179.662 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -69.27 -29.87 67.85 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.649 -0.657 . . . . 0.0 109.784 179.687 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.15 -37.04 83.09 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.695 -0.628 . . . . 0.0 109.893 179.738 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -61.52 -33.49 73.91 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.585 -0.697 . . . . 0.0 109.97 179.921 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.3 mp -77.99 -29.37 49.6 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.602 -0.686 . . . . 0.0 109.804 179.686 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -88.7 -21.01 24.11 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.655 -0.653 . . . . 0.0 110.545 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.1 tp . . . . . 0 N--CA 1.5 2.049 0 CA-C-O 118.014 -0.994 . . . . 0.0 110.545 -179.931 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.41 HD13 ' OG ' ' B' ' 168' ' ' SER . 3.2 pp -143.08 -42.24 0.3 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.687 -0.89 . . . . 0.0 110.761 -179.527 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 168' ' ' SER . . . . . 0.41 ' OG ' HD13 ' B' ' 167' ' ' LEU . 53.1 m -153.07 17.85 0.57 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.32 -0.863 . . . . 0.0 111.039 179.999 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 4.8 tptm 49.73 26.63 1.92 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.244 -0.91 . . . . 0.0 110.884 -179.729 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -151.79 -46.77 0.11 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.7 -0.625 . . . . 0.0 110.133 -179.996 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.48 -30.79 61.98 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.798 -0.761 . . . . 0.0 109.294 179.512 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 2.9 tt -78.31 -30.43 48.27 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.727 -0.608 . . . . 0.0 109.583 179.176 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . 0.446 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 1.9 mp -73.03 -33.97 44.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.409 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.23 -32.55 72.82 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.955 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -73.02 -38.57 66.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.715 -0.615 . . . . 0.0 109.427 179.222 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.79 -30.63 71.65 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.696 -0.628 . . . . 0.0 109.645 179.637 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -78.89 -30.95 45.2 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.655 -0.653 . . . . 0.0 109.831 179.738 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.37 -29.89 47.68 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.744 -0.597 . . . . 0.0 109.684 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 68.4 t -76.3 -29.73 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.72 -0.613 . . . . 0.0 109.58 179.57 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -73.43 -30.59 63.32 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.523 -0.735 . . . . 0.0 109.915 179.833 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.21 -29.3 60.27 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.674 -0.642 . . . . 0.0 109.942 179.714 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -75.93 -36.7 59.27 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.634 -0.666 . . . . 0.0 109.914 179.831 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 72.8 mt -71.28 -29.92 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.705 -0.622 . . . . 0.0 109.511 179.663 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 86.0 m -72.21 -39.32 68.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.61 -0.681 . . . . 0.0 109.743 179.594 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 mtp -72.53 -37.7 68.26 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.635 -0.665 . . . . 0.0 109.495 179.525 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 66.5 t -72.56 -34.79 49.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 179.283 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -64.87 -33.27 75.61 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.748 -0.595 . . . . 0.0 109.526 179.485 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -67.39 -26.1 66.28 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.677 -0.639 . . . . 0.0 109.933 179.562 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -76.31 -25.34 54.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.52 -0.737 . . . . 0.0 110.361 179.871 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.477 HD11 HG23 ' B' ' 190' ' ' ILE . 25.6 mm -80.38 -35.95 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.484 -0.76 . . . . 0.0 109.398 -179.945 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 14.9 m -76.01 -29.38 58.12 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.755 -0.591 . . . . 0.0 109.839 179.595 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 7.3 mmmt -77.51 -31.58 53.56 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.624 -0.672 . . . . 0.0 109.786 179.708 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . 0.401 ' CD1' ' CD2' ' A' ' 72' ' ' LEU . 0.4 OUTLIER -75.68 -29.71 59.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.546 -0.721 . . . . 0.0 109.49 179.491 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -34.52 71.07 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.63 -0.669 . . . . 0.0 109.762 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -71.78 -31.23 66.39 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.676 -0.64 . . . . 0.0 109.71 179.561 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -68.4 -31.51 70.91 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.674 -0.641 . . . . 0.0 109.576 179.509 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -66.7 -30.43 70.67 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.69 -0.631 . . . . 0.0 109.734 179.533 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -62.65 -40.79 98.13 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.651 -0.656 . . . . 0.0 109.794 179.706 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -62.25 -39.73 93.83 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.779 179.681 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 8.7 tp -73.59 -33.21 64.51 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.563 -0.71 . . . . 0.0 109.71 179.473 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.74 0 O-C-N 121.72 -0.612 . . . . 0.0 109.753 179.553 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 121.128 0.489 . . . . 0.0 109.813 . . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.92 -32.65 74.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.594 -0.691 . . . . 0.0 109.934 179.81 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -75.48 -36.98 60.52 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.598 -0.689 . . . . 0.0 109.771 179.68 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 32.3 m -72.91 -30.57 64.02 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.694 -0.628 . . . . 0.0 109.557 179.438 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.04 -28.2 65.28 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.689 -0.632 . . . . 0.0 109.803 179.514 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -66.65 -37.92 85.8 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.585 -0.697 . . . . 0.0 110.081 179.926 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.46 -40.33 67.07 Favored 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.64 179.605 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.1 mt -68.41 -26.84 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.793 -0.567 . . . . 0.0 109.502 179.457 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.67 -37.42 79.6 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.533 -0.729 . . . . 0.0 109.796 179.563 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -68.39 -31.6 71.07 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.588 -0.695 . . . . 0.0 109.846 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.9 mt -68.65 -29.37 67.84 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.655 -0.653 . . . . 0.0 110.039 179.84 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -70.88 -31.16 67.74 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.595 -0.691 . . . . 0.0 109.958 179.824 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -78.12 -31.35 49.89 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.554 -0.716 . . . . 0.0 109.712 179.572 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -74.72 -29.45 61.19 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.707 -0.621 . . . . 0.0 109.771 179.506 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.8 tp -72.29 -34.77 68.41 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.626 -0.671 . . . . 0.0 109.883 179.756 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.8 mt -75.18 -36.45 61.47 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.643 -0.66 . . . . 0.0 109.426 179.513 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.12 -28.45 67.33 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.082 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.1 tp -67.9 -48.16 66.79 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.72 -0.613 . . . . 0.0 110.054 179.698 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -63.06 -25.91 68.6 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.612 -0.68 . . . . 0.0 110.366 179.868 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.57 -29.96 63.99 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.426 -0.796 . . . . 0.0 110.148 179.88 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -76.76 -46.9 23.41 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.591 -0.693 . . . . 0.0 109.603 179.555 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -65.67 -24.34 66.99 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.647 -0.821 . . . . 0.0 108.815 178.686 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -60.82 -26.57 67.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.428 -0.795 . . . . 0.0 109.266 178.403 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.3 tp60 -59.15 -38.92 80.84 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.512 -0.743 . . . . 0.0 109.733 179.191 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.69 -34.33 76.69 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 179.137 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.424 ' CG ' ' HE1' ' B' ' 176' ' ' MET . 2.4 m-85 -61.84 -29.82 70.43 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.741 -0.599 . . . . 0.0 109.818 179.524 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.07 -28.08 65.14 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.657 -0.652 . . . . 0.0 109.993 179.673 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -95.02 -7.24 40.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.623 -0.673 . . . . 0.0 111.063 179.946 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.034 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.418 -179.969 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.412 ' CD1' ' CB ' ' B' ' 171' ' ' GLU . 1.3 pp -50.92 -47.14 61.01 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.848 -0.795 . . . . 0.0 111.594 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.6 t -152.96 15.99 0.56 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.228 -0.92 . . . . 0.0 111.278 179.982 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 6.9 tptm 49.7 26.33 1.8 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.179 -0.951 . . . . 0.0 110.985 -179.893 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -151.71 -46.83 0.11 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.659 -0.65 . . . . 0.0 109.974 -179.944 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . 0.412 ' CB ' ' CD1' ' B' ' 167' ' ' LEU . 1.9 mt-10 -75.08 -32.21 61.41 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 119.881 -0.728 . . . . 0.0 109.182 179.407 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.5 tt -78.45 -28.23 46.54 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 178.886 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 49.6 mm -71.69 -32.28 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.655 -0.653 . . . . 0.0 109.433 179.52 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 65.5 mm-40 -68.2 -32.79 73.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.655 -0.653 . . . . 0.0 109.671 179.541 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 -63.52 -46.04 87.9 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.482 179.384 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.424 ' HE1' ' CG ' ' A' ' 87' ' ' PHE . 8.2 mtt -52.85 -31.86 41.56 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.665 -0.647 . . . . 0.0 110.73 179.765 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -68.8 -52.95 24.67 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.683 -0.635 . . . . 0.0 109.75 179.839 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -28.19 67.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.736 -0.603 . . . . 0.0 109.78 179.48 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 94.3 t -77.88 -32.08 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.636 -0.665 . . . . 0.0 109.752 179.703 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -74.92 -31.38 61.52 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.562 -0.711 . . . . 0.0 109.64 179.553 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -25.27 64.18 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.724 -0.61 . . . . 0.0 109.86 179.345 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -68.62 -42.25 78.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.534 -0.729 . . . . 0.0 110.419 179.994 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 69.7 mt -66.94 -28.91 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.429 179.697 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 24.5 m -63.55 -32.05 73.39 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.608 -0.682 . . . . 0.0 109.623 179.43 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 1.2 ttt -68.52 -51.02 47.71 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.59 -0.694 . . . . 0.0 109.783 179.62 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.8 t -68.73 -31.61 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.546 -0.721 . . . . 0.0 109.425 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -75.3 -28.34 59.66 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.735 -0.603 . . . . 0.0 109.895 179.584 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -74.6 -27.87 60.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.605 -0.685 . . . . 0.0 110.085 179.76 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -74.23 -33.28 63.31 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.597 -0.689 . . . . 0.0 109.967 179.852 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 72.1 mt -73.26 -31.08 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.647 -0.658 . . . . 0.0 109.495 179.769 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.23 -31.81 71.57 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.716 -0.615 . . . . 0.0 109.48 179.377 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 23.7 mmtt -77.25 -34.1 55.87 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.678 -0.639 . . . . 0.0 109.511 179.381 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.72 -31.49 65.01 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.294 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.9 tptp -66.5 -40.83 89.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.623 -0.673 . . . . 0.0 109.372 179.323 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.92 -30.41 70.55 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.224 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -63.35 -36.93 85.34 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.319 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -63.24 -30.64 71.75 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.692 -0.63 . . . . 0.0 109.519 179.464 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -61.32 -38.52 87.18 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.725 -0.609 . . . . 0.0 109.785 179.684 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.85 -39.83 93.21 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.719 -0.613 . . . . 0.0 109.862 179.772 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.8 tp -72.76 -30.7 64.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.658 -0.651 . . . . 0.0 109.831 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.495 1.79 0 O-C-N 121.61 -0.682 . . . . 0.0 109.782 179.639 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 tp . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 121.063 0.459 . . . . 0.0 110.066 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -66.27 -29.49 69.73 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.575 -0.703 . . . . 0.0 110.162 179.997 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -72.72 -44.61 61.48 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.589 -0.694 . . . . 0.0 109.886 179.786 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.6 m -65.27 -30.27 71.12 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.646 -0.659 . . . . 0.0 109.648 179.51 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -66.4 -28.22 68.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.704 -0.623 . . . . 0.0 109.945 179.608 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.15 -44.01 89.98 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.614 -0.679 . . . . 0.0 110.101 179.938 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -39.05 72.7 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.651 -0.656 . . . . 0.0 109.642 179.739 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.404 HD12 HG21 ' A' ' 69' ' ' ILE . 81.5 mt -71.03 -25.89 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.719 -0.613 . . . . 0.0 109.634 179.42 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.2 tt -72.32 -34.42 68.06 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.534 -0.728 . . . . 0.0 110.001 179.755 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp -67.3 -36.63 81.9 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.491 -0.755 . . . . 0.0 109.91 179.806 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.3 mt -64.74 -28.29 69.49 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.669 -0.645 . . . . 0.0 109.944 179.748 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -66.08 -38.3 87.95 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.593 -0.692 . . . . 0.0 110.13 179.962 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.96 -31.08 61.39 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.611 -0.681 . . . . 0.0 109.743 179.654 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -77.9 -30.41 50.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.618 -0.676 . . . . 0.0 109.635 179.691 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -78.78 -30.87 45.82 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.62 -0.675 . . . . 0.0 109.725 179.604 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.5 mt -77.28 -30.54 54.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.642 -0.661 . . . . 0.0 109.753 179.584 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.01 -28.4 60.51 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.667 -0.646 . . . . 0.0 110.032 179.638 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.65 -36.06 57.61 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.596 -0.69 . . . . 0.0 109.875 179.796 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -74.72 -27.38 60.35 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.616 -0.677 . . . . 0.0 109.993 179.731 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -76.53 -27.7 56.05 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.565 -0.709 . . . . 0.0 109.782 179.597 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.71 -41.95 59.24 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.663 -0.648 . . . . 0.0 109.886 179.63 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.4 ptmt -65.65 -26.31 67.74 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.758 -0.777 . . . . 0.0 109.672 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -63.8 -29.42 70.63 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.572 -0.705 . . . . 0.0 109.621 179.258 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -63.97 -35.43 80.67 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.6 -0.687 . . . . 0.0 109.877 179.717 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.01 -33.11 75.05 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.6 -0.688 . . . . 0.0 109.605 179.723 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.421 ' CG ' ' HE3' ' B' ' 176' ' ' MET . 6.7 m-85 -62.77 -29.27 70.57 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.609 -0.682 . . . . 0.0 110.049 179.782 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.35 -29.09 59.83 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.589 -0.695 . . . . 0.0 110.14 179.834 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -87.57 -26.66 23.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.653 -0.654 . . . . 0.0 110.371 179.894 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.4 tp . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.21 -179.978 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' B' B ' 167' ' ' LEU . . . . . 0.407 ' CD1' ' N ' ' B' ' 168' ' ' SER . 3.0 pp -141.46 -42.94 0.36 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.567 -0.961 . . . . 0.0 110.724 -179.735 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 168' ' ' SER . . . . . 0.407 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 48.1 t -153.34 16.97 0.54 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.317 -0.864 . . . . 0.0 111.234 179.934 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.3 tptt 50.03 26.26 1.99 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.099 -1.001 . . . . 0.0 111.084 -179.954 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -154.3 -45.52 0.09 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.6 -0.687 . . . . 0.0 110.409 179.982 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.48 -30.75 61.97 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.899 -0.72 . . . . 0.0 109.434 179.691 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 3.3 tt -79.29 -29.56 42.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.733 -0.605 . . . . 0.0 109.601 179.18 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 173' ' ' ILE . . . . . 0.426 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.5 mp -77.56 -34.55 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.405 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -65.27 -33.61 76.39 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.832 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -75.58 -36.21 60.4 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.976 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 176' ' ' MET . . . . . 0.421 ' HE3' ' CG ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -68.05 -30.71 69.99 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.678 -0.638 . . . . 0.0 109.804 179.437 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -75.34 -34.51 61.2 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.644 -0.66 . . . . 0.0 109.677 179.655 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -30.05 67.99 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.689 -0.632 . . . . 0.0 109.63 179.488 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 82.4 t -66.28 -32.14 56.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.695 -0.628 . . . . 0.0 109.699 179.711 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . 0.415 ' O ' ' OG1' ' B' ' 184' ' ' THR . 1.9 m-20 -65.56 -43.18 90.63 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.7 -0.625 . . . . 0.0 109.93 179.882 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -34.07 75.59 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.733 -0.605 . . . . 0.0 109.97 179.8 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -71.16 -45.91 62.51 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.521 -0.737 . . . . 0.0 109.855 179.842 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 78.0 mt -69.73 -29.45 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.649 -0.657 . . . . 0.0 109.38 179.513 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 184' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 87.7 m -70.22 -32.49 70.4 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.633 -0.667 . . . . 0.0 109.43 179.343 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.4 ttm -70.22 -48.33 57.49 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.623 -0.673 . . . . 0.0 109.754 179.511 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.8 t -69.84 -31.32 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.551 -0.718 . . . . 0.0 109.376 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -73.99 -29.79 62.14 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.705 -0.622 . . . . 0.0 109.757 179.522 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.24 -30.7 67.83 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.625 -0.672 . . . . 0.0 109.827 179.54 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -37.65 67.64 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.673 -0.642 . . . . 0.0 109.621 179.652 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 190' ' ' ILE . . . . . 0.421 HG23 HD12 ' B' ' 190' ' ' ILE . 82.1 mt -69.26 -31.43 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.623 -0.673 . . . . 0.0 109.495 179.542 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.13 -41.59 85.88 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.659 -0.651 . . . . 0.0 109.617 179.55 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -70.69 -35.87 72.99 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.635 -0.665 . . . . 0.0 109.583 179.528 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.71 -31.32 68.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.673 -0.642 . . . . 0.0 109.501 179.399 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.4 tptp -69.14 -41.13 77.72 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.637 -0.664 . . . . 0.0 109.699 179.482 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -62.79 -31.69 72.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.665 -0.647 . . . . 0.0 109.508 179.518 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -37.16 86.17 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.696 -0.628 . . . . 0.0 109.382 179.256 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -62.72 -29.6 70.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.734 -0.604 . . . . 0.0 109.642 179.496 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.76 -43.61 98.52 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.632 -0.667 . . . . 0.0 109.741 179.695 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -63.09 -44.71 94.96 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.712 -0.618 . . . . 0.0 109.853 179.796 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 18.4 tp -71.6 -31.28 66.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.589 -0.694 . . . . 0.0 109.809 179.59 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 . . . . . 0 N--CA 1.493 1.696 0 O-C-N 121.622 -0.674 . . . . 0.0 109.834 179.595 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.1 0.476 . . . . 0.0 110.18 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.4 mttm -112.57 -172.76 2.11 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.57 -0.706 . . . . 0.0 110.196 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 52.7 34.74 16.7 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.402 -0.811 . . . . 0.0 110.77 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 15.3 ttm -109.87 -26.51 9.75 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.601 -0.687 . . . . 0.0 110.453 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -60.13 -31.72 70.33 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.502 -0.748 . . . . 0.0 110.235 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -73.81 -29.79 62.35 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.648 -0.658 . . . . 0.0 109.84 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -71.61 -27.86 63.4 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.689 -0.632 . . . . 0.0 110.011 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 mmt -70.38 -33.58 71.58 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.552 -0.717 . . . . 0.0 110.165 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.6 m -72.88 -30.72 64.18 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.602 -0.686 . . . . 0.0 109.905 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.3 tt -70.75 -28.67 64.87 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.679 -0.638 . . . . 0.0 109.882 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -67.47 -29.93 69.5 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.544 -0.722 . . . . 0.0 109.955 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -74.94 -35.59 62.15 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.651 -0.656 . . . . 0.0 109.943 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 88.3 m -71.29 -30.81 66.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.763 -0.586 . . . . 0.0 109.682 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -68.74 -28.71 67.06 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.618 -0.676 . . . . 0.0 109.899 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -66.86 -32.36 73.58 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.585 -0.697 . . . . 0.0 110.022 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -78.18 -31.34 49.53 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.644 -0.66 . . . . 0.0 109.695 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.4 mt -77.28 -29.67 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.663 -0.648 . . . . 0.0 109.539 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.97 -33.35 63.82 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.639 -0.663 . . . . 0.0 109.651 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.9 tptt -66.31 -30.7 71.16 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.655 -0.653 . . . . 0.0 109.563 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 10.4 mt -62.38 -31.24 71.87 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.669 -0.644 . . . . 0.0 109.856 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -63.01 -36.59 84.06 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.57 -0.707 . . . . 0.0 109.787 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -76.36 -31.52 58.11 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.694 -0.629 . . . . 0.0 109.576 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -77.07 -30.49 55.52 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.702 -0.624 . . . . 0.0 109.671 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 41.5 tp -77.91 -32.8 51.94 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.614 -0.679 . . . . 0.0 109.633 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.3 mt -75.18 -31.63 61.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.706 -0.621 . . . . 0.0 109.565 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.66 -30.41 67.01 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.645 -0.66 . . . . 0.0 109.731 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.16 -41.81 80.98 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.72 -0.613 . . . . 0.0 109.641 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -68.15 -31.14 70.49 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.609 -0.682 . . . . 0.0 109.674 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.91 -30.53 69.88 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.657 -0.652 . . . . 0.0 109.62 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.07 -45.84 83.62 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.672 -0.642 . . . . 0.0 109.749 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.3 tttm -64.34 -32.2 73.71 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.568 -0.707 . . . . 0.0 109.45 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.78 -30.13 71.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.722 -0.611 . . . . 0.0 109.844 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.7 tm0? -65.99 -33.58 76.13 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.601 -0.687 . . . . 0.0 109.736 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.8 mt -65.76 -32.32 73.79 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.631 -0.668 . . . . 0.0 109.661 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.404 ' CD1' ' HE3' ' B' ' 176' ' ' MET . 1.9 m-85 -61.28 -35.83 78.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.654 -0.654 . . . . 0.0 109.83 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -61.73 -29.94 70.45 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.74 -0.6 . . . . 0.0 109.832 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -101.71 -19.6 15.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.676 -0.64 . . . . 0.0 110.553 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.401 ' CD1' ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.047 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.552 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -144.88 -67.47 0.32 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.61 -0.935 . . . . 0.0 110.751 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 11.0 t -145.39 16.68 1.5 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.145 -0.972 . . . . 0.0 110.919 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.3 tptt 50.68 25.76 2.21 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.171 -0.955 . . . . 0.0 110.684 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -148.93 -46.77 0.14 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.655 -0.653 . . . . 0.0 109.472 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.9 -33.17 73.32 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 119.95 -0.7 . . . . 0.0 109.262 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.5 tt -77.87 -27.75 49.81 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . 0.43 HD13 HG23 ' B' ' 173' ' ' ILE . 49.1 mm -71.14 -31.08 43.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.632 -0.667 . . . . 0.0 109.399 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -70.35 -29.49 66.18 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.689 -0.632 . . . . 0.0 109.984 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -69.29 -29.08 66.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.605 -0.684 . . . . 0.0 110.081 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.404 ' HE3' ' CD1' ' A' ' 87' ' ' PHE . 0.4 OUTLIER -71.46 -29.34 64.73 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.527 -0.733 . . . . 0.0 110.045 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -75.6 -29.96 59.44 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.603 -0.686 . . . . 0.0 110.168 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.4 ttp180 -76.11 -32.21 59.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.619 -0.675 . . . . 0.0 109.95 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 72.1 t -74.08 -29.86 26.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.684 -0.635 . . . . 0.0 109.652 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -71.76 -28.59 63.75 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.667 -0.645 . . . . 0.0 110.022 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 19.4 mtp180 -74.15 -28.39 61.29 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.568 -0.708 . . . . 0.0 110.077 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -73.82 -29.12 61.97 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.588 -0.695 . . . . 0.0 110.128 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . 0.451 HG23 HD12 ' B' ' 183' ' ' ILE . 85.0 mt -72.53 -27.81 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.587 -0.696 . . . . 0.0 109.894 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.2 m -71.2 -31.01 67.09 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.56 -0.712 . . . . 0.0 109.937 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.3 ttp -71.7 -44.08 64.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.637 -0.664 . . . . 0.0 109.934 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.0 t -71.28 -31.24 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.615 -0.678 . . . . 0.0 109.554 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -75.21 -29.11 60.21 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.717 -0.614 . . . . 0.0 109.779 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . 0.4 ' O ' ' OG ' ' B' ' 191' ' ' SER . 11.5 tp-100 -73.27 -28.5 62.16 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.654 -0.654 . . . . 0.0 110.068 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -32.49 64.13 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.572 -0.705 . . . . 0.0 109.962 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.403 HG21 HD12 ' B' ' 190' ' ' ILE . 77.0 mt -73.41 -31.67 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.677 -0.64 . . . . 0.0 109.776 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 191' ' ' SER . . . . . 0.4 ' OG ' ' O ' ' B' ' 188' ' ' GLN . 19.0 p -69.9 -35.61 74.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.649 -0.657 . . . . 0.0 109.636 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -76.91 -32.28 57.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.659 -0.651 . . . . 0.0 109.431 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.89 -30.8 62.81 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.685 -0.634 . . . . 0.0 109.374 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -67.76 -40.32 84.09 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.647 -0.658 . . . . 0.0 109.514 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -68.48 -33.11 73.58 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.634 -0.666 . . . . 0.0 109.344 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 1.5 ttpp -63.91 -34.54 78.2 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -29.87 71.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.753 -0.592 . . . . 0.0 109.469 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -47.65 85.36 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.652 -0.655 . . . . 0.0 109.74 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -62.41 -41.49 98.73 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.198 -0.601 . . . . 0.0 109.925 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.58 -36.31 68.15 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.619 -0.676 . . . . 0.0 109.733 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -76.58 -29.64 56.68 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.642 -0.661 . . . . 0.0 109.826 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -79.88 -29.4 39.93 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.665 -0.647 . . . . 0.0 109.768 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -79.74 -28.59 40.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.625 -0.672 . . . . 0.0 109.843 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -79.42 -25.07 42.11 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.562 -0.711 . . . . 0.0 110.242 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.87 -26.16 27.53 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.435 -0.791 . . . . 0.0 110.21 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.13 148.64 77.7 Favored Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.543 -0.723 . . . . 0.0 110.233 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.318 -1.074 0 O-C-N 123.367 1.193 . . . . 0.0 110.445 -179.979 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.007 0.432 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -121.45 168.71 11.38 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.568 -0.708 . . . . 0.0 110.29 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -93.27 -29.32 15.74 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.53 -0.731 . . . . 0.0 110.172 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.2 mtt -76.22 -28.0 57.03 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.643 -0.661 . . . . 0.0 110.266 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -60.74 -27.22 67.78 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.621 -0.675 . . . . 0.0 110.352 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -71.14 -32.47 69.0 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.52 -0.738 . . . . 0.0 110.129 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 35.0 ttm105 -75.44 -30.29 59.96 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.655 -0.653 . . . . 0.0 109.905 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 32.6 mtt -74.15 -30.01 62.07 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.636 -0.665 . . . . 0.0 109.806 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.2 m -70.14 -28.66 65.53 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.653 -0.654 . . . . 0.0 109.903 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.8 tp -68.11 -29.52 68.46 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.652 -0.655 . . . . 0.0 109.987 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -76.64 -32.69 58.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.605 -0.684 . . . . 0.0 110.089 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -76.83 -30.7 56.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.598 -0.689 . . . . 0.0 109.771 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.3 m -74.53 -29.98 61.59 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.727 -0.608 . . . . 0.0 109.704 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -70.41 -27.04 63.98 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.611 -0.681 . . . . 0.0 109.997 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -69.37 -33.22 72.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.581 -0.7 . . . . 0.0 110.189 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -76.11 -36.05 59.05 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.581 -0.699 . . . . 0.0 109.711 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 82.5 mt -71.79 -27.19 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.737 -0.602 . . . . 0.0 109.533 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.4 -37.37 77.46 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.599 -0.688 . . . . 0.0 109.717 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -71.06 -30.38 66.51 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.594 -0.691 . . . . 0.0 109.781 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.32 -27.08 62.2 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.639 -0.663 . . . . 0.0 110.067 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -74.16 -32.82 63.27 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.493 -0.754 . . . . 0.0 109.622 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.91 -31.69 63.22 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.733 -0.604 . . . . 0.0 109.392 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -67.82 -30.8 70.29 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.734 -0.604 . . . . 0.0 109.666 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.1 tp -74.38 -30.02 61.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.633 -0.667 . . . . 0.0 109.851 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.89 -33.41 62.05 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.625 -0.672 . . . . 0.0 109.739 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.4 -29.43 66.06 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.709 -0.619 . . . . 0.0 109.858 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.78 -42.41 67.17 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.715 -0.616 . . . . 0.0 109.761 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -66.88 -30.52 70.71 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.567 -0.708 . . . . 0.0 109.696 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -67.17 -29.42 69.1 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.706 -0.621 . . . . 0.0 109.803 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -47.64 71.05 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.598 -0.688 . . . . 0.0 109.614 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -62.78 -28.92 70.32 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.558 -0.714 . . . . 0.0 109.67 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -65.14 -29.54 70.39 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.654 -0.654 . . . . 0.0 109.996 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -65.36 -41.46 93.8 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.612 -0.68 . . . . 0.0 109.693 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.5 mt -61.77 -29.22 69.99 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.609 -0.682 . . . . 0.0 109.868 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.22 -35.72 79.78 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.594 -0.691 . . . . 0.0 109.636 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.4 mt -77.46 -29.59 52.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.739 -0.601 . . . . 0.0 109.789 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -90.04 -14.52 33.7 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.671 -0.643 . . . . 0.0 110.807 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.0 tp . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.515 -179.876 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.402 ' CD1' ' CB ' ' B' ' 171' ' ' GLU . 0.0 OUTLIER -145.75 -75.52 0.21 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.621 -0.929 . . . . 0.0 110.492 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 3.9 t -138.0 19.51 2.82 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.124 -0.985 . . . . 0.0 110.924 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 18.5 tptm 50.82 25.91 2.36 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.134 -0.979 . . . . 0.0 110.67 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -150.73 -45.84 0.12 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.715 -0.615 . . . . 0.0 109.661 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . 0.402 ' CB ' ' CD1' ' B' ' 167' ' ' LEU . 1.4 mp0 -68.23 -30.26 69.28 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.671 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 2.0 tt -81.51 -30.46 33.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.648 -0.657 . . . . 0.0 109.483 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . 0.438 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.1 mp -74.13 -30.88 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -63.97 -32.73 74.37 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -76.18 -31.3 58.44 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -29.01 67.0 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.664 -0.647 . . . . 0.0 109.83 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -75.04 -29.65 60.84 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.568 -0.708 . . . . 0.0 110.243 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -75.25 -29.73 60.28 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.59 -0.694 . . . . 0.0 110.043 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 60.7 t -76.19 -28.63 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.629 -0.669 . . . . 0.0 109.837 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -75.77 -28.63 58.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.631 -0.668 . . . . 0.0 110.07 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -28.49 59.89 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.588 -0.695 . . . . 0.0 110.117 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.7 -30.66 61.62 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.618 -0.676 . . . . 0.0 110.138 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 75.7 mt -73.42 -30.11 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.633 -0.667 . . . . 0.0 109.749 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.9 -32.45 69.41 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.669 -0.645 . . . . 0.0 109.713 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 5.5 mtp -71.99 -46.09 58.58 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.617 -0.677 . . . . 0.0 109.693 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -66.97 -31.31 52.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 119.989 -0.685 . . . . 0.0 109.286 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -66.24 -33.99 77.0 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.756 -0.59 . . . . 0.0 110.027 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 65.8 mm-40 -66.58 -27.53 67.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.582 -0.699 . . . . 0.0 110.0 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -23.32 57.7 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.586 -0.696 . . . . 0.0 110.408 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 33.8 mm -79.79 -36.8 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.369 -0.832 . . . . 0.0 109.55 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -30.53 63.95 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.735 -0.603 . . . . 0.0 109.736 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -75.33 -38.75 60.05 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.649 -0.657 . . . . 0.0 109.783 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.0 -30.23 65.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.578 -0.701 . . . . 0.0 109.348 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -67.03 -37.69 84.56 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.351 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 24.4 tptt -66.43 -30.96 71.44 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.63 -0.669 . . . . 0.0 109.361 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -62.96 -37.57 87.61 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.702 -0.624 . . . . 0.0 109.464 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -62.49 -30.65 71.42 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.78 -0.575 . . . . 0.0 109.609 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -61.3 -41.31 96.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.705 -0.622 . . . . 0.0 110.016 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -63.28 -39.93 95.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.735 -0.603 . . . . 0.0 109.891 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.3 tp -72.83 -30.76 64.28 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.639 -0.663 . . . . 0.0 109.833 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -77.08 -30.65 55.54 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.586 -0.696 . . . . 0.0 109.879 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -77.59 -29.45 51.99 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.656 -0.652 . . . . 0.0 109.885 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -78.02 -28.93 49.24 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.605 -0.685 . . . . 0.0 110.008 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.58 -25.44 45.28 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.607 -0.683 . . . . 0.0 110.201 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.19 -23.56 30.5 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.501 -0.749 . . . . 0.0 110.438 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 1.6 mttp -57.85 153.77 30.95 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 121.364 -0.835 . . . . 0.0 110.415 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo . . . . . 0 C--N 1.317 -1.103 0 O-C-N 123.464 1.244 . . . . 0.0 110.386 179.947 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.3 mtmm . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.146 0.498 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.2 ttmt -87.29 -162.57 0.81 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.524 -0.735 . . . . 0.0 110.113 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 52.56 24.71 3.21 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.38 -0.825 . . . . 0.0 110.867 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.9 mtt -133.54 22.1 3.98 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.563 -0.711 . . . . 0.0 110.388 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -85.0 -29.16 25.24 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.396 -0.815 . . . . 0.0 110.069 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -66.63 -32.25 73.46 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.684 -0.635 . . . . 0.0 109.931 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 -73.72 -36.4 65.21 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.595 -0.691 . . . . 0.0 109.846 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.4 mtt -69.55 -30.5 68.32 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.715 -0.616 . . . . 0.0 109.6 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.6 m -65.88 -30.31 70.89 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.718 -0.614 . . . . 0.0 109.723 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.1 tp -62.4 -29.45 70.5 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.667 -0.645 . . . . 0.0 110.015 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.24 -29.56 64.04 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.602 -0.686 . . . . 0.0 110.049 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -75.4 -33.27 60.96 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.592 -0.693 . . . . 0.0 109.892 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.7 m -71.18 -30.49 66.49 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.649 -0.657 . . . . 0.0 109.713 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -68.2 -29.14 67.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.607 -0.683 . . . . 0.0 109.978 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -66.58 -32.55 73.96 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.541 -0.725 . . . . 0.0 110.05 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -76.7 -32.82 58.12 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.643 -0.66 . . . . 0.0 109.853 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.9 mt -75.66 -28.96 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.719 -0.613 . . . . 0.0 109.597 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.7 tp -74.4 -33.6 63.06 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.662 -0.649 . . . . 0.0 109.845 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.63 -35.76 70.53 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.639 -0.663 . . . . 0.0 109.808 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.403 ' CG ' ' CD1' ' B' ' 190' ' ' ILE . 2.0 tp -68.67 -27.87 66.36 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.608 -0.683 . . . . 0.0 109.849 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -67.4 -35.51 79.45 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.544 -0.722 . . . . 0.0 109.493 179.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.19 -31.44 60.95 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -71.06 -30.79 67.04 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.753 -0.592 . . . . 0.0 109.712 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.1 tp -72.08 -31.31 65.96 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.592 -0.693 . . . . 0.0 109.689 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.09 -32.8 56.9 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.655 -0.653 . . . . 0.0 109.677 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.41 -31.24 63.74 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 120.121 -0.631 . . . . 0.0 109.376 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.3 tp -65.06 -33.85 77.03 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.663 -0.648 . . . . 0.0 109.425 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -31.32 65.66 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.697 -0.627 . . . . 0.0 109.49 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -67.98 -30.09 69.28 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.691 -0.63 . . . . 0.0 109.735 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -66.27 -44.96 82.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.646 -0.659 . . . . 0.0 109.914 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -66.91 -30.15 70.23 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.597 -0.69 . . . . 0.0 109.863 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -70.32 -29.27 65.94 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.713 -0.617 . . . . 0.0 109.894 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -67.4 -32.21 72.95 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.629 -0.67 . . . . 0.0 109.866 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.71 -30.55 69.22 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.593 -0.692 . . . . 0.0 109.969 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.408 ' CG ' ' HE2' ' B' ' 176' ' ' MET . 2.7 m-85 -68.54 -27.89 66.5 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.597 -0.689 . . . . 0.0 110.187 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.5 -28.66 64.07 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.524 -0.735 . . . . 0.0 110.025 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -117.82 25.6 10.26 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.627 -0.67 . . . . 0.0 110.532 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.061 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.405 ' CD1' ' CB ' ' B' ' 171' ' ' GLU . 0.0 OUTLIER -139.78 -82.75 0.26 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.554 -0.968 . . . . 0.0 110.536 -179.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 88.6 p -130.49 20.81 5.17 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.246 -0.909 . . . . 0.0 110.94 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.1 tptt 50.92 25.62 2.29 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.234 -0.916 . . . . 0.0 110.729 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -150.64 -46.09 0.12 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.724 -0.61 . . . . 0.0 109.643 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . 0.405 ' CB ' ' CD1' ' B' ' 167' ' ' LEU . 0.4 OUTLIER -66.38 -29.88 70.14 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.982 -0.687 . . . . 0.0 109.447 179.418 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 14.8 tp -81.49 -33.2 32.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.704 -0.622 . . . . 0.0 109.386 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . 0.434 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.1 mp -74.76 -31.37 26.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -64.06 -32.14 73.59 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -75.38 -32.72 60.89 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.408 ' HE2' ' CG ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -66.45 -33.13 75.02 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.172 -0.611 . . . . 0.0 109.555 179.47 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -76.33 -31.59 58.21 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.639 -0.663 . . . . 0.0 109.751 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -74.31 -29.58 61.68 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.701 -0.624 . . . . 0.0 109.864 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 68.8 t -73.43 -29.57 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.658 -0.651 . . . . 0.0 109.763 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -75.37 -32.83 60.96 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.568 -0.707 . . . . 0.0 110.04 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -73.02 -29.43 63.0 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.71 -0.619 . . . . 0.0 109.864 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -73.42 -39.66 64.86 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.616 -0.677 . . . . 0.0 109.925 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 96.3 mt -66.81 -28.49 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.67 -0.644 . . . . 0.0 109.723 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 79.0 m -67.95 -37.07 81.14 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.609 -0.682 . . . . 0.0 109.672 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 19.9 tpp -70.73 -44.4 66.91 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.64 -0.662 . . . . 0.0 109.485 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 68.3 t -66.85 -35.79 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -63.7 -34.23 77.4 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.726 -0.609 . . . . 0.0 109.815 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.88 -24.88 62.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.681 -0.637 . . . . 0.0 110.033 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -24.83 57.33 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.547 -0.72 . . . . 0.0 110.458 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.403 ' CD1' ' CG ' ' A' ' 72' ' ' LEU . 32.8 mm -79.16 -34.86 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.354 -0.842 . . . . 0.0 109.601 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.1 m -75.55 -30.8 59.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.729 -0.607 . . . . 0.0 109.684 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 39.0 mmtt -74.68 -32.59 62.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.689 -0.632 . . . . 0.0 109.678 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . 0.402 ' CD1' ' CD2' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -71.61 -35.83 70.6 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.566 -0.709 . . . . 0.0 109.424 179.459 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.2 -40.8 94.68 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.64 -0.663 . . . . 0.0 109.407 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -70.83 -32.05 68.96 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.687 -0.633 . . . . 0.0 109.378 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -67.64 -31.88 72.19 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -65.46 -30.67 71.48 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.726 -0.608 . . . . 0.0 109.676 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -62.2 -43.47 98.76 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.713 -0.617 . . . . 0.0 109.829 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -61.54 -40.73 95.74 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.777 -0.577 . . . . 0.0 109.842 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.93 -32.53 63.55 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.533 -0.729 . . . . 0.0 109.558 179.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -77.61 -30.72 52.49 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.791 -0.568 . . . . 0.0 109.747 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -76.58 -29.02 56.43 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.801 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -75.48 -29.78 59.69 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.652 -0.655 . . . . 0.0 109.862 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -72.36 -29.36 63.72 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.592 -0.692 . . . . 0.0 109.982 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -118.22 27.91 8.69 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.583 -0.698 . . . . 0.0 110.204 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.26 142.11 96.56 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.5 -0.75 . . . . 0.0 110.074 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.317 -1.114 0 O-C-N 123.304 1.16 . . . . 0.0 110.392 -179.964 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.4 tptt . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.137 0.494 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.7 mttm -121.21 179.99 4.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.544 -0.722 . . . . 0.0 110.191 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 52.78 26.19 4.35 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.431 -0.793 . . . . 0.0 110.838 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.31 -34.66 8.7 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.451 -0.781 . . . . 0.0 110.182 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -73.58 -28.79 62.02 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.615 -0.678 . . . . 0.0 110.007 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -75.44 -28.48 59.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.632 -0.667 . . . . 0.0 110.04 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -75.11 -30.64 60.93 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.552 -0.718 . . . . 0.0 109.963 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 24.5 mtp -72.34 -30.44 64.75 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.652 -0.655 . . . . 0.0 109.879 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 21.5 m -68.04 -28.99 67.87 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.655 -0.653 . . . . 0.0 109.901 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.19 -31.47 72.67 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.566 -0.709 . . . . 0.0 110.021 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -75.22 -37.46 61.09 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.61 -0.681 . . . . 0.0 109.91 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -74.01 -30.55 62.51 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.733 -0.604 . . . . 0.0 109.672 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 79.0 m -72.71 -29.94 63.79 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.677 -0.639 . . . . 0.0 109.71 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -68.94 -27.74 66.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.647 -0.658 . . . . 0.0 110.051 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -68.24 -33.21 73.96 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.45 -0.781 . . . . 0.0 110.14 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -75.65 -33.86 60.47 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.678 -0.639 . . . . 0.0 109.722 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.7 mt -71.82 -28.25 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.768 -0.583 . . . . 0.0 109.617 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.23 -38.27 78.43 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.558 -0.714 . . . . 0.0 109.796 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.3 tptp -68.74 -29.89 68.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.584 -0.697 . . . . 0.0 109.766 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.4 mt -68.58 -32.17 71.88 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.69 -0.631 . . . . 0.0 110.023 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -68.29 -33.46 74.39 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.64 -0.663 . . . . 0.0 109.829 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -75.34 -30.07 60.14 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.655 -0.653 . . . . 0.0 109.814 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -74.61 -30.12 61.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.698 -0.626 . . . . 0.0 109.905 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 28.8 tp -74.94 -34.01 62.04 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.661 -0.649 . . . . 0.0 109.901 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 22.0 mt -74.97 -32.31 61.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.674 -0.641 . . . . 0.0 109.743 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.68 -29.75 62.48 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.71 -0.618 . . . . 0.0 109.767 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.45 -41.13 56.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.712 -0.617 . . . . 0.0 109.614 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -71.05 -29.19 65.02 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.65 -0.656 . . . . 0.0 109.743 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -71.11 -29.65 65.53 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.593 -0.692 . . . . 0.0 109.716 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -68.03 -42.23 80.94 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.678 -0.639 . . . . 0.0 109.867 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -66.91 -28.96 68.73 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.546 -0.721 . . . . 0.0 109.864 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -68.76 -30.94 69.65 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.644 -0.66 . . . . 0.0 109.95 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -65.04 -38.07 89.65 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.606 -0.684 . . . . 0.0 109.784 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.0 mt -61.25 -33.84 74.18 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.707 -0.621 . . . . 0.0 109.98 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -63.35 -46.06 88.33 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.511 -0.743 . . . . 0.0 109.905 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 42.4 mt -69.31 -28.63 66.43 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.734 -0.604 . . . . 0.0 109.862 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -100.52 7.95 43.79 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.673 -0.642 . . . . 0.0 110.997 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.0 tp . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.304 -179.99 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.402 ' CD1' ' CB ' ' B' ' 171' ' ' GLU . 0.1 OUTLIER -141.86 -84.08 0.19 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.51 -0.994 . . . . 0.0 110.454 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 66.7 m -127.84 19.35 6.62 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.064 -1.022 . . . . 0.0 110.819 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 16.7 tptt 50.71 25.92 2.29 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.237 -0.915 . . . . 0.0 110.652 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -148.96 -46.74 0.14 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.643 -0.661 . . . . 0.0 109.453 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . 0.402 ' CB ' ' CD1' ' B' ' 167' ' ' LEU . 1.1 mt-10 -66.3 -34.75 78.7 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.248 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 5.5 tt -77.63 -29.35 51.75 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.5 mm -68.56 -31.07 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.702 -0.624 . . . . 0.0 109.358 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -76.29 -30.31 57.73 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.672 -0.643 . . . . 0.0 109.835 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -75.05 -30.1 60.92 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.718 -0.614 . . . . 0.0 109.847 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -31.19 65.91 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.636 -0.665 . . . . 0.0 109.848 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.72 -29.97 56.44 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.956 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -76.81 -30.1 56.26 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.608 -0.683 . . . . 0.0 109.829 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 71.1 t -74.48 -29.69 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.616 -0.677 . . . . 0.0 109.687 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -71.63 -28.8 64.02 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.583 -0.698 . . . . 0.0 109.99 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 22.1 mtp180 -74.88 -29.49 61.03 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.591 -0.693 . . . . 0.0 110.031 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -74.64 -34.44 62.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.725 -0.609 . . . . 0.0 110.039 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 78.3 mt -71.18 -28.77 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.715 -0.616 . . . . 0.0 109.768 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.6 m -72.17 -33.59 67.82 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.59 -0.694 . . . . 0.0 109.803 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 11.2 ttt -75.46 -36.86 60.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.62 -0.675 . . . . 0.0 109.733 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.5 t -74.88 -30.58 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.7 -0.625 . . . . 0.0 109.528 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -75.48 -28.77 59.34 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.716 -0.615 . . . . 0.0 109.915 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -74.44 -28.98 61.29 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.648 -0.657 . . . . 0.0 109.992 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.27 -36.71 63.84 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.637 -0.665 . . . . 0.0 109.952 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.459 HG23 HD13 ' B' ' 190' ' ' ILE . 82.0 mt -72.1 -31.55 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.621 -0.674 . . . . 0.0 109.607 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 3.7 m -71.36 -35.85 71.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.698 -0.626 . . . . 0.0 109.571 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 14.7 mmtt -75.52 -32.47 60.49 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.517 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.0 -17.65 58.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.695 -0.628 . . . . 0.0 110.426 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 7.3 tptt -85.53 -27.0 25.87 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.349 -0.844 . . . . 0.0 109.545 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -76.45 -32.84 58.66 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.624 -0.673 . . . . 0.0 110.006 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -25.07 62.92 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.495 -0.753 . . . . 0.0 109.896 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -70.39 -30.07 66.88 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.509 -0.744 . . . . 0.0 109.591 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.61 -46.69 87.1 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.596 -0.69 . . . . 0.0 109.513 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -61.74 -36.94 82.44 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.738 -0.601 . . . . 0.0 109.899 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 19.6 tp -75.47 -35.32 60.89 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.603 -0.686 . . . . 0.0 109.658 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -77.86 -30.66 51.02 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.66 -0.65 . . . . 0.0 109.641 179.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.46 -28.56 46.57 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.61 -0.681 . . . . 0.0 109.738 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -77.06 -27.8 54.47 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.612 -0.68 . . . . 0.0 110.015 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.23 -24.64 51.19 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.549 -0.719 . . . . 0.0 110.33 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.35 -25.83 28.88 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.472 -0.768 . . . . 0.0 110.3 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 13.1 mttt -59.72 167.23 2.7 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.511 -0.743 . . . . 0.0 110.315 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo . . . . . 0 C--N 1.317 -1.12 0 O-C-N 123.35 1.184 . . . . 0.0 110.402 -179.963 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.7 mttm . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.038 0.447 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -117.13 -177.85 3.31 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.59 -0.694 . . . . 0.0 110.237 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 52.72 26.98 4.84 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.4 -0.813 . . . . 0.0 110.706 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.23 -45.82 0.34 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.583 -0.698 . . . . 0.0 110.118 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -64.58 -29.19 70.2 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.694 -0.628 . . . . 0.0 110.032 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -71.13 -28.74 64.51 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.634 -0.666 . . . . 0.0 110.03 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -29.53 67.11 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.601 -0.687 . . . . 0.0 110.078 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 6.3 mmm -74.12 -30.35 62.28 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.601 -0.687 . . . . 0.0 110.013 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 t -71.77 -29.77 64.84 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.672 -0.642 . . . . 0.0 109.898 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 mp -69.11 -28.98 66.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.623 -0.673 . . . . 0.0 109.97 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -67.23 -30.63 70.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.543 -0.723 . . . . 0.0 110.007 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -75.03 -39.23 61.18 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.608 -0.682 . . . . 0.0 109.87 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 47.3 m -72.21 -30.75 65.23 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.655 -0.653 . . . . 0.0 109.638 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -71.72 -27.47 63.02 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.647 -0.658 . . . . 0.0 109.967 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -69.64 -34.84 74.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.626 -0.671 . . . . 0.0 110.175 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 -75.67 -35.27 60.42 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.612 -0.68 . . . . 0.0 109.652 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.3 mt -72.34 -27.52 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.781 -0.574 . . . . 0.0 109.554 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 9.6 tt -71.13 -38.88 72.27 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.635 -0.666 . . . . 0.0 109.915 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -35.02 79.51 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.596 -0.69 . . . . 0.0 109.676 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.719 -0.613 . . . . 0.0 109.825 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.9 -36.13 83.38 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.607 -0.683 . . . . 0.0 109.977 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -76.1 -30.98 58.48 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.634 -0.666 . . . . 0.0 109.724 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tttm -77.19 -31.71 55.55 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.715 -0.616 . . . . 0.0 109.774 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 36.4 tp -77.74 -30.65 51.73 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.624 -0.672 . . . . 0.0 109.681 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.79 -30.94 56.66 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.678 -0.639 . . . . 0.0 109.639 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.32 -29.99 61.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.593 -0.692 . . . . 0.0 109.956 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.34 -38.2 56.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.639 -0.663 . . . . 0.0 109.631 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -71.69 -29.07 64.17 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.589 -0.694 . . . . 0.0 109.748 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -71.4 -29.47 64.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.581 -0.7 . . . . 0.0 109.866 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -70.8 -43.57 68.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.619 -0.676 . . . . 0.0 109.852 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -62.96 -29.31 70.71 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.587 -0.696 . . . . 0.0 109.748 179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -63.44 -31.14 72.21 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.622 -0.674 . . . . 0.0 109.848 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -62.8 -32.82 74.08 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.672 -0.643 . . . . 0.0 109.852 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.39 -35.93 78.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.647 -0.658 . . . . 0.0 109.81 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -64.18 -29.24 70.36 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.682 -0.636 . . . . 0.0 110.052 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 tp -65.85 -30.12 70.68 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.58 -0.7 . . . . 0.0 110.004 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.58 27.38 9.23 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.601 -0.687 . . . . 0.0 110.289 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 51.2 tp . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 118.045 -0.978 . . . . 0.0 110.168 179.923 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -140.84 -84.07 0.21 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.578 -0.954 . . . . 0.0 110.561 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -128.64 19.66 6.16 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.143 -0.973 . . . . 0.0 110.9 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 7.6 tptm 50.76 26.09 2.4 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.21 -0.931 . . . . 0.0 110.604 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -149.33 -45.87 0.14 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.627 -0.67 . . . . 0.0 109.694 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.45 -35.85 81.33 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.804 -0.759 . . . . 0.0 109.292 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 10.2 tp -76.9 -28.79 55.45 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 178.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.7 mm -66.59 -31.38 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.616 -0.677 . . . . 0.0 109.196 179.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -74.98 -31.08 61.35 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.124 -0.63 . . . . 0.0 109.775 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -75.03 -34.72 61.91 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.681 -0.637 . . . . 0.0 109.77 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -30.67 68.03 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.743 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -67.15 -35.26 79.33 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.666 -0.647 . . . . 0.0 109.727 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.51 -30.73 59.92 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.72 -0.612 . . . . 0.0 109.686 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 69.3 t -76.67 -30.96 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.702 -0.624 . . . . 0.0 109.569 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . 0.41 ' O ' ' OG1' ' B' ' 184' ' ' THR . 7.9 t70 -75.24 -29.72 60.31 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.728 -0.608 . . . . 0.0 109.907 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -73.47 -30.16 62.99 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.691 -0.631 . . . . 0.0 109.851 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -72.53 -36.91 68.41 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.652 -0.655 . . . . 0.0 109.965 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.0 mt -70.02 -30.52 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.705 -0.622 . . . . 0.0 109.652 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 184' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 1.8 m -68.58 -35.04 76.82 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.673 -0.642 . . . . 0.0 109.652 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -46.63 74.79 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.582 -0.699 . . . . 0.0 109.659 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 60.5 t -70.57 -33.03 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.634 -0.666 . . . . 0.0 109.307 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -72.86 -29.95 63.6 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.775 -0.578 . . . . 0.0 109.675 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 37.5 mm-40 -68.89 -30.27 68.73 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.636 -0.665 . . . . 0.0 109.781 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.55 -36.83 63.11 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.594 -0.691 . . . . 0.0 109.841 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 79.4 mt -69.54 -30.58 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.627 -0.671 . . . . 0.0 109.523 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 20.4 m -66.67 -40.29 88.53 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.701 -0.624 . . . . 0.0 109.612 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -72.32 -31.53 65.75 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 120.087 -0.645 . . . . 0.0 109.495 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.39 -35.41 68.41 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.756 -0.59 . . . . 0.0 109.418 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -68.5 -43.09 77.6 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.693 -0.63 . . . . 0.0 109.497 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -67.3 -32.0 72.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.667 -0.646 . . . . 0.0 109.327 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -34.89 79.25 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -63.01 -30.37 71.55 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.795 -0.566 . . . . 0.0 109.637 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.42 -46.24 90.93 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.705 -0.622 . . . . 0.0 109.743 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -62.09 -46.2 90.11 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.714 -0.617 . . . . 0.0 109.843 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 4.9 tp -69.48 -34.34 74.19 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.623 -0.673 . . . . 0.0 109.822 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -76.72 -30.34 56.6 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.649 -0.657 . . . . 0.0 109.811 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -77.08 -29.78 55.15 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.595 -0.691 . . . . 0.0 109.799 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.36 -27.83 56.57 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.664 -0.648 . . . . 0.0 110.036 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.31 -27.81 47.3 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.576 -0.703 . . . . 0.0 110.206 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -88.36 -28.69 20.81 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.552 -0.717 . . . . 0.0 110.166 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 153.07 78.05 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.565 -0.71 . . . . 0.0 110.13 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo . . . . . 0 C--N 1.318 -1.078 0 O-C-N 123.417 1.22 . . . . 0.0 110.371 179.978 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.7 mtpp . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.037 0.446 . . . . 0.0 110.186 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.3 tttt -146.95 178.58 8.24 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.601 -0.687 . . . . 0.0 110.189 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -99.51 -29.36 12.77 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.533 -0.729 . . . . 0.0 110.11 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -89.9 -24.31 21.38 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.592 -0.692 . . . . 0.0 110.43 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.74 -26.67 62.16 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.366 -0.834 . . . . 0.0 110.509 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -61.27 -41.47 96.98 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.481 -0.762 . . . . 0.0 110.096 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -70.17 -29.88 66.88 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.619 -0.676 . . . . 0.0 109.855 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.6 mmm -72.23 -30.22 64.69 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.638 -0.664 . . . . 0.0 109.737 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 t -67.65 -28.07 67.39 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.654 -0.654 . . . . 0.0 109.938 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.1 tp -66.73 -29.16 69.07 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.539 -0.725 . . . . 0.0 110.131 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -76.29 -31.71 58.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.579 -0.701 . . . . 0.0 110.082 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -76.78 -30.8 56.63 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.596 -0.69 . . . . 0.0 109.798 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.9 m -75.16 -30.04 60.62 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.686 -0.634 . . . . 0.0 109.755 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.1 mmtt -72.33 -27.21 62.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.624 -0.672 . . . . 0.0 110.137 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -72.86 -35.32 67.18 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.562 -0.711 . . . . 0.0 110.206 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.1 tp60 -76.07 -35.09 59.56 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.502 -0.748 . . . . 0.0 109.706 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.6 mt -75.39 -28.62 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.771 -0.58 . . . . 0.0 109.503 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.3 tt -75.19 -36.93 61.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.625 -0.672 . . . . 0.0 109.601 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -66.31 -29.45 69.65 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.469 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.6 mt -62.04 -33.03 73.62 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.695 -0.628 . . . . 0.0 109.899 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -61.6 -36.04 79.56 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.523 -0.736 . . . . 0.0 109.888 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -77.31 -31.46 54.66 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.71 -0.618 . . . . 0.0 109.353 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.3 -30.67 62.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.705 -0.622 . . . . 0.0 109.621 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -74.01 -34.89 64.32 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.667 -0.646 . . . . 0.0 109.647 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tp -71.83 -36.71 70.3 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.693 -0.629 . . . . 0.0 109.61 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.69 -30.38 71.06 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.745 -0.597 . . . . 0.0 109.481 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.6 -41.88 98.08 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.707 -0.621 . . . . 0.0 109.828 179.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -67.58 -30.26 69.84 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.614 -0.679 . . . . 0.0 109.753 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -30.18 69.42 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.688 -0.632 . . . . 0.0 109.765 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.33 -49.29 57.09 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.657 -0.652 . . . . 0.0 109.782 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.9 ttpt -66.96 -31.27 71.73 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.578 -0.701 . . . . 0.0 109.494 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -70.12 -30.24 67.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.753 -0.592 . . . . 0.0 109.775 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -67.43 -29.72 69.28 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.571 -0.706 . . . . 0.0 109.886 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.47 -39.55 88.85 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.579 -0.701 . . . . 0.0 109.922 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -61.14 -29.26 69.67 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.546 -0.721 . . . . 0.0 110.14 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.9 tp -70.32 -27.65 64.54 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.628 -0.67 . . . . 0.0 110.199 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -119.84 26.99 8.96 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.528 -0.733 . . . . 0.0 110.412 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 29.2 tp . . . . . 0 N--CA 1.496 1.861 0 CA-C-O 117.933 -1.032 . . . . 0.0 109.989 179.9 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.43 -77.59 0.25 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.553 -0.969 . . . . 0.0 110.536 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 18.1 t -136.48 18.62 3.12 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.105 -0.997 . . . . 0.0 110.876 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 40.6 tptt 50.67 25.95 2.28 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.238 -0.914 . . . . 0.0 110.562 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -148.23 -46.66 0.16 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.692 -0.63 . . . . 0.0 109.386 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.18 -32.56 72.88 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.21 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 3.9 tt -78.96 -29.28 43.88 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.8 mm -68.61 -30.55 47.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.721 -0.612 . . . . 0.0 109.4 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -72.67 -30.55 64.36 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.6 -0.688 . . . . 0.0 109.803 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -74.67 -31.7 62.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.619 -0.676 . . . . 0.0 109.701 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.6 mtt -70.16 -30.83 68.08 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.763 -0.586 . . . . 0.0 109.869 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -76.95 -30.94 56.25 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.635 -0.666 . . . . 0.0 109.886 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -29.84 57.37 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.661 -0.649 . . . . 0.0 109.735 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 73.9 t -74.39 -28.45 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.6 -0.688 . . . . 0.0 109.81 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -74.65 -36.72 62.86 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.613 -0.68 . . . . 0.0 110.047 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 15.3 mtt85 -70.09 -26.32 63.93 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.639 -0.663 . . . . 0.0 109.977 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -72.87 -36.1 67.31 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.515 -0.741 . . . . 0.0 110.142 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 87.3 mt -67.89 -27.94 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.57 -0.707 . . . . 0.0 109.874 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 7.8 m -67.97 -34.61 76.89 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.559 -0.713 . . . . 0.0 109.787 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 mtm -73.78 -37.71 64.9 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.6 -0.688 . . . . 0.0 109.742 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.7 t -73.29 -30.42 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.642 -0.661 . . . . 0.0 109.616 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.56 -29.22 61.27 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.6 -0.688 . . . . 0.0 109.991 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -30.85 63.37 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.651 -0.655 . . . . 0.0 109.939 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -32.57 69.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.625 -0.672 . . . . 0.0 109.942 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.462 HD11 HG23 ' B' ' 190' ' ' ILE . 78.1 mt -75.3 -30.71 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.546 -0.721 . . . . 0.0 109.739 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 27.6 m -75.53 -35.86 60.62 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.632 -0.667 . . . . 0.0 109.654 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 28.5 mtmt -73.48 -34.19 65.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.662 -0.649 . . . . 0.0 109.538 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.28 -35.6 76.21 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -64.15 -47.32 80.37 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -67.43 -31.93 72.45 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -64.83 -34.18 77.77 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -63.41 -30.85 71.91 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 120.223 -0.591 . . . . 0.0 109.48 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -60.98 -45.89 92.96 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.655 -0.653 . . . . 0.0 109.885 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -61.82 -39.51 92.04 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.745 -0.597 . . . . 0.0 109.739 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 13.7 tp -74.89 -30.52 61.33 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.65 -0.656 . . . . 0.0 109.582 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -78.44 -31.33 48.0 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.644 -0.66 . . . . 0.0 109.761 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -77.92 -28.87 49.83 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.719 -0.613 . . . . 0.0 109.786 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -79.43 -29.73 42.0 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.637 -0.664 . . . . 0.0 109.949 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -81.04 -27.69 35.67 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.632 -0.668 . . . . 0.0 110.025 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -92.95 -26.51 17.54 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.53 -0.732 . . . . 0.0 110.325 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 52.78 76.83 0.49 Allowed Pre-proline 0 N--CA 1.501 2.111 0 O-C-N 121.406 -0.809 . . . . 0.0 110.764 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.317 -1.095 0 O-C-N 123.339 1.178 . . . . 0.0 110.403 -179.984 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.033 0.445 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -147.1 -165.66 2.3 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.585 -0.697 . . . . 0.0 110.221 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 52.43 24.86 3.18 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.407 -0.808 . . . . 0.0 110.852 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.2 mmt -132.54 21.73 4.31 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.522 -0.737 . . . . 0.0 110.337 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -83.11 -29.86 28.38 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.406 -0.809 . . . . 0.0 110.014 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -71.53 -30.23 65.67 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.591 -0.693 . . . . 0.0 109.954 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -30.3 69.58 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.597 -0.69 . . . . 0.0 109.82 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.2 mmt -63.77 -33.52 75.85 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.639 -0.663 . . . . 0.0 109.952 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.9 t -66.66 -28.81 68.76 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.637 -0.664 . . . . 0.0 109.972 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 tt -66.23 -29.51 69.77 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.601 -0.687 . . . . 0.0 110.082 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -64.58 -31.41 72.61 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.626 -0.671 . . . . 0.0 110.067 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -72.25 -33.15 67.29 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.595 -0.69 . . . . 0.0 109.924 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.8 m -70.56 -38.51 74.15 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.689 -0.632 . . . . 0.0 109.76 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -63.99 -27.04 68.86 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.625 -0.672 . . . . 0.0 109.943 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -66.82 -39.58 87.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.532 -0.73 . . . . 0.0 110.204 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.0 tp60 -76.07 -31.48 58.8 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.608 -0.682 . . . . 0.0 109.624 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.427 HD11 HG22 ' A' ' 69' ' ' ILE . 90.8 mt -77.42 -28.12 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.743 -0.598 . . . . 0.0 109.533 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 24.5 tp -75.14 -38.12 61.14 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.585 -0.697 . . . . 0.0 109.536 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -65.54 -30.95 71.76 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.623 -0.673 . . . . 0.0 109.565 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mt -62.64 -35.72 80.54 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.655 -0.653 . . . . 0.0 110.06 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -61.99 -35.69 79.24 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.598 -0.689 . . . . 0.0 110.033 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -76.16 -30.66 58.18 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.612 -0.68 . . . . 0.0 109.731 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.6 tttt -75.81 -28.95 58.51 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.658 -0.651 . . . . 0.0 109.888 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.7 tp -76.83 -32.37 57.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.676 -0.64 . . . . 0.0 109.984 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.64 -31.56 57.45 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.652 -0.655 . . . . 0.0 109.792 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.24 -27.71 59.6 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.699 -0.626 . . . . 0.0 110.068 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.1 tp -76.55 -31.66 57.72 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.543 -0.723 . . . . 0.0 110.086 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -75.07 -30.48 60.99 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.642 -0.661 . . . . 0.0 109.784 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -71.91 -28.13 63.29 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.689 -0.632 . . . . 0.0 109.81 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -68.76 -37.5 79.4 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.565 -0.709 . . . . 0.0 110.012 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -70.32 -29.65 66.42 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.474 -0.766 . . . . 0.0 109.923 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -69.67 -29.83 67.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.591 -0.693 . . . . 0.0 109.75 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.0 tm0? -64.85 -34.19 77.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.647 -0.658 . . . . 0.0 109.959 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.24 -38.62 91.7 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.586 -0.696 . . . . 0.0 109.858 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.421 ' CG ' ' HE1' ' B' ' 176' ' ' MET . 9.6 m-85 -60.76 -28.59 68.84 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.628 -0.67 . . . . 0.0 110.141 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 66.7 mt -72.85 -28.72 62.7 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.572 -0.705 . . . . 0.0 110.138 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -116.99 25.82 10.23 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.628 -0.67 . . . . 0.0 110.433 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.805 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.903 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.66 -80.03 0.13 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.476 -1.014 . . . . 0.0 110.524 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 168' ' ' SER . . . . . 0.406 ' O ' ' OG ' ' B' ' 168' ' ' SER . 3.1 t -134.18 19.2 3.72 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.234 -0.916 . . . . 0.0 110.919 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 25.4 tptt 50.63 25.92 2.24 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.175 -0.953 . . . . 0.0 110.598 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -148.2 -46.66 0.16 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.722 -0.611 . . . . 0.0 109.354 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.77 -32.16 72.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.593 -0.692 . . . . 0.0 109.32 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.3 tt -78.95 -28.17 43.66 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 49.6 mm -70.6 -31.41 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.652 -0.655 . . . . 0.0 109.418 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 52.9 tp60 -71.07 -28.22 64.2 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.666 -0.646 . . . . 0.0 109.939 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -70.34 -28.62 65.28 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.622 -0.674 . . . . 0.0 110.151 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.421 ' HE1' ' CG ' ' A' ' 87' ' ' PHE . 0.4 OUTLIER -75.27 -31.84 60.87 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.49 -0.757 . . . . 0.0 110.049 179.845 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -73.18 -30.02 63.25 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.614 -0.679 . . . . 0.0 109.967 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -77.69 -30.52 51.94 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.645 -0.659 . . . . 0.0 109.865 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 65.7 t -76.8 -30.31 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.698 -0.626 . . . . 0.0 109.738 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -76.98 -29.64 55.61 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.7 -0.625 . . . . 0.0 109.989 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.5 -28.32 59.13 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.655 -0.653 . . . . 0.0 109.971 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -74.96 -33.85 61.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.613 -0.68 . . . . 0.0 110.052 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 89.1 mt -71.47 -28.23 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.589 -0.694 . . . . 0.0 109.817 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.7 m -71.51 -34.73 70.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.57 -0.706 . . . . 0.0 109.918 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -39.21 62.87 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.597 -0.689 . . . . 0.0 109.775 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 60.2 t -74.34 -29.89 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.569 -0.707 . . . . 0.0 109.564 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -76.34 -28.48 56.89 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.623 -0.673 . . . . 0.0 109.958 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -75.13 -28.06 60.04 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.539 -0.725 . . . . 0.0 110.11 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.89 -29.22 61.95 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.585 -0.697 . . . . 0.0 110.022 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.43 HG23 HD12 ' B' ' 190' ' ' ILE . 81.0 mt -76.04 -34.28 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.632 -0.667 . . . . 0.0 109.71 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 86.9 p -70.57 -30.95 67.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.74 -0.6 . . . . 0.0 109.501 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 25.2 mmtt -77.36 -33.86 55.2 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.638 -0.664 . . . . 0.0 109.591 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.5 -31.52 65.42 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.594 -0.691 . . . . 0.0 109.27 179.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -66.96 -41.27 87.18 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.614 -0.679 . . . . 0.0 109.476 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -71.32 -31.77 67.81 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.676 -0.64 . . . . 0.0 109.284 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 9.7 ttpt -67.88 -32.39 72.85 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -64.77 -30.07 71.06 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.706 -0.621 . . . . 0.0 109.485 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.77 -46.07 91.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.652 -0.655 . . . . 0.0 109.81 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -61.92 -37.72 85.71 Favored 'General case' 0 N--CA 1.496 1.842 0 C-N-CA 120.228 -0.589 . . . . 0.0 109.807 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.6 tp -73.59 -33.61 64.69 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.583 -0.698 . . . . 0.0 109.673 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -76.94 -33.87 57.67 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.684 -0.635 . . . . 0.0 109.707 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.27 -29.99 48.31 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.703 -0.623 . . . . 0.0 109.594 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -77.6 -27.49 51.27 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.626 -0.671 . . . . 0.0 109.796 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.14 -23.61 51.69 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.547 -0.721 . . . . 0.0 110.338 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -82.15 -24.78 34.86 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.425 -0.797 . . . . 0.0 110.189 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt -58.64 165.37 3.16 Favored Pre-proline 0 N--CA 1.496 1.859 0 O-C-N 121.479 -0.763 . . . . 0.0 110.372 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 C--N 1.317 -1.125 0 O-C-N 123.427 1.225 . . . . 0.0 110.376 179.994 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.4 ttmt . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.125 0.488 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -153.95 -168.06 2.85 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.506 -0.746 . . . . 0.0 110.198 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -82.7 -27.72 31.02 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.625 -0.672 . . . . 0.0 110.356 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.1 mtt -73.31 -30.2 63.22 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.563 -0.71 . . . . 0.0 110.158 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.6 -29.3 62.3 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.667 -0.645 . . . . 0.0 110.039 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -72.1 -27.53 62.71 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.627 -0.671 . . . . 0.0 110.114 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.7 mtt85 -71.21 -29.27 64.95 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.49 -0.756 . . . . 0.0 110.115 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 49.8 mtt -70.93 -41.04 71.7 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.631 -0.668 . . . . 0.0 109.847 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.2 p -62.46 -28.33 69.74 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.74 -0.6 . . . . 0.0 109.747 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.34 -30.38 71.43 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.613 -0.679 . . . . 0.0 110.059 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -72.23 -34.29 68.2 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.035 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -75.06 -31.33 61.24 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.635 -0.665 . . . . 0.0 109.779 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 56.7 m -72.52 -29.79 63.91 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.717 -0.614 . . . . 0.0 109.76 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -69.15 -26.98 65.14 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.619 -0.676 . . . . 0.0 110.149 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -70.36 -31.89 69.35 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.586 -0.697 . . . . 0.0 110.328 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.1 tp60 -77.51 -34.25 54.12 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.492 -0.755 . . . . 0.0 109.847 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 81.1 mt -74.08 -26.98 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.721 -0.612 . . . . 0.0 109.56 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.9 mt -72.38 -37.27 68.8 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.5 -0.75 . . . . 0.0 109.882 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -65.26 -30.63 71.53 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.585 -0.697 . . . . 0.0 109.846 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -68.72 -29.27 67.65 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.65 -0.656 . . . . 0.0 110.049 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -69.44 -33.74 73.39 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.546 -0.721 . . . . 0.0 110.033 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -30.0 58.56 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.646 -0.659 . . . . 0.0 109.87 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -76.19 -29.42 57.66 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.686 -0.634 . . . . 0.0 109.986 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -76.76 -32.12 57.51 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.585 -0.697 . . . . 0.0 109.863 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.6 mp -76.55 -32.56 58.27 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.747 -0.595 . . . . 0.0 109.782 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.1 -28.73 61.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.698 -0.626 . . . . 0.0 109.811 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.0 -36.69 64.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.619 -0.676 . . . . 0.0 109.89 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -69.25 -28.37 66.27 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.593 -0.692 . . . . 0.0 110.014 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -70.94 -27.92 64.11 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.564 -0.71 . . . . 0.0 110.052 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -44.18 64.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.532 -0.73 . . . . 0.0 109.804 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.6 ttpp -62.78 -27.66 69.45 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.513 -0.742 . . . . 0.0 109.673 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -63.95 -32.95 74.66 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.565 -0.71 . . . . 0.0 110.023 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -64.49 -34.88 79.24 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.534 -0.729 . . . . 0.0 109.792 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.22 -35.22 80.1 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.599 -0.688 . . . . 0.0 109.896 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -60.75 -35.45 76.42 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.585 -0.697 . . . . 0.0 110.029 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mt -62.81 -30.31 71.38 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.637 -0.664 . . . . 0.0 109.674 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -96.77 -26.79 15.01 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.693 -0.63 . . . . 0.0 110.095 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.4 ' CD1' ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.005 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.494 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.5 -28.62 5.29 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.589 -0.947 . . . . 0.0 110.615 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 8.3 t -165.84 18.12 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.349 -0.845 . . . . 0.0 111.62 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 48.66 26.58 1.26 Allowed 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.095 -1.003 . . . . 0.0 111.291 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -154.44 -46.56 0.09 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.723 -0.611 . . . . 0.0 110.109 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -74.12 -35.38 64.12 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.921 -0.712 . . . . 0.0 109.291 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 19.3 tp -76.01 -26.48 56.71 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . 0.4 ' CD1' ' CD1' ' A' ' 90' ' ' LEU . 49.1 mm -69.22 -32.85 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -70.44 -30.18 66.96 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.716 -0.615 . . . . 0.0 109.869 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -67.22 -32.24 73.16 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.612 -0.68 . . . . 0.0 109.858 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -31.51 67.81 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.713 -0.617 . . . . 0.0 109.746 179.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.79 -30.27 63.96 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.707 -0.621 . . . . 0.0 109.856 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -39.94 61.96 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.619 -0.676 . . . . 0.0 109.926 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 61.2 t -72.09 -30.97 38.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.675 -0.641 . . . . 0.0 109.458 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.73 -30.09 65.25 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.664 -0.648 . . . . 0.0 109.748 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -67.33 -32.75 73.92 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.645 -0.659 . . . . 0.0 109.768 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -74.14 -35.87 64.1 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.58 -0.7 . . . . 0.0 109.942 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.5 mt -72.99 -29.76 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.703 -0.623 . . . . 0.0 109.705 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 53.7 m -74.15 -32.7 63.24 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.633 -0.667 . . . . 0.0 109.806 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.0 mtt -74.33 -39.27 62.94 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.669 -0.644 . . . . 0.0 109.705 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -72.33 -30.83 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.586 -0.696 . . . . 0.0 109.511 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -72.72 -29.7 63.58 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.711 -0.618 . . . . 0.0 109.905 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -29.89 66.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.641 -0.662 . . . . 0.0 109.899 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.06 -34.05 63.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.706 -0.621 . . . . 0.0 109.989 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.444 HG23 HD13 ' B' ' 190' ' ' ILE . 72.9 mt -73.86 -31.77 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.583 -0.698 . . . . 0.0 109.742 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 89.8 p -72.21 -34.88 68.69 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.615 -0.678 . . . . 0.0 109.462 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 4.0 mmmt -76.35 -32.51 58.69 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.366 179.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.08 -31.37 67.73 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 179.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.9 tptt -68.83 -46.68 67.94 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.592 -0.693 . . . . 0.0 109.651 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 3.2 tptp -66.58 -31.47 72.19 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.563 -0.71 . . . . 0.0 109.287 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -65.25 -34.87 79.37 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -65.3 -29.11 69.84 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.688 -0.633 . . . . 0.0 109.676 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -62.16 -40.19 95.16 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.629 -0.669 . . . . 0.0 109.76 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -62.49 -34.63 77.22 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.79 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 11.0 tp -76.88 -30.69 56.33 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.653 -0.655 . . . . 0.0 109.702 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -79.2 -31.18 43.67 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.613 -0.68 . . . . 0.0 109.713 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -78.99 -29.76 43.96 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.719 -0.613 . . . . 0.0 109.79 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -78.28 -28.14 47.53 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.623 -0.673 . . . . 0.0 109.924 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.51 -27.72 46.14 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.598 -0.689 . . . . 0.0 110.072 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -86.76 -33.29 19.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.59 -0.694 . . . . 0.0 110.172 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 9.9 mmtp 51.85 94.71 0.05 OUTLIER Pre-proline 0 N--CA 1.502 2.129 0 O-C-N 121.546 -0.721 . . . . 0.0 110.906 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.316 -1.184 0 O-C-N 123.365 1.192 . . . . 0.0 110.404 179.944 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.0 mtpt . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.194 0.521 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.72 -172.8 3.83 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.46 -0.775 . . . . 0.0 110.151 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -111.3 -29.25 7.9 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.608 -0.682 . . . . 0.0 110.154 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.8 mtt -87.81 -28.07 21.89 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.607 -0.683 . . . . 0.0 110.26 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -61.0 -28.08 68.78 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.539 -0.726 . . . . 0.0 110.256 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.5 -28.1 63.67 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.611 -0.68 . . . . 0.0 110.199 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -73.28 -29.61 62.85 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.56 -0.713 . . . . 0.0 110.123 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -34.13 68.59 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.525 -0.735 . . . . 0.0 109.843 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -67.53 -29.89 69.41 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.61 -0.681 . . . . 0.0 109.901 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.49 -29.22 69.85 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.618 -0.676 . . . . 0.0 109.842 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -63.24 -41.82 99.13 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.666 -0.646 . . . . 0.0 109.997 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -72.16 -37.55 69.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.667 -0.646 . . . . 0.0 109.642 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 89.7 m -73.62 -30.9 63.25 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.757 -0.59 . . . . 0.0 109.413 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -69.9 -27.66 64.98 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 120.166 -0.614 . . . . 0.0 109.92 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.47 -38.54 81.16 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.587 -0.695 . . . . 0.0 110.084 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -75.99 -36.02 59.36 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.612 -0.68 . . . . 0.0 109.606 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.1 mt -75.61 -26.2 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.777 -0.577 . . . . 0.0 109.644 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 tt -76.03 -33.89 59.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.549 -0.72 . . . . 0.0 109.812 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.9 mmtm -70.41 -32.97 70.82 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.601 -0.687 . . . . 0.0 109.655 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.9 mt -65.8 -29.96 70.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.679 -0.638 . . . . 0.0 109.707 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.11 -44.18 96.39 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.648 -0.658 . . . . 0.0 109.82 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.08 -32.5 72.87 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.693 -0.63 . . . . 0.0 109.428 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -67.53 -35.2 78.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.773 -0.579 . . . . 0.0 109.743 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -71.19 -31.64 67.88 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.719 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.65 -38.72 67.58 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.718 -0.614 . . . . 0.0 109.572 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.17 -30.57 71.08 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.714 -0.617 . . . . 0.0 109.742 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -70.33 -46.75 63.55 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.708 -0.62 . . . . 0.0 109.734 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -64.28 -31.04 72.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.633 -0.667 . . . . 0.0 109.602 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.75 -29.43 69.95 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.688 -0.633 . . . . 0.0 109.781 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -64.62 -47.65 77.78 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.656 -0.653 . . . . 0.0 109.669 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 tptm -63.1 -30.77 71.86 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.671 -0.643 . . . . 0.0 109.619 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.6 t60 -64.93 -34.31 78.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.744 -0.598 . . . . 0.0 109.832 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -70.52 -37.35 74.11 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.709 -0.619 . . . . 0.0 109.745 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.1 -29.42 69.74 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.711 -0.618 . . . . 0.0 109.763 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -29.53 69.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.57 -0.706 . . . . 0.0 109.829 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.0 mp -76.62 -28.83 56.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.702 -0.624 . . . . 0.0 110.044 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -95.72 1.61 53.51 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.578 -0.701 . . . . 0.0 111.071 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.272 -179.96 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.26 -79.48 0.16 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.561 -0.964 . . . . 0.0 110.471 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 35.5 t -134.35 18.85 3.66 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.19 -0.944 . . . . 0.0 110.799 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 7.4 tptm 50.76 25.9 2.32 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.222 -0.924 . . . . 0.0 110.558 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -148.44 -46.49 0.15 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.612 -0.68 . . . . 0.0 109.417 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.39 -33.08 74.44 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.286 179.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.2 tt -78.5 -28.42 46.33 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 178.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.7 mm -68.5 -30.82 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -71.76 -30.27 65.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.648 -0.658 . . . . 0.0 109.979 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -74.72 -32.9 62.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.636 -0.665 . . . . 0.0 109.716 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.4 mtt -70.13 -29.77 66.78 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.692 -0.63 . . . . 0.0 109.983 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -73.81 -35.12 64.83 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.584 -0.697 . . . . 0.0 110.044 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -75.55 -29.93 59.54 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.636 -0.665 . . . . 0.0 109.876 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 68.4 t -76.05 -29.88 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.608 -0.682 . . . . 0.0 109.653 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -75.73 -35.93 60.09 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.653 -0.654 . . . . 0.0 109.834 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.4 mtt85 -71.46 -28.45 63.96 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.632 -0.668 . . . . 0.0 109.723 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -70.19 -32.96 71.14 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.531 -0.731 . . . . 0.0 109.953 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 76.0 mt -70.88 -29.05 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.568 -0.707 . . . . 0.0 109.766 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.9 m -71.34 -34.73 70.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.574 -0.704 . . . . 0.0 109.742 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.22 -43.85 66.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.615 -0.678 . . . . 0.0 109.731 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 73.4 t -71.95 -31.53 40.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.577 -0.702 . . . . 0.0 109.426 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.49 -30.18 59.79 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.659 -0.651 . . . . 0.0 109.704 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 12.0 tp-100 -73.03 -30.13 63.52 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.643 -0.66 . . . . 0.0 109.843 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -37.44 73.73 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.683 -0.636 . . . . 0.0 109.823 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 75.8 mt -71.26 -31.15 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.63 -0.668 . . . . 0.0 109.554 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 6.4 m -68.49 -35.0 76.9 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.679 -0.638 . . . . 0.0 109.517 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 3.5 mmmm -74.73 -37.05 62.64 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.702 -0.624 . . . . 0.0 109.393 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.92 -31.82 68.56 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.635 -0.665 . . . . 0.0 109.367 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.7 tptm -66.56 -40.25 88.92 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.724 -0.61 . . . . 0.0 109.446 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -64.37 -31.62 72.9 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.666 -0.646 . . . . 0.0 109.43 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -63.74 -36.39 83.73 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.671 -0.643 . . . . 0.0 109.462 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -62.83 -30.03 71.18 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.774 -0.579 . . . . 0.0 109.632 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.54 -44.24 97.41 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.646 -0.659 . . . . 0.0 109.894 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -63.55 -39.98 95.82 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.699 -0.626 . . . . 0.0 109.699 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.6 tp -70.8 -40.64 72.4 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.655 -0.653 . . . . 0.0 109.721 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -73.12 -30.5 63.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.656 -0.653 . . . . 0.0 109.668 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -74.84 -29.97 61.22 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.69 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -69.79 -30.25 67.75 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.663 -0.648 . . . . 0.0 109.659 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -64.07 -30.28 71.36 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.651 -0.656 . . . . 0.0 109.762 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -110.57 28.46 8.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.698 -0.626 . . . . 0.0 110.086 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -107.63 88.3 4.16 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.535 -0.728 . . . . 0.0 110.178 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo . . . . . 0 C--N 1.318 -1.071 0 O-C-N 123.354 1.186 . . . . 0.0 110.404 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 19.0 pttp . . . . . 0 N--CA 1.493 1.699 0 CA-C-O 121.141 0.496 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -126.4 -169.63 2.05 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.552 -0.717 . . . . 0.0 110.187 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 52.87 38.74 27.59 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.465 -0.772 . . . . 0.0 110.758 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 7.0 mtt -135.03 -43.71 0.72 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.608 -0.682 . . . . 0.0 110.413 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.66 -28.65 68.75 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.63 -0.669 . . . . 0.0 110.269 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -77.24 -32.32 55.67 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.637 -0.665 . . . . 0.0 109.982 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -74.94 -27.05 60.04 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.698 -0.626 . . . . 0.0 110.01 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 20.0 mtp -75.74 -28.74 58.61 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.6 -0.688 . . . . 0.0 110.096 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.2 t -74.33 -29.23 61.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.565 -0.71 . . . . 0.0 110.135 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.0 tp -75.41 -28.34 59.37 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.663 -0.648 . . . . 0.0 110.084 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.16 -32.38 61.28 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.534 -0.729 . . . . 0.0 110.127 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -75.89 -36.79 59.36 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.629 -0.669 . . . . 0.0 109.735 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 89.6 m -71.87 -30.51 65.5 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.734 -0.603 . . . . 0.0 109.446 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -67.1 -28.91 68.56 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.593 -0.692 . . . . 0.0 109.767 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -63.49 -40.17 96.38 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.623 -0.673 . . . . 0.0 110.058 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -74.22 -34.54 63.71 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.653 -0.654 . . . . 0.0 109.609 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.8 mt -74.63 -27.05 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.744 -0.598 . . . . 0.0 109.578 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.3 tt -73.01 -31.56 64.55 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.544 -0.723 . . . . 0.0 109.843 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -30.88 70.94 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.509 -0.744 . . . . 0.0 109.843 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.9 mt -65.02 -29.1 69.99 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.624 -0.673 . . . . 0.0 110.036 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -66.76 -35.32 79.83 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.653 -0.654 . . . . 0.0 110.076 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.5 -32.8 58.53 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.603 -0.686 . . . . 0.0 109.826 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.7 tmtm? -77.73 -30.19 51.53 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.729 -0.607 . . . . 0.0 109.586 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 27.8 tp -79.16 -30.19 43.42 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.665 -0.647 . . . . 0.0 109.78 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.4 mp -77.68 -31.28 52.41 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.634 -0.666 . . . . 0.0 109.719 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.26 -28.66 59.9 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.655 -0.653 . . . . 0.0 109.875 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.6 tp -76.48 -36.24 57.94 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.603 -0.686 . . . . 0.0 109.893 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -73.04 -30.46 63.74 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.614 -0.679 . . . . 0.0 109.694 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -70.85 -27.95 64.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.677 -0.64 . . . . 0.0 109.875 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -39.67 81.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.571 -0.706 . . . . 0.0 109.935 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -68.99 -29.72 67.98 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.592 -0.693 . . . . 0.0 109.91 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -69.91 -29.75 67.01 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.7 -0.625 . . . . 0.0 109.943 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -67.15 -36.27 81.48 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.66 -0.65 . . . . 0.0 109.861 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mt -59.99 -36.59 77.51 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.659 -0.651 . . . . 0.0 110.01 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -63.6 -51.66 64.31 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.618 -0.676 . . . . 0.0 109.666 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.6 mt -62.14 -27.36 68.89 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.696 -0.627 . . . . 0.0 109.611 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -107.78 21.12 17.88 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.621 -0.674 . . . . 0.0 110.417 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.4 mt . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.445 -179.961 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.67 -61.9 1.86 Allowed 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.545 -0.974 . . . . 0.0 111.596 -179.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 5.3 t -149.14 14.74 0.9 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.995 -1.065 . . . . 0.0 111.328 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 19.6 tptt 49.94 26.21 1.92 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.081 -1.012 . . . . 0.0 110.867 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -150.86 -46.48 0.12 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.695 -0.628 . . . . 0.0 109.753 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.76 -42.64 85.8 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.355 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 9.8 tp -71.44 -28.78 64.21 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.0 mm -66.35 -32.1 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -74.94 -31.17 61.43 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.734 -0.604 . . . . 0.0 109.637 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -71.64 -29.95 65.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.692 -0.63 . . . . 0.0 109.805 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -68.06 -32.31 72.57 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.657 -0.652 . . . . 0.0 109.938 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -72.65 -34.49 67.3 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.616 -0.677 . . . . 0.0 109.933 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.41 -29.68 61.62 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.823 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 67.6 t -74.44 -30.17 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.638 -0.664 . . . . 0.0 109.75 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -71.94 -30.84 65.73 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.671 -0.643 . . . . 0.0 110.045 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -28.8 61.31 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.635 -0.666 . . . . 0.0 109.933 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -74.63 -37.24 62.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.587 -0.696 . . . . 0.0 109.928 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 90.3 mt -71.19 -29.66 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.689 -0.632 . . . . 0.0 109.592 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 65.5 m -70.71 -33.79 71.23 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.664 -0.648 . . . . 0.0 109.664 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.0 mtt -70.18 -44.54 68.52 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.637 -0.664 . . . . 0.0 109.686 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 67.4 t -66.92 -30.98 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.676 -0.64 . . . . 0.0 109.563 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.88 -30.69 68.19 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.654 -0.653 . . . . 0.0 109.808 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -36.59 80.32 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.663 -0.648 . . . . 0.0 109.712 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -38.56 82.06 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.633 -0.667 . . . . 0.0 109.85 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 72.9 mt -70.62 -37.09 68.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.623 -0.673 . . . . 0.0 109.667 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 32.5 m -68.87 -33.39 73.72 Favored 'General case' 0 N--CA 1.496 1.842 0 C-N-CA 120.192 -0.603 . . . . 0.0 109.605 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -77.01 -33.03 57.51 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.629 -0.67 . . . . 0.0 109.488 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.31 -33.14 65.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.68 -0.638 . . . . 0.0 109.324 179.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 16.5 tptt -65.4 -38.69 90.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.567 -0.708 . . . . 0.0 109.394 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -67.57 -31.24 71.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.627 -0.67 . . . . 0.0 109.336 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -37.1 86.01 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.664 -0.648 . . . . 0.0 109.422 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -62.79 -30.35 71.4 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.702 -0.624 . . . . 0.0 109.691 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -61.52 -41.2 96.95 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.672 -0.643 . . . . 0.0 109.874 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -62.29 -41.83 98.83 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.24 -0.584 . . . . 0.0 109.849 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.3 tp -72.36 -30.66 64.91 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.69 -0.631 . . . . 0.0 109.765 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -77.37 -30.67 53.87 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.679 -0.638 . . . . 0.0 109.832 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -77.07 -29.04 54.9 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.699 -0.626 . . . . 0.0 109.852 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -77.68 -29.27 51.36 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.637 -0.665 . . . . 0.0 110.012 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.94 -28.32 43.72 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.549 -0.719 . . . . 0.0 110.121 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -97.65 -25.69 15.02 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.626 -0.671 . . . . 0.0 110.278 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 24.3 mttt 52.89 87.07 0.14 Allowed Pre-proline 0 N--CA 1.501 2.107 0 O-C-N 121.369 -0.832 . . . . 0.0 110.807 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo . . . . . 0 C--N 1.317 -1.099 0 O-C-N 123.448 1.236 . . . . 0.0 110.409 179.951 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 121.009 0.433 . . . . 0.0 110.363 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 170.45 3.26 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.547 -0.72 . . . . 0.0 110.272 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -82.54 -28.81 30.78 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.674 -0.641 . . . . 0.0 110.221 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.1 mtm -61.91 -24.41 66.95 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.601 -0.687 . . . . 0.0 110.455 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.15 -39.01 81.09 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.496 -0.752 . . . . 0.0 110.364 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.93 -34.01 66.3 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.664 -0.648 . . . . 0.0 109.762 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -73.54 -28.03 61.66 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.71 -0.618 . . . . 0.0 109.771 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 48.4 mtp -72.21 -29.38 63.91 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.576 -0.703 . . . . 0.0 109.941 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.9 p -69.06 -30.73 69.13 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.648 -0.658 . . . . 0.0 109.897 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.6 tp -67.56 -28.69 68.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.68 -0.637 . . . . 0.0 109.923 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -65.75 -30.0 70.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.53 -0.731 . . . . 0.0 110.009 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -48.99 66.1 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.59 -0.694 . . . . 0.0 109.976 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 26.6 m -67.02 -30.61 70.75 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.612 -0.68 . . . . 0.0 109.472 179.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -68.97 -28.12 66.34 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.681 -0.637 . . . . 0.0 109.883 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -65.19 -39.08 92.37 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.553 -0.717 . . . . 0.0 109.943 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.73 -41.09 65.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.615 -0.678 . . . . 0.0 109.42 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.402 HG21 HD12 ' A' ' 69' ' ' ILE . 87.4 mt -66.43 -27.21 39.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 mt -62.65 -41.32 98.99 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.588 -0.695 . . . . 0.0 109.629 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -65.14 -30.35 71.27 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.53 -0.731 . . . . 0.0 109.621 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 12.3 mt -73.05 -29.02 62.66 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.691 -0.63 . . . . 0.0 109.95 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.78 -34.71 72.07 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.599 -0.688 . . . . 0.0 109.881 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -74.03 -29.94 62.18 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.619 -0.676 . . . . 0.0 109.73 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -73.66 -30.02 62.67 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.637 -0.664 . . . . 0.0 109.916 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.0 tp -75.32 -32.51 60.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.638 -0.664 . . . . 0.0 109.935 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.54 -30.94 57.32 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.633 -0.667 . . . . 0.0 109.748 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.23 -28.84 60.06 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.688 -0.632 . . . . 0.0 109.845 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -75.08 -36.95 61.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.536 -0.728 . . . . 0.0 109.823 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -70.63 -29.85 66.34 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.538 -0.726 . . . . 0.0 109.802 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -69.78 -27.85 65.25 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.693 -0.629 . . . . 0.0 109.973 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -40.37 83.8 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.544 -0.723 . . . . 0.0 109.849 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -69.14 -30.46 68.72 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.474 -0.766 . . . . 0.0 109.627 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.4 t-80 -67.19 -29.62 69.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.655 -0.653 . . . . 0.0 109.826 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -63.06 -36.17 82.7 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.624 -0.672 . . . . 0.0 109.936 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.52 -32.56 73.44 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.582 -0.699 . . . . 0.0 109.887 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -66.9 -29.48 69.37 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.658 -0.651 . . . . 0.0 109.996 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.0 mt -66.86 -29.29 69.17 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.601 -0.687 . . . . 0.0 110.049 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -120.14 29.28 7.59 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.58 -0.7 . . . . 0.0 110.161 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 27.7 tp . . . . . 0 N--CA 1.497 1.906 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.053 179.983 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.74 -82.62 0.21 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.681 -0.893 . . . . 0.0 110.413 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 59.8 p -129.5 19.52 5.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.13 -0.981 . . . . 0.0 110.825 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 5.7 tptm 50.61 25.99 2.26 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.272 -0.893 . . . . 0.0 110.616 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -148.79 -46.0 0.15 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.648 -0.657 . . . . 0.0 109.605 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.33 -33.16 73.79 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.92 -0.712 . . . . 0.0 109.322 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 2.7 tt -78.11 -28.37 48.59 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 178.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.8 mm -67.54 -30.76 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.736 -0.602 . . . . 0.0 109.381 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -72.04 -29.73 64.46 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.668 -0.645 . . . . 0.0 109.926 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -75.44 -30.95 60.16 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.611 -0.681 . . . . 0.0 109.8 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.92 -29.14 63.99 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.734 -0.604 . . . . 0.0 109.84 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -70.42 -29.96 66.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.592 -0.692 . . . . 0.0 110.027 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.9 ttp180 -71.99 -36.36 69.75 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.617 -0.677 . . . . 0.0 109.923 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 58.4 t -67.22 -29.82 47.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.707 -0.62 . . . . 0.0 109.881 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . 0.408 ' O ' ' OG1' ' B' ' 184' ' ' THR . 8.1 t0 -69.12 -28.95 66.92 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.632 -0.667 . . . . 0.0 110.141 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.36 -30.0 63.01 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.654 -0.654 . . . . 0.0 110.066 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -74.63 -35.74 62.9 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.597 -0.689 . . . . 0.0 109.956 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.9 mt -71.82 -30.85 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.705 -0.622 . . . . 0.0 109.56 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 184' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 4.7 m -69.71 -35.14 74.78 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.63 -0.669 . . . . 0.0 109.617 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.7 ttp -66.61 -44.84 81.0 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.654 -0.654 . . . . 0.0 109.815 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 64.6 t -68.96 -30.65 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.628 -0.67 . . . . 0.0 109.476 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -70.18 -28.51 65.38 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.67 -0.644 . . . . 0.0 110.021 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -67.47 -32.86 73.99 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.582 -0.699 . . . . 0.0 110.041 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.05 -33.65 57.22 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.663 -0.648 . . . . 0.0 109.67 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 75.2 mt -76.01 -27.91 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.615 -0.678 . . . . 0.0 109.705 179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.33 -30.48 63.38 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.632 -0.667 . . . . 0.0 109.572 179.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 19.8 mmtt -76.27 -37.11 58.0 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.596 -0.69 . . . . 0.0 109.749 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.03 -30.79 67.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.615 -0.678 . . . . 0.0 109.428 179.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.1 tptm -67.56 -38.26 83.88 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.635 -0.665 . . . . 0.0 109.614 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.3 tptt -69.62 -30.28 67.98 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.575 -0.703 . . . . 0.0 109.533 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -67.52 -32.77 73.8 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.603 -0.685 . . . . 0.0 109.606 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -65.27 -30.91 71.82 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.692 -0.63 . . . . 0.0 109.684 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -43.42 98.88 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.765 -0.584 . . . . 0.0 109.93 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -46.76 87.84 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.696 -0.627 . . . . 0.0 109.942 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 4.8 tp -70.27 -32.87 70.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.649 -0.657 . . . . 0.0 109.725 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -77.22 -29.68 54.3 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.642 -0.661 . . . . 0.0 109.878 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -78.41 -28.8 46.93 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.648 -0.657 . . . . 0.0 109.875 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -79.58 -29.46 41.26 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.582 -0.699 . . . . 0.0 109.977 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -81.05 -27.62 35.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.667 -0.646 . . . . 0.0 110.108 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -91.82 -26.38 18.54 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.548 -0.72 . . . . 0.0 110.349 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 16.0 mmtp 53.06 84.33 0.21 Allowed Pre-proline 0 N--CA 1.501 2.108 0 O-C-N 121.298 -0.876 . . . . 0.0 110.769 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo . . . . . 0 C--N 1.318 -1.052 0 O-C-N 123.49 1.258 . . . . 0.0 110.428 -179.989 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.066 0.46 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.4 pttt -164.47 169.0 17.79 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.554 -0.716 . . . . 0.0 110.251 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -154.28 28.2 0.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.594 -0.691 . . . . 0.0 110.205 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -155.79 -44.03 0.08 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.565 -0.709 . . . . 0.0 110.072 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.7 mp0 -60.17 -27.71 67.34 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.634 -0.666 . . . . 0.0 110.262 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -72.5 -29.21 63.42 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.553 -0.717 . . . . 0.0 110.094 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -70.67 -28.7 64.98 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.696 -0.628 . . . . 0.0 110.053 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.2 ttp -69.04 -29.27 67.39 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.575 -0.703 . . . . 0.0 110.001 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.9 t -72.37 -29.58 63.91 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.568 -0.707 . . . . 0.0 110.023 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.85 -27.44 63.85 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.626 -0.671 . . . . 0.0 110.168 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -70.68 -29.32 65.6 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.55 -0.719 . . . . 0.0 110.184 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -74.74 -40.22 61.39 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.58 -0.7 . . . . 0.0 109.973 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.7 m -71.48 -29.75 65.19 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.729 -0.607 . . . . 0.0 109.723 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.5 mmtp -72.5 -28.48 62.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.649 -0.657 . . . . 0.0 109.925 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -34.6 73.12 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.59 -0.694 . . . . 0.0 109.979 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -37.17 65.64 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.668 -0.645 . . . . 0.0 109.706 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.5 mt -68.77 -27.77 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.714 -0.616 . . . . 0.0 109.619 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.22 -35.93 80.62 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.58 -0.7 . . . . 0.0 109.936 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.0 mttt -70.03 -30.18 67.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.6 -0.687 . . . . 0.0 109.96 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -70.86 -28.7 64.76 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.61 -0.681 . . . . 0.0 109.964 179.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.34 -35.82 76.3 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.535 -0.728 . . . . 0.0 110.099 179.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -73.11 -31.7 64.49 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.716 -0.615 . . . . 0.0 109.827 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -75.04 -34.71 61.89 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.687 -0.633 . . . . 0.0 109.788 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.0 tp -74.19 -30.42 62.21 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.663 -0.648 . . . . 0.0 109.703 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.5 tp -74.8 -35.34 62.5 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.74 -0.6 . . . . 0.0 109.69 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.97 -29.82 68.12 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.707 -0.621 . . . . 0.0 109.758 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.8 mp -69.81 -43.1 72.76 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.767 -0.583 . . . . 0.0 109.813 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -66.64 -29.14 69.09 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.657 -0.652 . . . . 0.0 109.89 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -69.33 -30.46 68.51 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.557 -0.714 . . . . 0.0 109.826 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.4 -48.26 50.99 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.619 -0.676 . . . . 0.0 109.729 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.5 tttp -63.87 -29.52 70.7 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.587 -0.696 . . . . 0.0 109.568 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -66.08 -29.98 70.41 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.675 -0.641 . . . . 0.0 109.948 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -64.15 -40.62 96.52 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.638 -0.664 . . . . 0.0 109.86 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.8 mt -60.41 -33.5 72.58 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.557 -0.715 . . . . 0.0 110.066 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -63.8 -47.13 82.09 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.59 -0.694 . . . . 0.0 109.786 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.54 -28.63 68.69 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.722 -0.611 . . . . 0.0 109.678 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.48 13.06 36.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.679 -0.638 . . . . 0.0 110.81 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 27.7 tp . . . . . 0 N--CA 1.499 1.984 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.315 -179.92 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -144.64 -68.93 0.3 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.556 -0.967 . . . . 0.0 110.67 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 13.1 t -145.44 16.41 1.48 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.225 -0.922 . . . . 0.0 110.974 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.7 tptm 50.65 26.06 2.32 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.119 -0.988 . . . . 0.0 110.615 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -149.14 -46.58 0.14 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.606 -0.684 . . . . 0.0 109.491 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -66.26 -37.13 84.76 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.979 -0.688 . . . . 0.0 109.395 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.2 -28.66 60.08 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.5 mm -66.84 -30.49 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.67 -0.644 . . . . 0.0 109.341 179.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -74.56 -30.12 61.62 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.68 -0.638 . . . . 0.0 109.847 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -74.38 -29.3 61.49 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.639 -0.663 . . . . 0.0 109.979 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.49 -29.63 63.8 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.68 -0.638 . . . . 0.0 109.952 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -75.79 -28.96 58.58 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.657 -0.652 . . . . 0.0 110.138 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.91 -31.76 56.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.582 -0.699 . . . . 0.0 109.898 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 66.4 t -74.93 -29.29 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.668 -0.645 . . . . 0.0 109.774 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . 0.403 ' O ' ' OG1' ' B' ' 184' ' ' THR . 14.6 t70 -73.7 -28.26 61.63 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.59 -0.694 . . . . 0.0 110.089 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.09 -31.38 64.32 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.625 -0.672 . . . . 0.0 110.101 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -73.53 -37.65 65.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.609 -0.682 . . . . 0.0 110.004 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 85.1 mt -68.57 -28.1 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.704 -0.623 . . . . 0.0 109.702 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 184' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 2.7 m -67.46 -34.54 77.39 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.492 -0.755 . . . . 0.0 109.85 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -48.26 69.41 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.552 -0.718 . . . . 0.0 109.833 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.5 t -64.44 -28.93 45.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.61 -0.681 . . . . 0.0 109.816 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -70.81 -28.94 65.0 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.638 -0.664 . . . . 0.0 110.068 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -68.95 -31.31 70.09 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.548 -0.72 . . . . 0.0 110.047 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -40.53 65.48 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.703 -0.623 . . . . 0.0 109.893 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 77.2 mt -70.5 -28.51 35.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.687 -0.633 . . . . 0.0 109.819 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.0 m -73.85 -36.03 64.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.554 -0.716 . . . . 0.0 109.842 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -77.17 -31.08 55.22 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.615 -0.678 . . . . 0.0 109.611 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.78 -21.76 51.18 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.576 -0.702 . . . . 0.0 110.159 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.8 tptm -81.35 -27.54 34.87 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.325 -0.86 . . . . 0.0 109.673 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 27.4 tptt -75.67 -35.3 60.42 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.54 -0.725 . . . . 0.0 109.94 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 13.8 pttt -69.04 -25.42 64.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.511 -0.743 . . . . 0.0 109.892 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -71.8 -29.96 65.01 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.521 -0.737 . . . . 0.0 109.603 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -62.38 -41.91 99.01 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.705 -0.622 . . . . 0.0 109.751 179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.75 -38.79 91.94 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.733 -0.604 . . . . 0.0 109.639 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.6 tp -75.7 -32.33 60.04 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.61 -0.681 . . . . 0.0 109.508 179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.45 -30.49 47.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.658 -0.651 . . . . 0.0 109.738 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -79.19 -29.11 42.74 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.633 -0.667 . . . . 0.0 109.812 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -79.65 -28.74 40.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.637 -0.664 . . . . 0.0 109.928 179.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -80.86 -28.15 36.16 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.564 -0.71 . . . . 0.0 110.074 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -92.64 -27.07 17.53 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.553 -0.717 . . . . 0.0 110.313 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt 52.61 69.55 2.32 Favored Pre-proline 0 N--CA 1.501 2.077 0 O-C-N 121.428 -0.795 . . . . 0.0 110.73 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.317 -1.112 0 O-C-N 123.306 1.161 . . . . 0.0 110.389 179.998 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.7 mttp . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.113 0.482 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -86.54 -161.2 0.63 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.568 -0.708 . . . . 0.0 110.276 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 52.67 24.78 3.33 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.424 -0.797 . . . . 0.0 110.854 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.1 tpt -103.43 -36.23 8.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.504 -0.747 . . . . 0.0 109.985 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.35 -29.35 68.06 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.689 -0.632 . . . . 0.0 109.943 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -69.12 -29.45 67.51 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.637 -0.664 . . . . 0.0 110.006 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.23 -38.77 88.71 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.589 -0.694 . . . . 0.0 109.804 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.3 mtp -65.9 -31.01 71.7 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.699 -0.625 . . . . 0.0 109.622 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 29.5 t -63.56 -30.03 71.21 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.716 -0.615 . . . . 0.0 109.718 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.7 tp -61.82 -28.96 69.84 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.621 -0.675 . . . . 0.0 110.048 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -69.97 -48.65 57.43 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.479 -0.763 . . . . 0.0 109.982 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.92 -30.94 70.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.73 -0.606 . . . . 0.0 109.797 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 84.1 m -74.67 -30.71 61.68 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.69 -0.631 . . . . 0.0 109.742 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -71.41 -27.18 63.13 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.603 -0.686 . . . . 0.0 110.064 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -72.41 -35.1 68.3 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.598 -0.688 . . . . 0.0 110.22 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 -76.22 -35.07 59.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.69 -0.631 . . . . 0.0 109.792 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.4 ' CD1' ' NE2' ' B' ' 197' ' ' GLN . 62.2 mt -75.2 -27.14 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.683 -0.636 . . . . 0.0 109.494 179.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.83 -34.55 62.35 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.58 -0.7 . . . . 0.0 109.887 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -71.41 -33.51 69.51 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.564 -0.71 . . . . 0.0 109.613 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.6 mt -66.92 -33.0 74.64 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.655 -0.653 . . . . 0.0 109.853 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -67.67 -36.85 81.47 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.613 -0.679 . . . . 0.0 109.878 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -71.21 -32.0 68.3 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.63 -0.669 . . . . 0.0 109.412 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -67.86 -36.05 79.61 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.701 -0.624 . . . . 0.0 109.825 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 21.4 tp -68.49 -30.09 68.85 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.644 -0.66 . . . . 0.0 109.844 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.5 mt -75.07 -38.84 61.17 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.643 -0.661 . . . . 0.0 109.771 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.75 -28.99 66.25 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.688 -0.633 . . . . 0.0 109.902 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.9 tp -72.88 -37.25 67.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.587 -0.696 . . . . 0.0 110.022 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -70.04 -30.65 67.98 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.558 -0.713 . . . . 0.0 109.689 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -28.42 67.46 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.738 -0.601 . . . . 0.0 109.839 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -45.04 80.3 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.641 -0.662 . . . . 0.0 109.778 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.05 -30.86 71.85 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.605 -0.684 . . . . 0.0 109.665 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -65.32 -30.93 71.82 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.723 -0.61 . . . . 0.0 109.823 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -65.27 -32.33 73.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.594 -0.691 . . . . 0.0 109.839 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.28 -33.92 76.83 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.642 -0.661 . . . . 0.0 109.71 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -60.85 -34.8 75.14 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.642 -0.661 . . . . 0.0 109.862 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.7 mp -69.86 -29.38 66.6 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.732 -0.605 . . . . 0.0 109.775 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -95.09 -15.74 23.18 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.631 -0.668 . . . . 0.0 110.634 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 16.8 tp . . . . . 0 N--CA 1.501 2.094 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.746 -179.749 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.371 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.13 -52.17 37.32 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.581 -0.952 . . . . 0.0 111.746 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 25.2 p -153.07 15.23 0.54 Allowed 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.119 -0.988 . . . . 0.0 111.532 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 27.3 tptt 49.78 26.19 1.81 Allowed 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.077 -1.014 . . . . 0.0 110.893 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -150.5 -47.56 0.12 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.674 -0.641 . . . . 0.0 109.739 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -74.54 -31.56 62.16 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.053 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 2.9 tt -76.47 -28.18 56.41 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.0 mm -68.49 -30.2 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.642 -0.661 . . . . 0.0 109.624 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -70.89 -29.43 65.51 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.67 -0.644 . . . . 0.0 109.984 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -75.71 -29.66 59.04 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.674 -0.642 . . . . 0.0 110.065 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -75.53 -29.38 59.43 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.625 -0.672 . . . . 0.0 110.023 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.2 -31.29 58.38 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.617 -0.677 . . . . 0.0 110.05 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -28.51 58.67 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.67 -0.644 . . . . 0.0 110.001 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 60.1 t -76.12 -31.94 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.62 -0.675 . . . . 0.0 109.723 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -73.54 -29.92 62.75 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.591 -0.693 . . . . 0.0 109.917 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.2 -29.77 63.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.724 -0.61 . . . . 0.0 109.894 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -72.72 -38.82 67.33 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.653 -0.655 . . . . 0.0 109.953 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 88.1 mt -66.74 -28.02 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.694 -0.629 . . . . 0.0 109.702 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.0 m -67.26 -35.78 80.24 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.601 -0.687 . . . . 0.0 109.889 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.8 ttt -72.13 -37.52 69.42 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.648 -0.658 . . . . 0.0 109.856 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.0 -30.69 32.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.591 -0.693 . . . . 0.0 109.618 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -74.12 -28.62 61.44 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.726 -0.608 . . . . 0.0 110.077 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -29.33 61.77 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.603 -0.686 . . . . 0.0 110.044 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -37.63 61.15 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.7 -0.625 . . . . 0.0 109.94 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.415 HD11 HG22 ' B' ' 190' ' ' ILE . 81.4 mt -72.51 -30.52 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.602 -0.686 . . . . 0.0 109.635 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 17.8 m -71.65 -34.94 70.18 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.631 -0.668 . . . . 0.0 109.604 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.6 mmtp -75.34 -37.77 60.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.644 -0.66 . . . . 0.0 109.383 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.6 -30.26 65.6 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.743 -0.598 . . . . 0.0 109.455 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 17.1 tptt -70.29 -41.03 73.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.699 -0.626 . . . . 0.0 109.622 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.9 mmtm -67.14 -31.28 71.6 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.631 -0.668 . . . . 0.0 109.33 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -63.75 -36.15 82.94 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.681 -0.637 . . . . 0.0 109.293 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . 0.4 ' NE2' ' CD1' ' A' ' 69' ' ' ILE . 47.2 tt0 -63.07 -30.23 71.43 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.773 -0.58 . . . . 0.0 109.58 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -60.99 -41.95 97.47 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.691 -0.631 . . . . 0.0 109.911 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -61.75 -49.52 76.06 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.664 -0.647 . . . . 0.0 109.895 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 19.5 tp -68.27 -29.86 68.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.621 -0.675 . . . . 0.0 109.685 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -76.93 -31.37 56.6 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 0.0 109.929 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -78.17 -34.1 49.84 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.729 -0.607 . . . . 0.0 109.709 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -77.17 -27.48 53.76 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.684 -0.635 . . . . 0.0 109.909 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -79.66 -25.32 41.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.538 -0.726 . . . . 0.0 110.305 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -86.13 -27.88 24.35 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.497 -0.752 . . . . 0.0 110.115 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 15.8 mmtp -61.77 149.48 84.93 Favored Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 121.598 -0.689 . . . . 0.0 110.111 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.318 -1.04 0 O-C-N 123.33 1.174 . . . . 0.0 110.403 179.985 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.092 0.472 . . . . 0.0 110.143 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.9 mttp -98.24 173.0 7.22 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.569 -0.707 . . . . 0.0 110.239 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -79.28 -28.88 42.3 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.565 -0.709 . . . . 0.0 110.148 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 21.5 mtt -82.84 -24.71 33.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.613 -0.679 . . . . 0.0 110.428 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -58.6 -27.82 65.02 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.452 -0.78 . . . . 0.0 110.434 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -75.1 -29.67 60.67 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.579 -0.7 . . . . 0.0 109.962 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 24.5 mtt85 -72.62 -28.46 62.78 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 110.031 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 10.3 mmm -70.89 -29.98 66.22 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.66 -0.65 . . . . 0.0 109.998 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.9 m -67.65 -30.38 69.92 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.618 -0.676 . . . . 0.0 109.918 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.97 -28.44 69.51 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.727 -0.608 . . . . 0.0 110.041 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -64.28 -31.54 72.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.641 -0.662 . . . . 0.0 110.001 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -70.44 -47.75 59.22 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.598 -0.689 . . . . 0.0 109.92 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.9 m -66.49 -31.36 72.05 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.739 -0.601 . . . . 0.0 109.538 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.92 -27.23 65.58 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.672 -0.642 . . . . 0.0 109.896 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -66.54 -36.02 81.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.498 -0.751 . . . . 0.0 109.988 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.0 tp60 -76.39 -34.56 58.85 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.567 -0.708 . . . . 0.0 109.563 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.9 mt -73.26 -27.51 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.691 -0.63 . . . . 0.0 109.491 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.1 tp -71.77 -38.78 70.29 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.556 -0.715 . . . . 0.0 109.953 179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.3 mmtt -65.64 -35.44 80.79 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.543 -0.723 . . . . 0.0 109.728 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.2 mt -69.54 -27.96 65.61 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.72 -0.612 . . . . 0.0 109.809 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -69.91 -38.91 76.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.579 -0.701 . . . . 0.0 109.975 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -67.38 -41.38 85.11 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.681 -0.637 . . . . 0.0 109.62 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.7 tptt -64.32 -35.23 80.18 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.77 -0.581 . . . . 0.0 109.713 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.5 tp -73.49 -31.41 63.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.679 -0.638 . . . . 0.0 109.529 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 tp -70.51 -34.83 72.76 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.693 -0.629 . . . . 0.0 109.702 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.04 -30.78 62.58 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.721 -0.612 . . . . 0.0 109.68 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.16 -37.76 57.53 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.649 -0.657 . . . . 0.0 109.643 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -71.96 -29.75 64.59 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.617 -0.677 . . . . 0.0 109.686 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.5 -29.68 66.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 109.72 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -68.48 -43.67 76.41 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.612 -0.68 . . . . 0.0 109.744 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -64.7 -29.93 70.93 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.555 -0.716 . . . . 0.0 109.647 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -64.33 -32.56 74.22 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.699 -0.625 . . . . 0.0 109.829 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -73.57 -35.33 65.43 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.672 -0.642 . . . . 0.0 109.715 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.401 ' CD2' ' CD2' ' B' ' 172' ' ' LEU . 3.2 mt -70.87 -33.32 70.5 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.69 -0.631 . . . . 0.0 109.685 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.27 -33.12 73.79 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.715 -0.616 . . . . 0.0 109.718 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 tp -79.16 -30.0 43.31 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.643 -0.661 . . . . 0.0 109.764 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -89.11 -8.7 53.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.626 -0.672 . . . . 0.0 110.848 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.4 tp . . . . . 0 N--CA 1.5 2.026 0 O-C-N 121.093 -1.004 . . . . 0.0 110.46 -179.869 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.307 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -117.75 -31.16 5.23 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.684 -0.892 . . . . 0.0 110.32 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 1.4 m -167.53 18.08 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.375 -0.828 . . . . 0.0 111.808 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 24.4 tptt 48.3 26.98 1.21 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.04 -1.038 . . . . 0.0 110.99 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.32 -47.24 0.11 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.774 -0.579 . . . . 0.0 109.695 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.79 -37.02 76.18 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.259 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . 0.401 ' CD2' ' CD2' ' A' ' 86' ' ' LEU . 3.2 mt -74.2 -28.14 61.13 Favored 'General case' 0 N--CA 1.493 1.679 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.1 mm -68.25 -31.84 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.687 -0.633 . . . . 0.0 109.404 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -74.43 -31.35 62.25 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.757 -0.589 . . . . 0.0 109.955 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -75.06 -34.21 61.79 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.62 -0.675 . . . . 0.0 109.885 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -27.23 63.15 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.611 -0.681 . . . . 0.0 109.75 179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.05 -31.71 69.47 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.553 -0.717 . . . . 0.0 110.104 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.58 -29.32 46.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.607 -0.683 . . . . 0.0 109.952 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 76.0 t -79.29 -25.8 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.639 -0.663 . . . . 0.0 109.53 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . 0.4 ' O ' ' OG1' ' B' ' 184' ' ' THR . 36.2 t70 -78.16 -38.7 43.0 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.463 -0.773 . . . . 0.0 110.073 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 10.3 ptt85 -73.09 -24.8 60.7 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 119.868 -0.733 . . . . 0.0 110.158 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -80.78 -37.02 31.02 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.511 -0.743 . . . . 0.0 109.87 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 76.0 mt -76.52 -27.32 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.611 -0.681 . . . . 0.0 109.556 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 184' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 72.2 m -76.62 -30.98 57.12 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.496 -0.752 . . . . 0.0 109.676 179.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.5 mtp -76.07 -39.32 55.68 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.619 -0.676 . . . . 0.0 109.666 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.3 t -72.98 -29.9 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.628 -0.67 . . . . 0.0 109.499 179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -72.75 -28.15 62.45 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.539 -0.726 . . . . 0.0 109.984 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.94 -34.48 69.07 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.635 -0.666 . . . . 0.0 109.985 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -40.67 64.04 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.622 -0.674 . . . . 0.0 109.684 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.406 HD12 HG22 ' B' ' 190' ' ' ILE . 84.2 mt -71.04 -30.54 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.654 -0.654 . . . . 0.0 109.477 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 50.9 m -69.26 -35.57 76.21 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.688 -0.633 . . . . 0.0 109.41 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.9 mmmt -76.53 -36.4 57.72 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.75 -30.01 65.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.683 -0.636 . . . . 0.0 109.531 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -69.24 -37.75 78.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.613 -0.679 . . . . 0.0 109.764 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.6 -31.23 71.13 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.562 -0.711 . . . . 0.0 109.467 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -64.13 -36.49 84.2 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.659 -0.65 . . . . 0.0 109.742 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -63.77 -30.59 71.67 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.667 -0.646 . . . . 0.0 109.867 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.39 -38.61 90.28 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.59 -0.693 . . . . 0.0 109.897 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -62.22 -41.47 98.42 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.715 -0.615 . . . . 0.0 109.9 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.5 tp -73.14 -32.37 64.85 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.587 -0.695 . . . . 0.0 109.687 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -77.78 -30.14 51.25 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.685 -0.635 . . . . 0.0 109.812 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -77.78 -28.31 50.47 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.626 -0.672 . . . . 0.0 109.8 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -77.23 -28.27 53.67 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.492 -0.755 . . . . 0.0 110.079 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.81 -28.44 44.5 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.561 -0.712 . . . . 0.0 110.176 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -99.22 -28.16 13.47 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.539 -0.725 . . . . 0.0 110.26 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp 52.83 92.07 0.06 OUTLIER Pre-proline 0 N--CA 1.5 2.066 0 O-C-N 121.419 -0.801 . . . . 0.0 110.736 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.317 -1.119 0 O-C-N 123.434 1.228 . . . . 0.0 110.348 -179.994 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.129 0.49 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.4 mttp -102.93 171.73 7.23 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.512 -0.742 . . . . 0.0 110.132 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -78.42 -28.97 46.88 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.536 -0.727 . . . . 0.0 110.164 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -83.72 -23.55 31.59 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.606 -0.684 . . . . 0.0 110.504 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -58.52 -31.42 67.89 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.493 -0.754 . . . . 0.0 110.361 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -71.61 -43.9 65.38 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.597 -0.69 . . . . 0.0 109.805 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -65.32 -28.15 69.1 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.73 -0.606 . . . . 0.0 109.808 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.3 mtt -68.6 -30.62 69.39 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.633 -0.667 . . . . 0.0 110.042 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.4 t -67.51 -29.77 69.27 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.649 -0.657 . . . . 0.0 109.989 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.93 -29.96 69.97 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.632 -0.668 . . . . 0.0 109.982 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -64.18 -30.0 71.08 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.66 -0.65 . . . . 0.0 109.954 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -68.45 -51.41 43.91 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.615 -0.678 . . . . 0.0 109.866 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 79.7 m -63.45 -32.08 73.42 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.637 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.41 -29.09 68.5 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.647 -0.658 . . . . 0.0 109.76 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.7 -36.7 84.72 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.66 -0.65 . . . . 0.0 109.956 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 36.6 tp60 -73.46 -35.75 65.76 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.652 -0.655 . . . . 0.0 109.708 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.439 HD12 HG21 ' A' ' 69' ' ' ILE . 84.5 mt -71.0 -28.31 32.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.656 -0.653 . . . . 0.0 109.553 179.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 9.8 tt -68.71 -37.5 79.54 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.492 -0.755 . . . . 0.0 109.806 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -65.01 -37.96 89.35 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.66 -0.65 . . . . 0.0 109.701 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 12.3 mt -62.37 -29.55 70.55 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.689 -0.632 . . . . 0.0 109.939 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 tm-20 -63.3 -42.84 99.09 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.537 -0.727 . . . . 0.0 109.945 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.19 -34.48 74.97 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.671 -0.643 . . . . 0.0 109.559 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.01 -36.9 69.84 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.733 -0.605 . . . . 0.0 109.595 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.8 tp -75.11 -31.36 61.11 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.626 -0.671 . . . . 0.0 109.582 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tt -76.06 -32.2 59.16 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.738 -0.601 . . . . 0.0 109.604 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.26 -27.09 61.37 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.1 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.48 -27.07 41.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.46 -0.775 . . . . 0.0 109.813 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -76.34 -36.58 58.16 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.582 -0.699 . . . . 0.0 109.976 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.76 -24.62 64.46 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 119.889 -0.724 . . . . 0.0 109.822 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.05 -41.8 81.5 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.495 -0.753 . . . . 0.0 109.478 179.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.4 ttpm? -68.29 -31.05 70.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.593 -0.692 . . . . 0.0 109.435 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -65.5 -30.08 70.81 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.687 -0.633 . . . . 0.0 109.734 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -61.79 -34.72 76.41 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.63 -0.669 . . . . 0.0 109.726 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.66 -30.31 66.88 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.635 -0.665 . . . . 0.0 109.81 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -69.79 -30.51 68.07 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.602 -0.686 . . . . 0.0 110.019 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.4 tp -67.5 -31.61 71.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.576 -0.703 . . . . 0.0 109.888 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -117.38 29.84 7.64 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.648 -0.657 . . . . 0.0 109.987 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.498 1.945 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.305 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.369 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.35 -82.6 0.22 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.556 -0.967 . . . . 0.0 110.453 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 8.4 t -129.48 20.74 5.64 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.946 . . . . 0.0 110.848 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.8 tptm 50.76 25.94 2.33 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.238 -0.914 . . . . 0.0 110.729 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -150.99 -45.58 0.12 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.694 -0.628 . . . . 0.0 109.724 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -67.7 -31.12 70.86 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 120.003 -0.679 . . . . 0.0 109.621 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 2.8 tt -80.94 -30.57 35.22 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.622 -0.674 . . . . 0.0 109.341 179.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . 0.437 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.0 mp -72.53 -31.29 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -64.7 -32.62 74.38 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -74.16 -32.76 63.25 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -65.23 -29.46 70.26 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.785 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -72.12 -31.94 66.48 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.566 -0.709 . . . . 0.0 110.021 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.03 -30.17 58.36 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.617 -0.677 . . . . 0.0 109.838 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 66.2 t -74.54 -29.57 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.673 -0.642 . . . . 0.0 109.689 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -72.64 -28.67 62.88 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.591 -0.693 . . . . 0.0 110.049 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -71.92 -29.52 64.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.591 -0.693 . . . . 0.0 110.02 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -72.85 -38.87 66.93 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.542 -0.724 . . . . 0.0 110.044 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 80.8 mt -68.53 -29.03 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 C-N-CA 120.172 -0.611 . . . . 0.0 109.678 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 24.6 m -68.72 -32.88 72.98 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.689 -0.632 . . . . 0.0 109.849 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.92 -47.81 60.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.556 -0.715 . . . . 0.0 109.724 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 65.6 t -70.42 -31.95 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.62 -0.675 . . . . 0.0 109.402 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -74.81 -28.89 60.9 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.771 -0.581 . . . . 0.0 109.715 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -72.59 -29.94 63.95 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.612 -0.68 . . . . 0.0 109.956 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -72.26 -34.72 68.45 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.639 -0.663 . . . . 0.0 109.841 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.432 HG23 HD12 ' B' ' 190' ' ' ILE . 80.5 mt -70.63 -31.3 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.666 -0.646 . . . . 0.0 109.511 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 4.8 m -67.31 -40.17 86.0 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.629 -0.67 . . . . 0.0 109.524 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -72.3 -34.37 68.08 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.678 -0.639 . . . . 0.0 109.337 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.01 -10.97 59.85 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.682 -0.636 . . . . 0.0 110.558 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 18.4 tptt -91.72 -28.7 17.26 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.245 -0.91 . . . . 0.0 109.227 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.0 tptm -75.61 -32.68 60.38 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.702 -0.624 . . . . 0.0 109.733 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.23 -28.58 68.18 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.493 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -69.27 -29.45 67.35 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.653 -0.654 . . . . 0.0 109.47 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -61.22 -41.72 97.35 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.641 -0.662 . . . . 0.0 109.789 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -62.37 -37.83 87.22 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.727 -0.608 . . . . 0.0 109.641 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 7.2 tp -75.08 -30.67 61.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.683 -0.636 . . . . 0.0 109.527 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -76.38 -32.13 58.4 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.708 -0.62 . . . . 0.0 109.688 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -75.22 -31.57 60.9 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.638 -0.664 . . . . 0.0 109.746 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -71.46 -30.31 65.87 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.65 -0.656 . . . . 0.0 109.81 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -67.07 -27.94 67.78 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.657 -0.652 . . . . 0.0 109.921 179.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -116.76 30.41 7.35 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.518 -0.739 . . . . 0.0 110.184 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.43 98.46 10.75 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.558 -0.714 . . . . 0.0 110.156 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo . . . . . 0 C--N 1.318 -1.056 0 O-C-N 123.329 1.173 . . . . 0.0 110.368 179.993 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.055 0.455 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.2 mttp -163.41 160.37 23.38 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.569 -0.707 . . . . 0.0 110.227 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -81.8 -28.42 33.17 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.599 -0.688 . . . . 0.0 110.25 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.6 ttt -80.96 -27.79 35.91 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.542 -0.724 . . . . 0.0 110.29 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.74 -28.14 68.46 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.523 -0.736 . . . . 0.0 110.232 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.2 -28.63 67.43 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.564 -0.71 . . . . 0.0 110.186 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.2 mtp85 -75.07 -30.16 60.9 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.535 -0.728 . . . . 0.0 110.002 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.3 mtt -72.67 -29.99 63.88 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.64 -0.662 . . . . 0.0 109.919 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.6 m -69.3 -28.5 66.32 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.619 -0.676 . . . . 0.0 109.936 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.02 -28.51 67.47 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.582 -0.699 . . . . 0.0 110.163 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -70.4 -36.1 73.84 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.619 -0.676 . . . . 0.0 110.157 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -74.7 -34.58 62.64 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.63 -0.669 . . . . 0.0 109.773 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 88.2 m -74.55 -30.55 61.79 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.705 -0.622 . . . . 0.0 109.665 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.13 -27.19 62.46 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.669 -0.645 . . . . 0.0 110.012 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -72.1 -36.23 69.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.483 -0.76 . . . . 0.0 110.187 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -72.32 -39.81 67.93 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.641 -0.662 . . . . 0.0 109.717 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 46.3 mt -66.74 -27.64 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.45 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.49 -41.44 96.46 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.623 -0.673 . . . . 0.0 109.484 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -69.96 -29.62 66.78 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.587 -0.695 . . . . 0.0 109.633 179.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.6 mt -71.11 -28.38 64.27 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.726 -0.609 . . . . 0.0 109.917 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -75.84 -34.49 60.09 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.595 -0.691 . . . . 0.0 109.929 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -31.73 68.7 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 120.182 -0.607 . . . . 0.0 109.543 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -64.58 -33.42 75.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.733 -0.604 . . . . 0.0 109.743 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 20.2 tp -72.07 -28.77 63.54 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.637 -0.665 . . . . 0.0 109.953 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 mt -75.04 -34.89 61.93 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.667 -0.646 . . . . 0.0 109.924 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.48 -31.54 65.47 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.583 -0.698 . . . . 0.0 109.949 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.5 tp -75.06 -37.25 61.71 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.711 -0.618 . . . . 0.0 109.812 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -72.26 -30.42 64.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.601 -0.687 . . . . 0.0 109.563 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -69.18 -29.2 67.14 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.208 -0.597 . . . . 0.0 109.795 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.44 -45.13 76.94 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.549 -0.719 . . . . 0.0 109.826 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.4 tttm -62.92 -29.49 70.82 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.495 -0.753 . . . . 0.0 109.563 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -62.57 -32.87 73.92 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.675 -0.641 . . . . 0.0 109.784 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -65.88 -30.8 71.46 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.682 -0.636 . . . . 0.0 109.722 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.62 -33.09 74.29 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.607 -0.683 . . . . 0.0 109.65 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -61.81 -35.69 78.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.541 -0.724 . . . . 0.0 109.89 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.7 mp -74.0 -30.29 62.4 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.735 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -85.04 -21.89 29.23 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.741 -0.599 . . . . 0.0 110.414 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.2 tp . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.574 -179.879 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.33 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.406 ' CD1' ' CB ' ' B' ' 171' ' ' GLU . 0.0 OUTLIER -141.32 -83.5 0.21 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.572 -0.958 . . . . 0.0 110.654 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.2 m -128.79 19.62 6.08 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.148 -0.97 . . . . 0.0 110.994 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.3 tptt 50.71 25.81 2.25 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.228 -0.92 . . . . 0.0 110.539 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -147.95 -46.38 0.16 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.714 -0.616 . . . . 0.0 109.394 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . 0.406 ' CB ' ' CD1' ' B' ' 167' ' ' LEU . 4.0 mm-40 -68.69 -32.93 73.1 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 119.9 -0.72 . . . . 0.0 109.276 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 13.8 tp -77.5 -29.17 52.41 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 49.3 mm -65.92 -31.6 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.669 -0.644 . . . . 0.0 109.322 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -71.28 -29.65 65.31 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.753 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -72.07 -42.35 66.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.636 -0.665 . . . . 0.0 109.772 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.82 -33.99 77.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.684 -0.635 . . . . 0.0 109.651 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.34 -30.22 57.55 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.643 -0.661 . . . . 0.0 109.807 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -77.19 -30.0 54.59 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.668 -0.645 . . . . 0.0 109.865 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 72.2 t -75.83 -30.03 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.587 -0.696 . . . . 0.0 109.592 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -74.08 -29.7 61.99 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.681 -0.637 . . . . 0.0 109.966 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -73.55 -29.43 62.44 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.65 -0.656 . . . . 0.0 109.957 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -73.28 -38.06 66.05 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.568 -0.708 . . . . 0.0 109.949 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . 0.44 HG22 HD11 ' B' ' 183' ' ' ILE . 90.2 mt -67.39 -30.0 47.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.633 -0.667 . . . . 0.0 109.634 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.3 m -66.07 -35.69 81.19 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.597 -0.689 . . . . 0.0 109.743 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -50.34 58.24 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.648 -0.658 . . . . 0.0 109.643 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.6 t -63.85 -31.9 54.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.601 -0.687 . . . . 0.0 109.314 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -65.52 -34.85 79.24 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.7 -0.625 . . . . 0.0 109.947 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -63.89 -29.98 71.11 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.642 -0.661 . . . . 0.0 109.824 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.15 -27.68 61.8 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.669 -0.644 . . . . 0.0 109.969 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.409 HD13 HG21 ' B' ' 190' ' ' ILE . 45.0 mm -75.72 -41.99 40.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.606 -0.684 . . . . 0.0 109.525 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 51.8 m -68.66 -29.19 67.61 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.704 -0.622 . . . . 0.0 109.699 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 54.0 mmtt -74.27 -42.81 59.0 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.615 -0.678 . . . . 0.0 109.807 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.15 -31.09 65.65 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.471 -0.768 . . . . 0.0 109.283 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -70.26 -37.76 74.98 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.662 -0.649 . . . . 0.0 109.392 179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.3 mmtt -70.08 -31.52 69.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.592 -0.692 . . . . 0.0 109.319 179.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -65.01 -34.24 77.97 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -64.41 -30.25 71.3 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.661 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.83 -43.16 99.41 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.703 -0.623 . . . . 0.0 109.804 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -62.59 -40.15 95.98 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.75 -0.594 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.4 tp -73.23 -32.39 64.72 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.69 -0.631 . . . . 0.0 109.687 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -77.35 -30.78 54.02 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.555 -0.716 . . . . 0.0 109.836 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -77.11 -29.13 54.66 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.723 -0.611 . . . . 0.0 109.875 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -76.54 -28.94 56.52 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.578 -0.701 . . . . 0.0 109.977 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -75.54 -28.9 59.24 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.657 -0.652 . . . . 0.0 110.057 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -123.38 28.42 7.06 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.561 -0.712 . . . . 0.0 110.176 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.0 143.61 91.75 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.562 -0.711 . . . . 0.0 110.122 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo . . . . . 0 C--N 1.318 -1.05 0 O-C-N 123.278 1.146 . . . . 0.0 110.423 179.994 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.2 mttm . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.089 0.471 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -91.46 157.04 17.28 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.514 -0.741 . . . . 0.0 110.172 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -169.56 -39.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.556 -0.715 . . . . 0.0 110.527 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 8.5 mtp -70.8 -28.64 64.79 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.562 -0.711 . . . . 0.0 110.278 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.77 -29.66 56.18 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.587 -0.695 . . . . 0.0 110.108 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -76.61 -29.67 56.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.614 -0.679 . . . . 0.0 109.97 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.3 -28.14 59.59 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.619 -0.675 . . . . 0.0 110.019 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 19.4 mmm -74.49 -29.58 61.48 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.594 -0.691 . . . . 0.0 110.04 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 41.3 t -72.68 -28.1 62.49 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.572 -0.705 . . . . 0.0 110.094 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.51 -27.79 62.47 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.552 -0.718 . . . . 0.0 110.065 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -72.7 -34.67 67.3 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.586 -0.696 . . . . 0.0 110.232 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -75.04 -33.37 61.73 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.671 -0.643 . . . . 0.0 109.9 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.8 m -75.31 -30.37 60.33 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.633 -0.667 . . . . 0.0 109.631 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -73.04 -26.58 61.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.686 -0.634 . . . . 0.0 110.057 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -72.8 -32.48 65.58 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.528 -0.732 . . . . 0.0 110.179 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -76.05 -36.38 59.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.659 -0.65 . . . . 0.0 109.691 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.9 mt -70.67 -27.66 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.682 -0.636 . . . . 0.0 109.63 179.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.1 tt -68.43 -36.81 79.59 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.513 -0.742 . . . . 0.0 109.821 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -69.77 -30.09 67.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.64 -0.663 . . . . 0.0 109.843 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.2 mt -70.0 -28.57 65.62 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.702 -0.624 . . . . 0.0 110.028 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -72.35 -32.1 66.19 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.596 -0.69 . . . . 0.0 110.03 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.43 -30.9 60.17 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.604 -0.685 . . . . 0.0 109.78 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.78 -32.5 62.06 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.71 -0.619 . . . . 0.0 109.785 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.94 -31.01 61.4 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.576 -0.702 . . . . 0.0 109.654 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.1 mp -74.64 -35.29 62.88 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.625 -0.672 . . . . 0.0 109.812 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.37 -30.61 64.86 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.651 -0.655 . . . . 0.0 109.77 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.9 tp -73.66 -37.9 65.12 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.642 -0.661 . . . . 0.0 109.817 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 15.6 tp60 -70.46 -30.95 67.91 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.63 -0.668 . . . . 0.0 109.625 179.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.11 -30.13 69.22 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.62 -0.675 . . . . 0.0 109.742 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -66.01 -46.53 77.61 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.664 -0.647 . . . . 0.0 109.698 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.3 tttt -64.0 -28.98 70.17 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.502 -0.749 . . . . 0.0 109.443 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -63.83 -31.38 72.54 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.671 -0.643 . . . . 0.0 109.932 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -65.28 -31.25 72.3 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.508 -0.745 . . . . 0.0 109.704 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.24 -32.84 73.32 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.674 -0.641 . . . . 0.0 109.588 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -61.65 -35.18 77.21 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.638 -0.664 . . . . 0.0 109.898 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.3 tp -63.45 -29.63 70.88 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.587 -0.695 . . . . 0.0 109.768 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -94.97 -23.46 17.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.666 -0.646 . . . . 0.0 110.379 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.6 tp . . . . . 0 N--CA 1.502 2.147 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.74 -179.942 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.46 -61.98 1.56 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.677 -0.896 . . . . 0.0 109.2 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 52.1 m -153.53 37.09 0.46 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.322 0.582 . . . . 0.0 109.498 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 28.0 tptt 52.44 26.62 4.31 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.606 -0.684 . . . . 0.0 110.346 -179.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -153.72 -43.7 0.09 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.619 -0.675 . . . . 0.0 110.397 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.77 -29.59 70.23 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.53 -28.98 24.56 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . 0.422 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.7 mp -76.83 -30.97 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -66.0 -34.6 78.48 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -78.0 -32.57 51.25 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 178.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -29.98 67.94 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 120.184 -0.606 . . . . 0.0 109.526 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -74.12 -27.48 60.89 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.598 -0.689 . . . . 0.0 110.006 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.2 -41.07 58.6 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.549 -0.719 . . . . 0.0 109.967 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 10.5 p -70.33 -26.96 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.606 -0.684 . . . . 0.0 109.999 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -76.04 -29.08 57.93 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.519 -0.738 . . . . 0.0 109.961 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 5.6 mtp-105 -73.42 -29.35 62.52 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.653 -0.654 . . . . 0.0 110.05 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -72.56 -36.97 68.35 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.573 -0.704 . . . . 0.0 109.9 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 88.3 mt -66.38 -28.63 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.652 -0.655 . . . . 0.0 109.664 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.4 m -65.43 -30.95 71.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.598 -0.689 . . . . 0.0 109.677 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -42.97 61.22 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.783 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.5 t -71.78 -31.23 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.645 -0.659 . . . . 0.0 109.46 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.9 -29.06 60.88 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.648 -0.658 . . . . 0.0 109.836 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -72.87 -29.64 63.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.707 -0.62 . . . . 0.0 109.999 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -73.26 -36.45 66.36 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.597 -0.689 . . . . 0.0 109.842 179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.454 HG22 HD11 ' B' ' 190' ' ' ILE . 78.0 mt -71.49 -31.35 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.674 -0.641 . . . . 0.0 109.584 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 44.8 m -69.95 -37.62 75.88 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.682 -0.636 . . . . 0.0 109.65 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -71.59 -37.42 71.0 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.614 -0.679 . . . . 0.0 109.495 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.38 -11.85 60.13 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.731 -0.606 . . . . 0.0 110.601 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.55 -28.56 19.52 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.17 -0.956 . . . . 0.0 109.41 179.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -32.19 55.68 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.665 -0.647 . . . . 0.0 109.89 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.96 -28.25 63.32 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.49 -0.756 . . . . 0.0 109.652 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -68.13 -30.54 69.71 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.642 -0.661 . . . . 0.0 109.657 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -62.65 -44.17 96.95 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.757 -0.589 . . . . 0.0 109.951 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -61.36 -40.63 95.0 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.045 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 29.1 tp -70.38 -40.98 73.65 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.607 -0.683 . . . . 0.0 109.746 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.15 -29.86 62.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.653 -0.654 . . . . 0.0 109.637 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -78.99 -29.31 43.71 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.674 -0.641 . . . . 0.0 109.768 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -77.59 -27.88 51.44 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.523 -0.736 . . . . 0.0 109.993 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.19 -28.33 48.09 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.558 -0.714 . . . . 0.0 110.169 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.69 -31.61 24.02 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.586 -0.696 . . . . 0.0 110.138 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt 51.9 93.96 0.05 OUTLIER Pre-proline 0 N--CA 1.501 2.094 0 O-C-N 121.45 -0.781 . . . . 0.0 110.848 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.317 -1.085 0 O-C-N 123.459 1.242 . . . . 0.0 110.399 179.936 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 19.1 ttmt . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.059 0.457 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.0 mttm -112.36 178.26 4.36 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.645 -0.66 . . . . 0.0 110.209 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -84.87 -28.89 25.7 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.571 -0.705 . . . . 0.0 110.185 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 32.3 mtt -67.01 -29.02 68.73 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.625 -0.672 . . . . 0.0 110.132 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -71.27 -28.28 64.03 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.484 -0.76 . . . . 0.0 110.189 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -71.24 -28.52 64.24 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.563 -0.711 . . . . 0.0 110.238 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 35.4 mtt180 -73.51 -41.13 63.45 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.672 -0.642 . . . . 0.0 110.029 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.9 mtt -70.28 -30.88 68.0 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.703 -0.623 . . . . 0.0 109.771 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.75 -28.72 64.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.724 -0.61 . . . . 0.0 109.807 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 tt -67.88 -29.13 68.17 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.644 -0.66 . . . . 0.0 110.03 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -70.4 -36.03 73.82 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.608 -0.683 . . . . 0.0 109.981 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.53 -30.67 61.86 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.618 -0.676 . . . . 0.0 109.788 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 83.4 m -73.71 -30.62 62.95 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.655 -0.653 . . . . 0.0 109.587 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -69.81 -28.88 66.09 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.604 -0.685 . . . . 0.0 110.06 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -70.89 -33.22 70.36 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.57 -0.706 . . . . 0.0 110.155 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -72.43 -34.87 68.13 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.674 -0.641 . . . . 0.0 109.941 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.3 mt -68.43 -27.58 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.664 -0.647 . . . . 0.0 109.787 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.8 tt -69.88 -44.31 70.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.553 -0.717 . . . . 0.0 109.783 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -65.11 -30.9 71.88 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.598 -0.689 . . . . 0.0 109.668 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.6 mt -66.54 -29.42 69.49 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.634 -0.666 . . . . 0.0 109.978 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -68.46 -45.8 71.49 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.604 -0.685 . . . . 0.0 110.029 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -63.93 -31.08 72.14 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.662 -0.649 . . . . 0.0 109.593 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.1 tttm -64.37 -35.19 80.07 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.635 -0.665 . . . . 0.0 109.913 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.9 tp -66.18 -33.75 76.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.626 -0.671 . . . . 0.0 109.824 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 mt -73.09 -37.9 66.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.728 -0.607 . . . . 0.0 109.552 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.33 -28.44 68.67 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.701 -0.624 . . . . 0.0 109.884 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.07 -43.57 74.31 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.651 -0.655 . . . . 0.0 109.883 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -66.17 -32.81 74.46 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.62 -0.675 . . . . 0.0 109.713 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.9 -28.55 69.03 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.747 -0.596 . . . . 0.0 109.755 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.5 -44.39 94.47 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.664 -0.647 . . . . 0.0 109.735 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -65.81 -29.91 70.46 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.602 -0.686 . . . . 0.0 109.752 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -67.95 -34.17 76.06 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.578 -0.701 . . . . 0.0 109.903 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -68.9 -46.59 67.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.648 -0.658 . . . . 0.0 109.705 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.11 -29.58 70.43 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.658 -0.651 . . . . 0.0 109.832 179.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.16 -34.15 77.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.62 -0.675 . . . . 0.0 109.822 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.73 -30.4 71.5 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.6 -0.688 . . . . 0.0 109.858 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -85.26 -17.66 36.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.676 -0.64 . . . . 0.0 110.673 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.402 ' CD1' ' CD1' ' B' ' 173' ' ' ILE . 49.4 tp . . . . . 0 N--CA 1.5 2.058 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.743 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.15 -61.71 1.55 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.541 -0.976 . . . . 0.0 109.165 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 88.5 p -154.5 37.3 0.42 Allowed 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 36.7 tptt 52.15 26.31 3.81 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.548 -0.72 . . . . 0.0 110.363 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -152.86 -43.9 0.1 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.616 -0.678 . . . . 0.0 110.291 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.85 -29.24 70.05 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 119.753 -0.779 . . . . 0.0 109.666 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.21 -29.09 24.97 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.603 -0.685 . . . . 0.0 109.168 178.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . 0.42 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.9 mp -78.38 -31.7 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.307 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -67.58 -33.88 75.91 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -78.89 -32.32 45.77 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -30.02 65.1 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.734 -0.604 . . . . 0.0 109.638 179.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.27 -33.49 61.27 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.57 -0.707 . . . . 0.0 109.827 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -71.67 -29.03 64.16 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.651 -0.656 . . . . 0.0 109.895 179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 64.6 t -69.51 -32.7 53.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.616 -0.677 . . . . 0.0 109.612 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -63.73 -37.26 86.71 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.666 -0.646 . . . . 0.0 109.81 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 5.7 mtp-105 -69.94 -29.4 66.54 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.748 -0.595 . . . . 0.0 109.722 179.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.85 -32.35 70.7 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.676 -0.64 . . . . 0.0 109.869 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 86.6 mt -72.4 -33.17 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.676 -0.64 . . . . 0.0 109.616 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 58.9 m -71.96 -33.23 68.02 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.692 -0.63 . . . . 0.0 109.649 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.74 -41.46 71.78 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.644 -0.66 . . . . 0.0 109.602 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 63.2 t -68.28 -37.76 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 119.995 -0.682 . . . . 0.0 109.246 179.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.4 -33.57 75.83 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.805 -0.559 . . . . 0.0 109.893 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -29.91 70.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.648 -0.658 . . . . 0.0 109.858 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -72.91 -21.55 60.88 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.594 -0.691 . . . . 0.0 110.371 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 35.3 mm -79.55 -39.04 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.413 -0.804 . . . . 0.0 109.603 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.27 -30.2 64.61 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.623 -0.673 . . . . 0.0 109.734 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 13.8 mmtm -75.28 -36.15 61.23 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.692 -0.63 . . . . 0.0 109.85 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.08 -21.47 59.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.579 -0.7 . . . . 0.0 110.242 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.6 tptt -80.45 -28.59 37.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 109.575 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 14.9 tptt -74.26 -40.05 62.6 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.638 -0.664 . . . . 0.0 109.76 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 2.6 pttp -64.64 -26.11 68.25 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.532 -0.73 . . . . 0.0 109.639 179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -69.81 -30.64 68.21 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.513 -0.742 . . . . 0.0 109.569 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -43.59 98.48 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.684 -0.635 . . . . 0.0 109.764 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -61.71 -31.18 71.32 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.777 -0.577 . . . . 0.0 109.66 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 tp -77.41 -38.16 50.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.69 -0.631 . . . . 0.0 109.534 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -76.43 -30.77 57.54 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.687 -0.633 . . . . 0.0 109.598 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -78.88 -29.16 44.25 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.705 -0.622 . . . . 0.0 109.723 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -78.14 -28.28 48.39 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.593 -0.692 . . . . 0.0 109.928 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.99 -28.29 43.43 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.589 -0.694 . . . . 0.0 110.196 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -88.68 -29.13 20.12 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.586 -0.696 . . . . 0.0 110.179 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 4.2 mmtp -60.74 111.32 3.91 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.549 -0.719 . . . . 0.0 110.149 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 O-C-N 123.094 1.05 . . . . 0.0 110.4 179.954 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.7 mttt . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.103 0.478 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.9 pttt -136.77 172.17 13.41 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.579 -0.701 . . . . 0.0 110.355 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -84.03 -28.98 27.27 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.57 -0.706 . . . . 0.0 110.271 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.0 mtm -59.88 -24.51 64.33 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.576 -0.702 . . . . 0.0 110.462 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -71.55 -29.74 65.09 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.53 -0.731 . . . . 0.0 110.123 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -71.96 -27.71 62.96 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.664 -0.647 . . . . 0.0 110.097 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -71.39 -29.08 64.51 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.506 -0.746 . . . . 0.0 110.116 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.8 mtm -69.1 -35.6 76.63 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.641 -0.662 . . . . 0.0 110.049 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.9 m -68.58 -29.1 67.56 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.657 -0.652 . . . . 0.0 109.835 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.11 -29.45 69.2 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.651 -0.656 . . . . 0.0 109.911 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -63.95 -42.77 97.2 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.686 -0.634 . . . . 0.0 109.986 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -72.02 -30.77 65.54 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.72 -0.612 . . . . 0.0 109.636 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 66.7 m -73.59 -28.43 61.83 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.793 -0.567 . . . . 0.0 109.793 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.4 mmtp -72.06 -26.47 62.19 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.489 -0.757 . . . . 0.0 110.382 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -74.94 -31.85 61.6 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.542 -0.724 . . . . 0.0 110.433 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -76.23 -34.4 59.22 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.63 -0.669 . . . . 0.0 109.785 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.401 ' CD1' ' NE2' ' B' ' 197' ' ' GLN . 69.3 mt -71.5 -26.13 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.653 -0.655 . . . . 0.0 109.679 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.6 tt -71.12 -40.77 71.25 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.477 -0.765 . . . . 0.0 109.929 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.5 tppt? -62.62 -31.07 71.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.557 -0.715 . . . . 0.0 109.69 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 11.3 mt -62.67 -29.6 70.77 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.714 -0.616 . . . . 0.0 109.915 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -66.58 -39.28 88.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.625 -0.672 . . . . 0.0 109.847 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.03 -30.23 63.59 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.654 -0.654 . . . . 0.0 109.53 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -29.72 63.98 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.678 -0.639 . . . . 0.0 109.908 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 25.9 tp -74.1 -33.67 63.68 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.63 -0.669 . . . . 0.0 109.899 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.8 mt -74.32 -33.1 63.08 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.666 -0.646 . . . . 0.0 109.632 179.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.88 -29.21 66.36 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.725 -0.609 . . . . 0.0 109.706 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.64 -42.75 77.56 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.655 -0.653 . . . . 0.0 109.79 179.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -65.73 -29.05 69.52 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.468 -0.77 . . . . 0.0 109.876 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.0 tm-20 -68.41 -28.24 66.91 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.646 -0.659 . . . . 0.0 110.044 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -70.23 -45.76 65.86 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.557 -0.714 . . . . 0.0 109.87 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.1 tttm -63.7 -29.56 70.77 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.509 -0.744 . . . . 0.0 109.945 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -67.38 -29.3 68.78 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.59 -0.694 . . . . 0.0 109.943 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -36.15 83.18 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.533 -0.729 . . . . 0.0 109.945 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 mt -64.29 -34.36 77.96 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.638 -0.664 . . . . 0.0 109.992 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -65.59 -26.49 67.87 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.619 -0.676 . . . . 0.0 110.332 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.8 -28.24 64.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.575 -0.703 . . . . 0.0 110.267 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -117.29 26.19 9.93 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.557 -0.714 . . . . 0.0 110.467 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.8 tp . . . . . 0 N--CA 1.498 1.943 0 CA-C-O 117.957 -1.02 . . . . 0.0 110.171 -179.982 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.378 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 2.5 pp -139.85 -46.35 0.44 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.67 -0.9 . . . . 0.0 110.637 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 33.9 p -153.46 14.56 0.5 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.31 -0.868 . . . . 0.0 111.499 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 9.5 tptm 49.53 26.37 1.7 Allowed 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.012 -1.055 . . . . 0.0 111.051 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -152.92 -46.83 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.665 -0.647 . . . . 0.0 110.047 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.58 -36.73 65.59 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 179.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.09 -28.05 61.19 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.3 mm -67.54 -31.04 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.694 -0.629 . . . . 0.0 109.385 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -72.38 -29.09 63.44 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.681 -0.637 . . . . 0.0 109.916 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -72.55 -32.17 65.85 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.621 -0.674 . . . . 0.0 110.026 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.3 mtt -70.37 -30.19 67.05 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.695 -0.628 . . . . 0.0 109.888 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -69.39 -30.87 68.94 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.644 -0.66 . . . . 0.0 109.863 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.13 -45.48 66.76 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.701 -0.625 . . . . 0.0 109.695 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 58.5 t -61.96 -30.45 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.827 -0.545 . . . . 0.0 109.773 179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -67.85 -31.73 71.75 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.658 -0.651 . . . . 0.0 109.863 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.19 -30.39 63.5 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.698 -0.626 . . . . 0.0 109.715 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -70.89 -34.69 71.82 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.664 -0.647 . . . . 0.0 109.815 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.5 mt -73.66 -30.6 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.721 -0.612 . . . . 0.0 109.654 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 53.1 m -73.31 -34.76 65.88 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.674 -0.641 . . . . 0.0 109.626 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 tpp -72.13 -39.18 69.02 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.605 -0.685 . . . . 0.0 109.677 179.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 64.8 t -70.89 -32.07 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.641 -0.662 . . . . 0.0 109.423 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -70.77 -30.01 66.39 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.684 -0.635 . . . . 0.0 109.894 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -30.2 62.72 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.694 -0.629 . . . . 0.0 109.871 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -37.11 68.56 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.688 -0.632 . . . . 0.0 109.8 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 77.3 mt -72.95 -31.29 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.666 -0.646 . . . . 0.0 109.607 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.57 -34.7 65.26 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.656 -0.653 . . . . 0.0 109.662 179.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -73.1 -38.56 66.31 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.655 -0.653 . . . . 0.0 109.536 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -32.23 73.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.668 -0.645 . . . . 0.0 109.351 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -66.76 -47.23 72.86 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.66 -0.65 . . . . 0.0 109.387 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -64.21 -31.09 72.16 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 120.051 -0.66 . . . . 0.0 109.244 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 19.0 ttpt -62.79 -37.22 85.82 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.691 -0.631 . . . . 0.0 109.418 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . 0.401 ' NE2' ' CD1' ' A' ' 69' ' ' ILE . 5.5 tt0 -63.12 -30.16 71.37 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.722 -0.611 . . . . 0.0 109.66 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -61.04 -40.96 95.61 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.605 -0.685 . . . . 0.0 109.882 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -36.43 83.97 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.753 -0.592 . . . . 0.0 109.644 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 14.0 tp -75.68 -31.02 59.55 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.658 -0.651 . . . . 0.0 109.632 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -77.95 -30.73 50.55 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.638 -0.664 . . . . 0.0 109.723 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -76.13 -31.07 58.42 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.651 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -72.02 -29.08 63.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.679 -0.638 . . . . 0.0 109.923 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -71.13 -26.81 63.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.588 -0.695 . . . . 0.0 110.141 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -118.23 27.35 9.03 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.547 -0.721 . . . . 0.0 110.394 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -77.14 152.67 82.15 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.552 -0.717 . . . . 0.0 110.058 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.316 -1.141 0 O-C-N 123.404 1.213 . . . . 0.0 110.409 179.936 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.0 ttmt . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.094 0.473 . . . . 0.0 110.244 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.2 mtpp -123.65 156.82 35.15 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.569 -0.707 . . . . 0.0 110.165 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -59.96 -26.09 65.72 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.522 -0.736 . . . . 0.0 110.421 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.2 mmt -83.78 -28.6 28.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.432 -0.793 . . . . 0.0 110.248 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -60.89 -28.25 68.75 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.553 -0.717 . . . . 0.0 110.265 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -71.43 -28.87 64.29 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.533 -0.729 . . . . 0.0 110.131 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -72.12 -29.26 63.89 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.653 -0.654 . . . . 0.0 110.039 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.2 ttt -70.54 -29.55 66.05 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.666 -0.646 . . . . 0.0 109.932 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.5 t -68.46 -29.09 67.64 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.604 -0.685 . . . . 0.0 110.016 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.5 tp -67.43 -28.37 67.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.648 -0.658 . . . . 0.0 110.087 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.71 -29.83 69.19 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.583 -0.698 . . . . 0.0 110.119 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -70.5 -46.13 64.3 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.623 -0.673 . . . . 0.0 109.886 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 21.0 m -62.93 -31.12 72.13 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.731 -0.606 . . . . 0.0 109.724 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -65.02 -28.27 69.38 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.628 -0.67 . . . . 0.0 109.93 179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -62.57 -39.75 94.68 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.609 -0.682 . . . . 0.0 110.104 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.4 tp60 -75.41 -30.69 60.15 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.6 -0.687 . . . . 0.0 109.632 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.7 mt -77.37 -27.04 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.785 -0.572 . . . . 0.0 109.712 179.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.1 mt -75.37 -32.69 60.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.458 -0.776 . . . . 0.0 109.826 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -31.62 70.41 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.567 -0.708 . . . . 0.0 109.822 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.3 mt -69.73 -28.96 66.25 Favored 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.898 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.28 -33.11 73.75 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.6 -0.688 . . . . 0.0 110.003 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -76.48 -33.23 58.68 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.557 -0.715 . . . . 0.0 109.71 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.8 tttt -75.35 -29.93 60.07 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.705 -0.622 . . . . 0.0 109.807 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.7 tp -77.22 -31.03 54.94 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.671 -0.643 . . . . 0.0 109.798 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mp -76.34 -33.57 58.97 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.642 -0.661 . . . . 0.0 109.634 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.92 -29.3 63.02 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.696 -0.627 . . . . 0.0 109.994 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.8 tp -75.14 -38.39 61.01 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.592 -0.693 . . . . 0.0 109.922 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -71.23 -29.69 65.43 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.734 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -69.99 -28.98 65.96 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.688 -0.632 . . . . 0.0 109.861 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -67.61 -43.04 81.42 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.522 -0.736 . . . . 0.0 109.863 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -62.3 -28.46 69.75 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.559 -0.713 . . . . 0.0 109.779 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -62.95 -31.86 73.05 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.619 -0.676 . . . . 0.0 109.875 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -40.04 94.61 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.675 -0.64 . . . . 0.0 109.9 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.81 -35.5 76.65 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.629 -0.67 . . . . 0.0 110.127 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -61.3 -36.89 81.33 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.517 -0.739 . . . . 0.0 109.968 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mp -77.05 -29.17 55.06 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.703 -0.623 . . . . 0.0 109.684 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -95.18 -0.22 53.45 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.65 -0.656 . . . . 0.0 110.965 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.5 tp . . . . . 0 N--CA 1.498 1.964 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.245 -179.865 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 1.3 pp -139.03 -48.73 0.5 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.624 -0.927 . . . . 0.0 110.753 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 4.0 m -155.22 13.55 0.37 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.261 -0.9 . . . . 0.0 111.752 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 15.1 tptt 49.34 26.28 1.54 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.999 -1.063 . . . . 0.0 111.066 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -151.86 -47.26 0.11 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.684 -0.635 . . . . 0.0 109.829 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.38 -33.5 63.08 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.6 tt -75.56 -26.66 58.15 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 178.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.7 mm -69.4 -30.65 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.561 -0.712 . . . . 0.0 109.523 179.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -73.11 -28.57 62.34 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.714 -0.616 . . . . 0.0 110.15 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -74.86 -29.22 60.96 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.6 -0.687 . . . . 0.0 110.079 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -73.4 -29.96 62.95 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.581 -0.699 . . . . 0.0 109.921 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -77.25 -29.98 54.25 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.609 -0.682 . . . . 0.0 109.94 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.49 -31.13 47.63 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.646 -0.659 . . . . 0.0 109.787 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 67.0 t -77.96 -31.06 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.633 -0.667 . . . . 0.0 109.521 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -76.31 -29.0 57.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.654 -0.654 . . . . 0.0 109.811 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.38 -29.09 61.4 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.654 -0.654 . . . . 0.0 109.715 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -71.55 -31.4 66.97 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.579 -0.701 . . . . 0.0 110.039 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 83.9 mt -72.62 -29.64 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.628 -0.67 . . . . 0.0 109.706 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.4 -33.13 72.56 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.619 -0.675 . . . . 0.0 109.853 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 49.0 mtp -71.49 -45.76 61.61 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.589 -0.694 . . . . 0.0 109.768 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.1 t -71.57 -31.5 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.648 -0.658 . . . . 0.0 109.383 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -74.51 -28.8 61.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.73 -0.606 . . . . 0.0 109.782 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -72.62 -29.72 63.72 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.558 -0.714 . . . . 0.0 110.044 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -36.43 65.71 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.683 -0.635 . . . . 0.0 109.935 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 75.6 mt -71.29 -31.05 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.639 -0.663 . . . . 0.0 109.573 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 3.2 m -67.77 -37.59 82.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.704 -0.623 . . . . 0.0 109.541 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -74.94 -32.46 61.76 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.622 -0.674 . . . . 0.0 109.4 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.39 -31.56 67.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.631 -0.668 . . . . 0.0 109.295 179.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 11.9 tptm -68.81 -46.3 69.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.629 -0.669 . . . . 0.0 109.407 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.67 -29.67 70.67 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 119.967 -0.693 . . . . 0.0 109.151 179.12 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -62.52 -36.55 82.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.604 -0.685 . . . . 0.0 109.208 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.15 -31.16 72.24 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -58.93 -42.78 90.54 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.684 -0.635 . . . . 0.0 109.986 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.64 -39.46 93.92 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.737 -0.602 . . . . 0.0 109.596 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 15.1 tp -74.41 -28.54 61.13 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.676 -0.64 . . . . 0.0 109.666 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -78.11 -30.47 49.5 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.544 -0.723 . . . . 0.0 109.906 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -78.04 -29.9 49.57 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.622 -0.674 . . . . 0.0 109.792 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -76.29 -27.86 56.79 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.656 -0.652 . . . . 0.0 110.037 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -76.18 -27.96 57.12 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.534 -0.729 . . . . 0.0 110.203 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -81.09 -34.19 32.82 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.483 -0.761 . . . . 0.0 110.148 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 5.6 mmtm 51.89 93.58 0.05 OUTLIER Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 121.376 -0.827 . . . . 0.0 110.878 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 C--N 1.316 -1.162 0 O-C-N 123.413 1.218 . . . . 0.0 110.374 -179.978 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.144 0.497 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.1 mtpp -95.9 -175.74 3.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.566 -0.709 . . . . 0.0 110.185 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -80.03 -29.49 39.34 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.537 -0.727 . . . . 0.0 110.178 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.8 ttt -88.24 -28.36 21.18 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.646 -0.659 . . . . 0.0 110.232 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -60.64 -28.44 68.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.582 -0.699 . . . . 0.0 110.242 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -66.78 -37.24 84.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.535 -0.728 . . . . 0.0 109.996 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -73.73 -31.38 63.34 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.589 -0.694 . . . . 0.0 109.772 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.2 mtp -74.54 -29.72 61.48 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.689 -0.632 . . . . 0.0 109.762 179.559 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.5 m -71.08 -29.49 65.36 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.664 -0.648 . . . . 0.0 109.825 179.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.25 -29.37 68.16 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.697 -0.627 . . . . 0.0 109.999 179.737 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -73.86 -33.1 63.95 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.63 -0.669 . . . . 0.0 109.932 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -74.45 -38.82 62.87 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.66 -0.65 . . . . 0.0 109.752 179.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 58.5 m -71.85 -32.62 67.7 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.723 -0.611 . . . . 0.0 109.434 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -68.14 -29.45 68.36 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.581 179.406 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -63.0 -36.86 84.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.611 -0.681 . . . . 0.0 109.827 179.668 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -75.48 -34.69 60.91 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.466 179.501 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.1 mt -72.12 -28.57 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.734 -0.604 . . . . 0.0 109.397 179.274 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.8 tp -69.21 -40.45 78.0 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.589 -0.694 . . . . 0.0 109.748 179.583 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.23 -31.89 73.15 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.533 -0.729 . . . . 0.0 109.696 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.4 mt -69.69 -30.37 68.01 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.685 -0.634 . . . . 0.0 109.773 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -69.49 -34.24 74.05 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.598 -0.689 . . . . 0.0 109.758 179.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -75.25 -31.7 60.88 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.695 -0.628 . . . . 0.0 109.508 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.15 -30.53 66.57 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.523 179.546 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -74.05 -31.3 62.82 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.61 -0.681 . . . . 0.0 109.714 179.605 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 tp -73.26 -37.85 66.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.673 -0.642 . . . . 0.0 109.693 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.36 -30.9 70.83 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.602 179.483 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.76 -46.31 63.19 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.676 -0.64 . . . . 0.0 109.639 179.529 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -66.18 -29.3 69.56 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.661 -0.649 . . . . 0.0 109.644 179.453 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -68.95 -30.27 68.68 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.661 -0.649 . . . . 0.0 109.788 179.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -69.93 -47.05 63.93 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.668 -0.645 . . . . 0.0 109.808 179.692 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.4 tttt -62.28 -29.87 70.73 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.522 -0.736 . . . . 0.0 109.603 179.441 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -62.98 -31.83 73.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.662 -0.649 . . . . 0.0 109.743 179.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -67.2 -32.09 72.92 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.661 -0.649 . . . . 0.0 109.744 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.57 -31.62 71.82 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.6 -0.687 . . . . 0.0 109.755 179.687 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -62.36 -35.45 79.18 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.615 -0.678 . . . . 0.0 109.88 179.659 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.44 -30.5 64.65 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.671 -0.643 . . . . 0.0 109.696 179.569 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -88.72 -18.51 27.69 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.647 -0.658 . . . . 0.0 110.519 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 32.8 tp . . . . . 0 N--CA 1.501 2.097 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.646 -179.914 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.401 ' CD1' ' N ' ' B' ' 172' ' ' LEU . 0.4 OUTLIER -109.96 -62.51 1.5 Allowed 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.63 -0.923 . . . . 0.0 109.088 179.975 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 6.2 t -154.41 35.99 0.42 Allowed 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.315 0.579 . . . . 0.0 109.528 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 5.9 tptm 51.87 26.07 3.39 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.524 -0.735 . . . . 0.0 110.118 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -147.61 -45.39 0.17 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.707 -0.621 . . . . 0.0 109.962 -179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.68 -30.27 71.28 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 119.618 -0.833 . . . . 0.0 109.2 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . 0.401 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 0.3 OUTLIER -81.65 -27.53 34.06 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.63 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.93 -30.82 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.753 -0.592 . . . . 0.0 109.498 179.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.95 -30.31 66.56 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.636 -0.665 . . . . 0.0 109.946 179.77 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -76.83 -29.25 55.84 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.623 -0.673 . . . . 0.0 109.871 179.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -75.63 -28.31 58.76 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.653 -0.654 . . . . 0.0 110.056 179.761 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.75 -32.22 57.61 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.583 -0.698 . . . . 0.0 110.057 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -75.22 -29.99 60.46 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.611 -0.681 . . . . 0.0 109.889 179.711 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 68.9 t -73.75 -29.43 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.646 -0.659 . . . . 0.0 109.717 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . 0.408 ' O ' ' OG1' ' B' ' 184' ' ' THR . 1.2 m-20 -70.42 -29.21 65.76 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.558 -0.714 . . . . 0.0 110.029 179.755 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 -74.36 -28.9 61.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.602 -0.686 . . . . 0.0 110.118 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -75.73 -34.34 60.32 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.533 -0.73 . . . . 0.0 110.155 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 83.4 mt -74.0 -29.07 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.628 -0.67 . . . . 0.0 109.768 179.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 184' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 3.6 m -73.92 -33.92 64.15 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.613 -0.68 . . . . 0.0 109.714 179.549 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.28 -39.2 78.52 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.664 -0.648 . . . . 0.0 109.77 179.662 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.66 -29.89 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.673 -0.642 . . . . 0.0 109.598 179.612 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -71.17 -28.63 64.38 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.603 -0.685 . . . . 0.0 110.07 179.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -69.72 -33.96 73.22 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.562 -0.711 . . . . 0.0 109.995 179.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -37.93 62.17 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.64 -0.663 . . . . 0.0 109.702 179.74 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 78.7 mt -73.29 -28.91 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.659 -0.651 . . . . 0.0 109.683 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 23.5 p -73.39 -34.76 65.7 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.571 -0.706 . . . . 0.0 109.759 179.504 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -77.36 -33.02 55.38 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.611 -0.681 . . . . 0.0 109.473 179.399 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.4 -30.42 61.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.712 -0.617 . . . . 0.0 109.387 179.353 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.0 tptm -68.42 -36.57 79.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.595 -0.691 . . . . 0.0 109.528 179.483 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 8.5 tptp -68.49 -30.25 69.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.663 -0.648 . . . . 0.0 109.547 179.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -35.63 81.24 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.612 -0.68 . . . . 0.0 109.484 179.525 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -63.4 -30.74 71.82 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.747 -0.596 . . . . 0.0 109.8 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.97 -41.73 98.34 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.71 -0.619 . . . . 0.0 109.91 179.71 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -61.99 -45.76 92.2 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.741 -0.599 . . . . 0.0 109.969 179.756 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 4.4 tp -70.32 -32.84 70.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.621 -0.674 . . . . 0.0 109.716 179.586 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -76.34 -29.32 57.2 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.678 -0.639 . . . . 0.0 109.895 179.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -77.01 -28.27 54.92 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.587 -0.696 . . . . 0.0 110.026 179.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -78.45 -29.25 46.85 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.546 -0.721 . . . . 0.0 109.985 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -79.74 -27.41 40.57 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.592 -0.693 . . . . 0.0 110.132 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.68 -22.66 29.72 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.593 -0.692 . . . . 0.0 110.412 179.886 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.42 147.37 59.41 Favored Pre-proline 0 N--CA 1.498 1.94 0 O-C-N 121.355 -0.841 . . . . 0.0 110.385 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo . . . . . 0 C--N 1.317 -1.087 0 O-C-N 123.343 1.18 . . . . 0.0 110.366 -179.952 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.148 0.499 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.6 mptt -81.68 170.69 15.49 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.553 -0.717 . . . . 0.0 110.23 179.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -100.06 -24.32 14.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.626 -0.671 . . . . 0.0 110.444 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.1 -32.57 63.28 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.437 -0.789 . . . . 0.0 110.102 179.92 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -63.39 -25.59 68.35 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.61 -0.681 . . . . 0.0 110.329 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -73.51 -28.56 61.96 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.512 -0.742 . . . . 0.0 110.128 179.785 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 ttt-85 -69.71 -31.62 69.73 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.642 -0.661 . . . . 0.0 110.054 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.3 -45.01 64.07 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.628 -0.67 . . . . 0.0 109.735 179.791 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.31 -27.97 68.98 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.84 179.6 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -28.87 66.11 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.566 -0.709 . . . . 0.0 110.113 179.858 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -72.94 -33.15 65.75 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.578 -0.701 . . . . 0.0 110.1 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -75.84 -30.03 58.8 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.653 -0.654 . . . . 0.0 109.908 179.762 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 88.2 m -75.84 -29.59 58.67 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.654 -0.654 . . . . 0.0 109.875 179.621 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -73.83 -26.7 60.73 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.575 -0.703 . . . . 0.0 110.162 179.68 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.86 -33.28 62.08 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.597 -0.689 . . . . 0.0 110.133 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -76.38 -37.29 57.41 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.661 -0.649 . . . . 0.0 109.698 179.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.3 mt -72.6 -26.82 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.719 -0.613 . . . . 0.0 109.62 179.399 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.5 mt -72.91 -36.51 67.29 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.541 -0.724 . . . . 0.0 109.734 179.587 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -71.18 -31.06 67.2 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.611 -0.68 . . . . 0.0 109.718 179.605 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.0 mt -69.37 -30.57 68.59 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.774 -0.579 . . . . 0.0 109.831 179.667 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -69.21 -31.32 69.84 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.602 -0.686 . . . . 0.0 109.847 179.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.52 -32.73 54.26 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.603 -0.686 . . . . 0.0 109.626 179.583 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -76.06 -33.19 59.58 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.695 -0.628 . . . . 0.0 109.58 179.581 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.7 tp -74.96 -30.16 61.13 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.676 -0.64 . . . . 0.0 109.734 179.549 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tt -75.43 -36.2 60.82 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.667 -0.646 . . . . 0.0 109.71 179.562 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.72 -30.72 67.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.677 -0.639 . . . . 0.0 109.735 179.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.2 tp -69.32 -37.27 77.66 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.696 -0.628 . . . . 0.0 109.709 179.619 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -71.65 -30.09 65.35 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.598 -0.689 . . . . 0.0 109.639 179.359 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.52 -29.91 67.63 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.578 -0.701 . . . . 0.0 109.855 179.555 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.62 -42.8 81.76 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.634 -0.666 . . . . 0.0 109.885 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.3 ttpp -62.03 -29.61 70.4 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.555 -0.716 . . . . 0.0 109.769 179.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -62.48 -32.17 73.02 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.737 -0.602 . . . . 0.0 109.874 179.713 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -68.75 -37.7 79.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.639 -0.663 . . . . 0.0 109.714 179.68 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.08 -30.08 71.17 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.678 -0.639 . . . . 0.0 109.711 179.668 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -62.47 -36.1 81.41 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.626 -0.671 . . . . 0.0 109.824 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.72 -28.86 69.72 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.638 -0.664 . . . . 0.0 110.007 179.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -87.68 -23.98 24.03 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.542 -0.723 . . . . 0.0 110.418 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 29.4 tp . . . . . 0 N--CA 1.5 2.034 0 CA-C-O 118.018 -0.991 . . . . 0.0 110.575 -179.871 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.402 ' CD1' ' N ' ' B' ' 172' ' ' LEU . 0.4 OUTLIER -109.07 -61.98 1.54 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.561 -0.964 . . . . 0.0 109.01 179.897 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 93.7 p -155.27 35.41 0.38 Allowed 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 121.381 0.61 . . . . 0.0 109.451 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 4.8 tptm 51.88 26.16 3.46 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.526 -0.734 . . . . 0.0 110.146 -178.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -148.4 -44.84 0.15 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.679 -0.638 . . . . 0.0 109.916 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -30.4 71.49 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 119.612 -0.835 . . . . 0.0 109.27 179.514 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . 0.402 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 0.9 OUTLIER -83.48 -28.88 28.43 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 178.567 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.0 mm -68.07 -30.96 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.058 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -70.3 -29.96 66.84 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.675 -0.641 . . . . 0.0 109.903 179.617 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -77.45 -32.96 54.83 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.618 -0.676 . . . . 0.0 109.771 179.683 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.68 -30.25 59.31 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.675 -0.641 . . . . 0.0 109.746 179.595 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -76.57 -30.53 57.07 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.634 -0.666 . . . . 0.0 109.859 179.767 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -77.43 -33.85 54.79 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.628 -0.67 . . . . 0.0 109.799 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 67.5 t -76.84 -30.65 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.632 -0.668 . . . . 0.0 109.476 179.497 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -75.41 -29.25 59.7 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.656 -0.653 . . . . 0.0 109.865 179.503 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -29.64 62.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.609 -0.682 . . . . 0.0 109.992 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -75.06 -33.18 61.68 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.601 -0.687 . . . . 0.0 109.984 179.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 89.2 mt -72.25 -30.05 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.66 -0.65 . . . . 0.0 109.739 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.63 -35.13 72.76 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.669 -0.644 . . . . 0.0 109.789 179.556 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.5 ttt -67.55 -41.84 83.6 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.567 -0.708 . . . . 0.0 109.802 179.618 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.5 t -70.79 -30.41 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.674 -0.641 . . . . 0.0 109.638 179.629 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -74.0 -29.9 62.2 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.584 -0.698 . . . . 0.0 109.964 179.697 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -72.36 -29.68 64.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.52 -0.738 . . . . 0.0 109.918 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -38.69 65.31 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.677 -0.64 . . . . 0.0 109.843 179.774 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 76.0 mt -70.82 -30.5 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.745 -0.597 . . . . 0.0 109.616 179.722 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.6 m -71.09 -36.72 72.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.649 -0.657 . . . . 0.0 109.603 179.557 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 16.5 mmtm -74.88 -31.95 61.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.642 -0.661 . . . . 0.0 109.584 179.478 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.62 -14.42 59.33 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.694 -0.629 . . . . 0.0 110.438 179.358 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.7 tptp -87.65 -28.27 21.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.236 -0.915 . . . . 0.0 109.404 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.16 -34.92 56.39 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.583 -0.698 . . . . 0.0 109.753 179.523 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.67 -27.62 65.18 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 119.785 -0.766 . . . . 0.0 109.538 179.454 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -69.29 -29.77 67.71 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.54 -0.725 . . . . 0.0 109.458 179.174 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -61.19 -43.58 98.65 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.705 -0.622 . . . . 0.0 109.707 179.52 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -61.58 -34.05 74.94 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.746 -0.596 . . . . 0.0 109.616 179.369 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 23.5 tp -78.12 -31.97 50.19 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -78.4 -32.43 48.74 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.715 -0.615 . . . . 0.0 109.581 179.447 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -76.8 -29.62 56.08 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.787 -0.57 . . . . 0.0 109.707 179.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -74.19 -28.34 61.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.65 -0.656 . . . . 0.0 109.882 179.478 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -72.27 -26.61 62.05 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.635 -0.665 . . . . 0.0 110.185 179.832 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -86.1 -28.91 23.74 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.518 -0.739 . . . . 0.0 110.15 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 8.7 mttp -60.69 111.28 3.85 Favored Pre-proline 0 N--CA 1.495 1.819 0 O-C-N 121.612 -0.68 . . . . 0.0 110.179 179.969 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 N--CA 1.486 1.086 0 O-C-N 123.218 1.115 . . . . 0.0 110.394 179.989 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.1 0.476 . . . . 0.0 110.321 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -165.66 -172.36 2.38 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.562 -0.712 . . . . 0.0 110.146 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -89.55 -29.22 19.06 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.64 -0.662 . . . . 0.0 110.247 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -28.87 22.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.618 -0.676 . . . . 0.0 110.211 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -66.66 -28.65 68.63 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.555 -0.715 . . . . 0.0 110.121 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -69.56 -27.87 65.5 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.585 -0.697 . . . . 0.0 110.231 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.6 mtt180 -75.51 -30.55 59.86 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.518 -0.739 . . . . 0.0 110.069 -179.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.2 mtp -74.57 -31.64 62.14 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.656 -0.653 . . . . 0.0 109.911 179.824 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.8 m -71.26 -29.51 65.17 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.634 -0.666 . . . . 0.0 109.84 179.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.3 tt -67.95 -29.31 68.33 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.683 -0.635 . . . . 0.0 109.89 179.719 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -64.52 -35.69 81.79 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.573 -0.705 . . . . 0.0 109.9 179.888 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -73.7 -35.43 65.15 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.582 -0.699 . . . . 0.0 109.794 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.6 m -71.72 -31.32 66.58 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.741 -0.6 . . . . 0.0 109.604 179.476 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -68.07 -28.34 67.28 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.725 -0.609 . . . . 0.0 109.89 179.625 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -65.99 -34.73 78.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.59 -0.694 . . . . 0.0 110.006 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.6 tp60 -77.64 -31.71 52.87 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.679 -0.638 . . . . 0.0 109.64 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 82.0 mt -77.01 -28.8 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.732 -0.605 . . . . 0.0 109.562 179.496 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 25.4 tp -74.35 -33.89 63.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.598 -0.689 . . . . 0.0 109.632 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -29.94 70.0 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.574 -0.704 . . . . 0.0 109.745 179.626 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 14.2 mt -65.02 -30.98 72.0 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.642 -0.661 . . . . 0.0 110.046 179.796 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.98 -38.87 92.66 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.565 -0.709 . . . . 0.0 110.004 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -73.9 -31.76 63.26 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.548 179.574 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -76.07 -34.96 59.57 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.706 -0.621 . . . . 0.0 109.663 179.58 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.57 -30.65 61.8 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.58 -0.7 . . . . 0.0 109.607 179.464 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.9 tt -74.39 -34.69 63.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.634 -0.666 . . . . 0.0 109.726 179.552 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.37 69.56 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.676 -0.64 . . . . 0.0 109.723 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -72.16 -43.17 65.02 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.617 -0.677 . . . . 0.0 109.756 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -67.62 -29.05 68.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.684 -0.635 . . . . 0.0 109.872 179.486 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -70.1 -30.01 67.11 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.583 -0.698 . . . . 0.0 109.847 179.671 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -69.63 -45.65 68.0 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.599 -0.688 . . . . 0.0 109.711 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -61.87 -27.63 68.93 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.531 -0.731 . . . . 0.0 109.606 179.204 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -62.57 -30.01 71.01 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.592 -0.693 . . . . 0.0 109.771 179.561 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -61.34 -43.93 98.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.535 -0.728 . . . . 0.0 109.856 179.685 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.74 -33.65 76.13 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.703 -0.623 . . . . 0.0 109.394 179.436 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -62.03 -35.14 77.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.685 -0.634 . . . . 0.0 109.872 179.817 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.68 -27.17 69.05 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.981 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -106.33 12.73 29.55 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.62 -0.675 . . . . 0.0 110.803 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 58.8 tp . . . . . 0 N--CA 1.499 1.983 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.12 -179.866 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.409 ' CD1' ' N ' ' B' ' 168' ' ' SER . 2.5 pp -140.43 -46.05 0.42 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.616 -0.932 . . . . 0.0 110.501 -179.808 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 168' ' ' SER . . . . . 0.409 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 38.6 m -153.93 13.99 0.46 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.285 -0.884 . . . . 0.0 111.466 179.925 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 24.3 tptp 49.31 26.6 1.62 Allowed 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.085 -1.01 . . . . 0.0 111.02 -179.825 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -151.4 -47.43 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.735 -0.603 . . . . 0.0 109.738 179.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -74.01 -35.28 64.39 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.27 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -77.12 -29.72 54.89 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.774 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.0 mm -69.51 -29.98 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.393 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -74.1 -31.46 62.81 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.651 -0.656 . . . . 0.0 109.852 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -74.57 -32.76 62.5 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.658 -0.651 . . . . 0.0 109.837 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -29.4 64.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.729 -0.607 . . . . 0.0 109.772 179.523 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.18 -29.76 66.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.557 -0.715 . . . . 0.0 110.054 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 8.0 mtm180 -73.28 -37.08 66.39 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.679 -0.638 . . . . 0.0 109.936 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 59.2 t -73.57 -31.46 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.654 -0.654 . . . . 0.0 109.479 179.594 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -72.2 -29.19 63.74 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.712 -0.617 . . . . 0.0 109.919 179.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.52 -31.98 70.53 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.592 -0.692 . . . . 0.0 109.947 179.768 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.06 -35.06 66.63 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.666 -0.646 . . . . 0.0 109.926 179.779 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . 0.457 HD11 HG21 ' B' ' 183' ' ' ILE . 86.0 mt -69.51 -30.24 44.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.545 179.6 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.91 -30.98 71.66 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.636 -0.665 . . . . 0.0 109.808 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.6 mtt -68.5 -50.24 53.72 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.685 -0.634 . . . . 0.0 109.843 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -68.21 -30.89 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.578 -0.701 . . . . 0.0 109.564 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -75.23 -28.4 59.88 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.655 -0.653 . . . . 0.0 109.94 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -74.15 -28.89 61.53 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.564 -0.71 . . . . 0.0 110.036 179.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.03 -36.6 64.43 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.545 -0.722 . . . . 0.0 109.97 179.801 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 84.0 mt -68.99 -30.48 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.669 -0.644 . . . . 0.0 109.668 179.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.7 m -68.37 -40.94 81.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.63 -0.669 . . . . 0.0 109.559 179.513 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt -73.31 -33.44 65.17 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.682 -0.636 . . . . 0.0 109.4 179.426 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.37 -30.44 64.7 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.701 -0.625 . . . . 0.0 109.398 179.322 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.4 tppt? -69.75 -42.42 73.9 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.644 -0.66 . . . . 0.0 109.727 179.587 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.41 -31.83 73.19 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.561 -0.712 . . . . 0.0 109.383 179.493 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 2.0 ttpp -63.75 -37.12 86.16 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.697 -0.627 . . . . 0.0 109.452 179.476 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -62.28 -29.9 70.75 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.763 -0.586 . . . . 0.0 109.767 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -61.97 -44.97 95.62 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.707 -0.62 . . . . 0.0 109.886 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -63.1 -37.9 89.06 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.698 -0.626 . . . . 0.0 109.82 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.4 tp -73.22 -36.22 66.44 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.612 -0.68 . . . . 0.0 109.719 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -76.33 -30.62 57.75 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.599 -0.688 . . . . 0.0 109.76 179.639 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -78.64 -29.85 46.06 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.591 -0.693 . . . . 0.0 109.702 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.7 -28.2 55.8 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.628 -0.67 . . . . 0.0 109.952 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -76.0 -26.61 56.89 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.636 -0.665 . . . . 0.0 110.192 179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -85.63 -26.14 26.22 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.55 -0.719 . . . . 0.0 110.263 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -59.9 166.52 3.51 Favored Pre-proline 0 N--CA 1.496 1.873 0 O-C-N 121.501 -0.749 . . . . 0.0 110.22 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo . . . . . 0 C--N 1.318 -1.073 0 O-C-N 123.369 1.194 . . . . 0.0 110.407 179.976 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.182 0.515 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.8 ptpt -62.87 -164.33 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.545 -0.722 . . . . 0.0 110.171 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 53.51 27.9 7.08 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.33 -0.856 . . . . 0.0 110.73 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.1 mtp -145.79 -53.25 0.26 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.551 -0.718 . . . . 0.0 110.141 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -60.98 -28.0 68.69 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.684 -0.635 . . . . 0.0 110.039 179.762 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -69.6 -29.43 66.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.672 -0.643 . . . . 0.0 109.928 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -66.06 -41.72 90.41 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.604 -0.685 . . . . 0.0 109.973 179.716 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.7 mtm -71.84 -30.84 65.89 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.585 -0.697 . . . . 0.0 109.631 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.65 -28.28 63.65 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.745 -0.597 . . . . 0.0 109.767 179.377 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.6 tt -68.06 -29.32 68.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.61 -0.681 . . . . 0.0 110.019 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -66.45 -39.33 88.79 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.6 -0.688 . . . . 0.0 109.93 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -71.95 -29.88 64.73 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.729 -0.607 . . . . 0.0 109.811 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 74.9 m -73.06 -29.77 63.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.625 -0.672 . . . . 0.0 109.884 179.658 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.79 -27.47 63.93 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.568 -0.707 . . . . 0.0 110.1 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -76.11 -28.1 57.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.508 -0.745 . . . . 0.0 110.235 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 72.8 tp60 -77.7 -33.24 53.24 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.566 -0.709 . . . . 0.0 109.852 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 68.1 mt -74.12 -28.42 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.718 -0.613 . . . . 0.0 109.577 179.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.24 -37.22 66.44 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.547 -0.72 . . . . 0.0 109.647 179.537 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.9 tptt -62.8 -29.58 70.82 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.535 -0.728 . . . . 0.0 109.633 179.443 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 10.9 mt -61.47 -29.6 70.07 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.684 -0.635 . . . . 0.0 109.903 179.593 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.2 -38.55 89.57 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.6 -0.688 . . . . 0.0 109.719 179.603 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.04 -31.68 58.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.636 -0.665 . . . . 0.0 109.268 179.259 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -75.38 -31.97 60.65 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.763 -0.585 . . . . 0.0 109.702 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 22.3 tp -76.36 -31.41 58.05 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.606 -0.684 . . . . 0.0 109.647 179.469 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 tp -74.81 -33.95 62.29 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 120.263 -0.575 . . . . 0.0 109.61 179.485 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.4 -31.42 69.77 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.721 -0.612 . . . . 0.0 109.735 179.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -70.34 -44.01 69.04 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.678 -0.639 . . . . 0.0 109.668 179.589 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -66.42 -30.5 70.87 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.715 179.505 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -67.77 -31.7 71.77 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.682 -0.636 . . . . 0.0 109.779 179.709 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.07 -44.72 88.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.614 -0.679 . . . . 0.0 109.636 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.3 tttm -64.05 -28.82 70.05 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 120.044 -0.662 . . . . 0.0 109.543 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -65.78 -28.69 69.2 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.689 -0.632 . . . . 0.0 110.118 179.749 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -37.51 78.62 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.526 -0.734 . . . . 0.0 109.748 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 mt -62.87 -29.06 70.46 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.663 -0.648 . . . . 0.0 109.845 179.635 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -62.14 -42.32 99.13 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.5 -0.75 . . . . 0.0 109.508 179.64 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.86 -30.58 69.12 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-O 121.382 0.61 . . . . 0.0 109.515 179.152 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -85.9 -19.54 30.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.675 -0.641 . . . . 0.0 110.53 179.565 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.03 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.712 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.405 ' CD1' ' N ' ' B' ' 167' ' ' LEU . 0.1 OUTLIER -131.19 -63.17 0.86 Allowed 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.616 -0.932 . . . . 0.0 109.158 179.95 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 4.2 m -144.56 37.08 1.2 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 121.343 0.592 . . . . 0.0 109.559 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 17.0 tptt 51.92 25.74 3.25 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.483 -0.761 . . . . 0.0 110.17 -179.009 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -146.7 -45.11 0.18 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.661 -0.649 . . . . 0.0 109.953 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -64.62 -32.43 74.08 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.554 -0.859 . . . . 0.0 109.148 179.399 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.35 -28.35 38.09 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.583 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 47.2 mm -73.9 -30.7 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.641 -0.662 . . . . 0.0 109.623 179.698 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -73.69 -29.26 62.18 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.619 -0.676 . . . . 0.0 110.13 179.897 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 42.6 m-20 -73.35 -27.54 61.55 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.603 -0.685 . . . . 0.0 110.204 179.875 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.2 mtt -74.51 -28.94 61.21 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.553 -0.717 . . . . 0.0 110.276 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.77 -28.42 55.67 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.577 -0.702 . . . . 0.0 110.163 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 8.4 ttp180 -77.93 -34.45 51.24 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.595 -0.69 . . . . 0.0 109.918 179.861 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 84.2 t -73.58 -29.17 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.671 -0.643 . . . . 0.0 109.479 179.445 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -68.82 -29.56 67.93 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.69 -0.631 . . . . 0.0 109.919 179.592 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 30.8 mtp180 -75.39 -27.78 59.21 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.59 -0.694 . . . . 0.0 109.969 179.681 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -75.49 -34.27 60.85 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.557 -0.715 . . . . 0.0 110.064 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . 0.485 HG22 HD12 ' B' ' 183' ' ' ILE . 88.1 mt -71.49 -28.76 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.824 179.675 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -33.53 71.94 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.584 -0.697 . . . . 0.0 109.771 179.555 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 5.0 ttm -69.53 -45.49 68.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.651 -0.656 . . . . 0.0 109.856 179.794 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 61.6 t -70.18 -31.03 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.609 -0.682 . . . . 0.0 109.611 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -74.91 -28.98 60.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.672 -0.643 . . . . 0.0 109.876 179.598 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -73.3 -28.94 62.38 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.607 -0.683 . . . . 0.0 110.001 179.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -35.55 65.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.662 -0.649 . . . . 0.0 110.013 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.4 HG22 HD12 ' B' ' 190' ' ' ILE . 77.2 mt -70.57 -29.76 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.628 -0.67 . . . . 0.0 109.834 179.931 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.12 -39.66 68.67 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.672 -0.643 . . . . 0.0 109.791 179.664 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -73.92 -30.81 62.77 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.598 -0.689 . . . . 0.0 109.487 179.481 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.11 -31.03 65.66 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.614 -0.679 . . . . 0.0 109.38 179.282 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -46.63 66.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.602 -0.686 . . . . 0.0 109.456 179.411 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -68.03 -31.54 71.28 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.597 -0.689 . . . . 0.0 109.203 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 15.3 ttpt -65.7 -33.34 75.66 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.703 -0.623 . . . . 0.0 109.436 179.267 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -65.16 -29.98 70.86 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.751 -0.593 . . . . 0.0 109.707 179.544 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -62.83 -42.5 99.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.65 -0.656 . . . . 0.0 109.916 179.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -61.13 -45.46 94.57 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.67 -0.644 . . . . 0.0 109.927 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 13.4 tp -72.2 -30.14 64.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.581 -0.7 . . . . 0.0 109.673 179.638 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -79.15 -30.63 43.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.622 -0.674 . . . . 0.0 109.725 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -78.82 -30.28 45.23 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.72 -0.613 . . . . 0.0 109.701 179.547 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -76.85 -29.48 55.89 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.66 -0.65 . . . . 0.0 109.66 179.401 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -72.0 -29.74 64.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.656 -0.653 . . . . 0.0 109.765 179.569 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -113.86 26.32 10.44 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.619 -0.675 . . . . 0.0 110.184 179.738 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 11.5 tptt -80.85 135.29 52.15 Favored Pre-proline 0 N--CA 1.494 1.774 0 O-C-N 121.434 -0.791 . . . . 0.0 110.096 179.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo . . . . . 0 C--N 1.318 -1.037 0 O-C-N 123.195 1.103 . . . . 0.0 110.405 179.936 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.115 0.484 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.2 mttt -136.47 159.44 41.78 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.65 -0.656 . . . . 0.0 110.185 -179.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -65.89 -23.99 66.76 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.662 -0.649 . . . . 0.0 110.488 179.978 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.9 ttm -76.0 -28.3 57.75 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.555 -0.716 . . . . 0.0 110.306 -179.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -63.07 -29.63 70.97 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.573 -0.705 . . . . 0.0 110.118 -179.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.07 -28.66 64.51 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.599 -0.688 . . . . 0.0 110.071 179.84 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -69.55 -29.27 66.81 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.588 -0.695 . . . . 0.0 110.08 179.874 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -67.35 -37.08 82.67 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.54 -0.725 . . . . 0.0 109.954 179.84 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 53.6 p -69.5 -29.81 67.53 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.67 -0.643 . . . . 0.0 109.735 179.612 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 tp -68.53 -28.91 67.41 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.59 -0.694 . . . . 0.0 109.973 179.632 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.29 -38.79 88.58 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.552 -0.717 . . . . 0.0 110.035 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -73.44 -36.41 65.92 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.725 -0.609 . . . . 0.0 109.704 179.575 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.8 m -74.06 -31.03 62.69 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.697 -0.627 . . . . 0.0 109.517 179.415 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -70.88 -26.67 63.35 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.677 -0.639 . . . . 0.0 109.965 179.51 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -69.11 -35.61 76.61 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.554 -0.716 . . . . 0.0 110.206 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -75.95 -37.06 59.05 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.551 -0.718 . . . . 0.0 109.681 179.665 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 90.1 mt -71.96 -26.61 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.692 -0.63 . . . . 0.0 109.603 179.256 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.4 tt -70.73 -37.21 73.47 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.493 -0.755 . . . . 0.0 109.884 179.591 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -67.85 -38.04 82.64 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.613 -0.679 . . . . 0.0 109.688 179.649 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.4 mt -63.95 -29.6 70.75 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.733 -0.604 . . . . 0.0 109.898 179.714 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -65.22 -38.34 90.12 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.645 -0.659 . . . . 0.0 109.798 179.767 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -73.36 -32.87 64.76 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.383 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.9 tttt -69.76 -36.37 75.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.68 -0.638 . . . . 0.0 109.593 179.529 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.1 tp -70.39 -30.01 66.79 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.626 -0.671 . . . . 0.0 109.731 179.421 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -73.29 -37.76 66.13 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.716 -0.615 . . . . 0.0 109.727 179.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.16 -30.26 70.19 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.716 -0.615 . . . . 0.0 109.826 179.675 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.3 mp -70.99 -43.79 67.27 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.687 -0.633 . . . . 0.0 109.829 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -66.2 -29.59 69.88 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.618 -0.676 . . . . 0.0 109.785 179.755 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -68.78 -30.5 69.1 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.572 -0.705 . . . . 0.0 109.77 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -48.72 56.81 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.635 -0.666 . . . . 0.0 109.777 179.729 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -63.69 -30.34 71.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.556 -0.715 . . . . 0.0 109.591 179.462 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -65.59 -34.6 78.62 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.676 -0.64 . . . . 0.0 109.817 179.613 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -67.25 -37.76 84.05 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.725 -0.609 . . . . 0.0 109.713 179.61 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.3 mt -62.3 -38.45 89.44 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.646 -0.659 . . . . 0.0 109.762 179.66 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -60.9 -42.58 98.29 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.544 -0.722 . . . . 0.0 109.963 179.917 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.8 mt -67.47 -30.08 69.7 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.742 -0.599 . . . . 0.0 109.676 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.53 -15.7 34.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.689 -0.632 . . . . 0.0 110.692 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 30.5 tp . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.521 -179.859 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.404 ' CD1' ' CB ' ' B' ' 171' ' ' GLU . 1.6 pp -50.32 -46.37 55.51 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.793 -0.827 . . . . 0.0 111.607 179.868 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 34.8 t -151.74 16.36 0.68 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.258 -0.902 . . . . 0.0 111.115 -179.987 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 26.0 tptt 49.94 26.36 1.97 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.131 -0.981 . . . . 0.0 111.021 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -153.37 -46.4 0.09 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.648 -0.657 . . . . 0.0 110.03 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . 0.404 ' CB ' ' CD1' ' B' ' 167' ' ' LEU . 0.0 OUTLIER -74.64 -30.29 61.58 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.904 -0.718 . . . . 0.0 109.294 179.59 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.3 tt -79.13 -28.88 42.93 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.711 -0.618 . . . . 0.0 109.672 179.117 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . 0.445 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.3 mp -76.82 -35.25 24.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -64.44 -31.39 72.58 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.905 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -75.83 -34.58 60.11 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.109 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.48 -31.76 71.28 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.645 179.524 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -76.93 -30.65 56.19 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.545 -0.722 . . . . 0.0 109.851 179.588 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 -74.8 -30.11 61.31 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.661 -0.65 . . . . 0.0 109.781 179.579 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 66.5 t -72.12 -29.47 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.691 -0.63 . . . . 0.0 109.831 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.94 -31.38 67.95 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.543 -0.723 . . . . 0.0 109.985 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -30.03 63.61 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.739 -0.601 . . . . 0.0 109.828 179.746 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 47.6 tt0 -74.04 -41.17 62.19 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.639 -0.663 . . . . 0.0 109.901 179.716 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . 0.425 HG23 HD11 ' B' ' 183' ' ' ILE . 84.0 mt -67.89 -28.37 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.674 -0.641 . . . . 0.0 109.505 179.482 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 35.2 m -66.74 -32.13 73.23 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.55 -0.719 . . . . 0.0 109.691 179.475 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.4 mtt -67.28 -50.28 60.97 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.716 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.9 t -65.13 -30.25 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.653 -0.655 . . . . 0.0 109.565 179.568 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -71.12 -29.61 65.46 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.672 -0.643 . . . . 0.0 109.932 179.734 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -30.5 69.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.618 -0.676 . . . . 0.0 109.861 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -37.42 56.75 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.604 -0.685 . . . . 0.0 109.612 179.689 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 70.9 mt -73.38 -28.98 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.651 -0.656 . . . . 0.0 109.593 179.673 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.2 m -73.18 -34.29 65.92 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.544 -0.722 . . . . 0.0 109.548 179.508 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -37.38 62.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.677 -0.639 . . . . 0.0 109.491 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.54 -30.69 68.56 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.58 -0.7 . . . . 0.0 109.403 179.238 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -67.49 -42.93 82.1 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.633 -0.667 . . . . 0.0 109.663 179.54 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -68.74 -33.54 74.09 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.577 -0.702 . . . . 0.0 109.338 179.397 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.42 -32.62 74.31 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.032 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -65.49 -30.24 70.98 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.477 179.288 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -60.48 -42.47 96.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.684 -0.635 . . . . 0.0 109.868 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -45.42 93.6 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.679 -0.638 . . . . 0.0 109.689 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.0 tp -72.95 -30.9 64.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.707 -0.621 . . . . 0.0 109.422 179.231 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -77.0 -28.58 55.11 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.69 -0.631 . . . . 0.0 109.928 179.511 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -76.95 -28.89 55.35 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.605 -0.685 . . . . 0.0 109.99 179.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -78.65 -28.91 45.54 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.472 -0.768 . . . . 0.0 110.042 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -80.23 -27.86 38.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.642 -0.661 . . . . 0.0 110.208 179.795 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -90.0 -27.23 19.89 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.584 -0.697 . . . . 0.0 110.285 179.894 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -70.96 151.89 95.01 Favored Pre-proline 0 N--CA 1.495 1.783 0 O-C-N 121.505 -0.747 . . . . 0.0 110.213 179.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.317 -1.089 0 O-C-N 123.449 1.236 . . . . 0.0 110.42 179.943 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.6 tttt . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.099 0.476 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.2 mttt -85.22 -169.47 2.66 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.604 -0.685 . . . . 0.0 110.162 179.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -67.83 -29.11 68.18 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.585 -0.697 . . . . 0.0 110.149 -179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.2 mmm -61.84 -28.19 69.31 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.623 -0.673 . . . . 0.0 110.235 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -71.8 -28.25 63.47 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.582 -0.699 . . . . 0.0 110.219 -179.976 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -72.23 -32.87 67.12 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.648 -0.657 . . . . 0.0 110.184 179.985 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 ttp180 -69.06 -30.09 68.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.682 -0.636 . . . . 0.0 109.902 179.717 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 10.3 mmt -66.28 -30.33 70.73 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.663 -0.648 . . . . 0.0 109.841 179.667 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 t -62.72 -29.93 71.04 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.727 -0.608 . . . . 0.0 109.926 179.695 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 18.6 tp -62.26 -28.94 70.06 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.628 -0.67 . . . . 0.0 110.046 179.791 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.82 -32.61 69.72 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.555 -0.716 . . . . 0.0 110.02 179.964 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -75.16 -34.19 61.57 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.638 -0.664 . . . . 0.0 109.816 179.669 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 35.9 m -73.53 -30.41 63.06 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.703 -0.623 . . . . 0.0 109.677 179.608 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -71.59 -27.76 63.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.611 -0.68 . . . . 0.0 110.05 179.611 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -70.0 -30.19 67.45 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.571 -0.706 . . . . 0.0 110.156 179.886 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.41 -37.14 60.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.578 -0.701 . . . . 0.0 109.914 179.797 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.9 mt -70.26 -27.77 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.671 -0.643 . . . . 0.0 109.697 179.611 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 21.4 tp -69.75 -35.06 74.64 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.563 -0.711 . . . . 0.0 109.895 179.679 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -67.98 -28.78 67.73 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.526 -0.734 . . . . 0.0 109.911 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 11.7 mt -68.57 -31.4 70.58 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.599 -0.688 . . . . 0.0 110.108 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -66.42 -37.31 84.92 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.583 -0.698 . . . . 0.0 110.039 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -74.9 -28.53 60.67 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.608 -0.682 . . . . 0.0 109.916 179.662 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -77.53 -29.8 52.52 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.64 -0.662 . . . . 0.0 109.899 179.78 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.1 tp -77.05 -30.71 55.73 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.602 -0.686 . . . . 0.0 109.97 179.837 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.4 mt -79.3 -31.03 43.16 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.625 -0.672 . . . . 0.0 109.74 179.666 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -77.08 -28.4 54.57 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.699 -0.625 . . . . 0.0 109.827 179.487 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.8 tp -76.06 -33.75 59.59 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.62 -0.675 . . . . 0.0 109.918 179.704 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -72.45 -31.16 65.22 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.578 -0.701 . . . . 0.0 109.586 179.372 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -67.89 -29.04 68.05 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.719 -0.613 . . . . 0.0 109.787 179.416 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.17 -44.98 82.48 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.544 -0.722 . . . . 0.0 109.864 179.772 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -62.89 -29.48 70.8 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.568 -0.707 . . . . 0.0 109.799 179.686 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -65.69 -38.59 89.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.616 -0.678 . . . . 0.0 109.844 179.721 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -64.99 -46.64 80.6 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.656 -0.653 . . . . 0.0 109.67 179.596 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.52 -29.28 69.89 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.645 -0.659 . . . . 0.0 109.776 179.493 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.38 -35.58 81.36 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.59 -0.694 . . . . 0.0 109.537 179.619 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.93 -30.59 64.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.724 -0.61 . . . . 0.0 109.409 179.294 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -75.44 -18.51 59.86 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.711 -0.618 . . . . 0.0 110.494 179.55 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 28.0 tp . . . . . 0 N--CA 1.5 2.068 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.643 -179.939 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.402 ' CD1' ' N ' ' B' ' 172' ' ' LEU . 0.2 OUTLIER -126.96 -62.91 1.09 Allowed 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.537 -0.978 . . . . 0.0 109.132 179.901 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 9.0 t -144.36 37.2 1.23 Allowed 'General case' 0 N--CA 1.489 1.484 0 CA-C-O 121.238 0.542 . . . . 0.0 109.576 179.747 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 10.1 tptt 51.76 26.14 3.32 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.569 -0.707 . . . . 0.0 110.138 -178.976 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -147.19 -44.99 0.17 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.691 -0.63 . . . . 0.0 109.834 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.12 -32.32 73.97 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.383 179.599 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . 0.402 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 0.1 OUTLIER -79.45 -27.34 41.64 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.438 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.6 mm -70.07 -30.37 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.629 -0.67 . . . . 0.0 109.605 179.501 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -74.93 -27.82 60.36 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.566 -0.709 . . . . 0.0 110.225 179.97 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -77.37 -29.42 53.26 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.543 -0.723 . . . . 0.0 110.14 179.91 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -29.64 55.58 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.627 -0.671 . . . . 0.0 109.93 179.771 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.08 -29.37 54.94 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.66 -0.65 . . . . 0.0 110.026 179.914 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.11 -29.05 54.62 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.547 -0.72 . . . . 0.0 109.971 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 67.3 t -76.04 -29.32 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.582 -0.699 . . . . 0.0 109.792 179.701 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -74.69 -28.64 60.91 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.608 -0.682 . . . . 0.0 110.176 179.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -29.2 60.82 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.609 -0.682 . . . . 0.0 110.026 179.925 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -76.6 -36.18 57.66 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.61 -0.681 . . . . 0.0 110.058 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 87.6 mt -73.77 -27.88 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.715 -0.616 . . . . 0.0 109.762 179.604 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 29.5 m -73.98 -33.02 63.69 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.502 -0.748 . . . . 0.0 109.769 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 2.9 tpt -76.6 -36.75 57.31 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.626 -0.671 . . . . 0.0 109.585 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 73.1 t -75.15 -31.17 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.689 -0.632 . . . . 0.0 109.455 179.343 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -74.74 -29.17 61.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.644 -0.66 . . . . 0.0 109.847 179.678 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -73.72 -29.55 62.32 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.621 -0.674 . . . . 0.0 109.937 179.726 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -71.53 -35.43 70.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.706 -0.621 . . . . 0.0 109.819 179.798 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.405 HD12 HG21 ' B' ' 190' ' ' ILE . 79.0 mt -68.74 -37.89 78.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.576 -0.703 . . . . 0.0 109.849 179.832 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 56.1 p -66.9 -35.07 79.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.629 -0.67 . . . . 0.0 109.446 179.442 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 6.2 mmmm -75.86 -36.05 59.71 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.316 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.81 -14.61 60.3 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.682 -0.636 . . . . 0.0 110.458 179.358 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.9 tppt? -87.08 -29.25 22.03 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.238 -0.914 . . . . 0.0 109.355 179.334 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -76.53 -35.15 58.46 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 120.192 -0.603 . . . . 0.0 109.88 179.475 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -28.04 65.42 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 119.769 -0.773 . . . . 0.0 109.555 179.41 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -72.04 -30.28 65.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.597 -0.689 . . . . 0.0 109.223 179.032 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -35.79 80.55 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.73 -0.606 . . . . 0.0 109.786 179.637 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.06 -44.24 94.85 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.523 -0.736 . . . . 0.0 109.045 179.096 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 18.0 tp -68.02 -29.06 67.97 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.355 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -32.99 74.76 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.72 -0.613 . . . . 0.0 109.872 179.505 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -75.72 -30.07 59.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 110.046 179.928 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.03 -30.11 43.98 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.618 -0.676 . . . . 0.0 109.985 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -81.06 -27.68 35.61 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.672 -0.642 . . . . 0.0 110.025 179.718 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -96.11 -26.56 15.44 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.562 -0.711 . . . . 0.0 110.307 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 18.4 mmtm 52.86 69.42 2.36 Favored Pre-proline 0 N--CA 1.501 2.084 0 O-C-N 121.412 -0.805 . . . . 0.0 110.692 179.948 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 C--N 1.317 -1.117 0 O-C-N 123.35 1.184 . . . . 0.0 110.343 -179.983 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 33.2 mttp . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.071 0.462 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -130.99 178.02 7.0 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.534 -0.729 . . . . 0.0 110.19 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 52.14 25.96 3.59 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.484 -0.76 . . . . 0.0 110.886 179.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.6 mtm -160.48 -43.88 0.05 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.54 -0.725 . . . . 0.0 110.08 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -68.33 -28.39 67.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.62 -0.675 . . . . 0.0 110.096 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -75.24 -29.66 60.29 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.544 -0.722 . . . . 0.0 110.026 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.3 mtt85 -74.27 -30.54 62.16 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.594 -0.691 . . . . 0.0 109.959 179.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.7 mtt -71.49 -30.16 65.65 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.672 -0.642 . . . . 0.0 109.768 179.693 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 5.1 p -67.5 -29.51 68.95 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.601 -0.687 . . . . 0.0 109.912 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.1 -30.27 71.2 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.597 -0.69 . . . . 0.0 109.95 179.795 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -76.05 -31.98 59.08 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.655 -0.653 . . . . 0.0 109.933 179.82 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.28 -34.71 59.1 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.716 -0.615 . . . . 0.0 109.675 179.565 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.1 m -74.82 -34.17 62.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.651 -0.656 . . . . 0.0 109.454 179.4 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.4 mttt -69.68 -27.78 65.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.686 -0.634 . . . . 0.0 109.746 179.405 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -67.19 -34.55 77.75 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.513 -0.742 . . . . 0.0 109.912 179.726 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -76.24 -32.44 58.88 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.661 -0.649 . . . . 0.0 109.557 179.544 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.4 ' CD1' ' CG ' ' B' ' 197' ' ' GLN . 75.1 mt -72.66 -28.3 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.719 -0.613 . . . . 0.0 109.557 179.335 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 tt -69.27 -38.4 78.37 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.621 -0.674 . . . . 0.0 109.846 179.659 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.2 tmtm? -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.592 -0.693 . . . . 0.0 109.846 179.728 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -64.55 -32.84 74.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.711 -0.618 . . . . 0.0 109.912 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -38.89 91.71 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.594 -0.691 . . . . 0.0 109.83 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.34 -32.07 64.34 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.642 -0.662 . . . . 0.0 109.518 179.455 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.3 tptm -73.19 -33.63 65.52 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.717 -0.614 . . . . 0.0 109.659 179.577 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 20.8 tp -76.02 -32.09 59.2 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.671 -0.643 . . . . 0.0 109.587 179.491 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -76.73 -34.48 58.11 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.747 -0.596 . . . . 0.0 109.558 179.396 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.42 -29.14 62.38 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.708 -0.62 . . . . 0.0 109.79 179.472 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.1 tp -75.8 -36.6 59.69 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.662 -0.649 . . . . 0.0 109.817 179.68 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -76.2 -23.09 54.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.68 -0.637 . . . . 0.0 110.138 179.439 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -81.32 -26.75 35.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.455 -0.778 . . . . 0.0 109.573 179.187 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -76.43 -41.46 47.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.577 -0.702 . . . . 0.0 110.003 179.632 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.28 -24.84 64.92 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.627 179.339 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -66.29 -31.04 71.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.552 -0.717 . . . . 0.0 109.446 179.184 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.01 -31.46 72.6 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.616 -0.677 . . . . 0.0 109.595 179.465 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -34.96 77.41 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.672 -0.643 . . . . 0.0 109.755 179.548 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -61.87 -36.36 81.02 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.596 -0.69 . . . . 0.0 109.975 179.684 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 tp -64.16 -29.86 70.95 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.677 -0.64 . . . . 0.0 109.95 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -82.41 -13.1 57.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.652 -0.655 . . . . 0.0 110.799 179.822 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.5 tp . . . . . 0 N--CA 1.501 2.098 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.598 -179.946 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.98 -63.13 1.44 Allowed 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.583 -0.951 . . . . 0.0 108.946 -179.957 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.6 t -152.83 33.55 0.49 Allowed 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.277 0.56 . . . . 0.0 109.543 179.684 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 9.6 tptm 51.34 26.73 3.22 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.515 -0.741 . . . . 0.0 110.072 -179.065 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -149.03 -43.21 0.14 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.633 -0.667 . . . . 0.0 110.339 -179.785 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.0 -40.83 96.98 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.667 179.77 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.4 mt -76.18 -28.53 57.33 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.8 mm -67.5 -31.06 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.328 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -75.53 -32.73 60.58 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.714 179.766 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -73.78 -35.0 64.89 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.67 -0.644 . . . . 0.0 109.566 179.45 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -29.54 69.04 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.729 -0.607 . . . . 0.0 109.966 179.628 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -77.17 -25.34 51.8 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.625 -0.672 . . . . 0.0 110.132 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -77.86 -31.5 51.45 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.562 -0.711 . . . . 0.0 110.194 179.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 34.5 m -77.21 -24.53 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.573 -0.705 . . . . 0.0 110.294 179.966 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -82.44 -29.71 30.5 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.405 -0.809 . . . . 0.0 109.836 179.653 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -77.49 -27.93 52.03 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.696 -0.627 . . . . 0.0 109.842 179.576 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -77.54 -34.54 53.86 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.537 -0.727 . . . . 0.0 110.021 179.705 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 76.9 mt -74.26 -27.0 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.551 -0.718 . . . . 0.0 109.692 179.574 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 28.1 m -71.61 -31.43 66.89 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.525 -0.735 . . . . 0.0 109.552 179.256 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.26 -44.37 53.17 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.61 -0.681 . . . . 0.0 109.497 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 70.5 t -71.45 -31.83 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.679 -0.638 . . . . 0.0 109.289 179.331 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -72.99 -29.06 62.75 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.704 -0.623 . . . . 0.0 109.797 179.565 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -72.43 -32.17 66.09 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.677 -0.639 . . . . 0.0 109.918 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.46 -29.85 67.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.715 -0.616 . . . . 0.0 109.983 179.803 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.408 HD13 HG23 ' B' ' 190' ' ' ILE . 79.7 mt -73.95 -30.27 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.602 -0.686 . . . . 0.0 109.762 179.775 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 97.7 p -71.73 -40.28 69.53 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.627 -0.671 . . . . 0.0 109.519 179.315 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 9.8 mtpp -71.35 -30.19 65.87 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.589 -0.695 . . . . 0.0 109.455 179.341 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.19 -37.65 72.13 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.668 -0.645 . . . . 0.0 109.341 179.366 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.93 -42.37 97.39 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.625 -0.672 . . . . 0.0 109.486 179.453 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.04 -30.64 71.2 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.46 179.337 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt -64.35 -34.31 77.85 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.686 -0.634 . . . . 0.0 109.33 179.296 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . 0.4 ' CG ' ' CD1' ' A' ' 69' ' ' ILE . 4.0 mm-40 -64.49 -31.35 72.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.77 -0.581 . . . . 0.0 109.465 179.38 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -60.22 -40.47 90.27 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.655 -0.653 . . . . 0.0 109.894 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -62.03 -39.64 93.0 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 120.286 -0.566 . . . . 0.0 109.793 179.605 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.78 -31.88 65.2 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.689 -0.632 . . . . 0.0 109.59 179.575 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -77.41 -34.61 54.7 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.623 -0.673 . . . . 0.0 109.753 179.645 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -77.64 -30.19 52.06 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.738 -0.602 . . . . 0.0 109.606 179.447 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -77.23 -27.92 53.51 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.622 -0.674 . . . . 0.0 109.897 179.513 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.4 -24.8 50.43 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.586 -0.696 . . . . 0.0 110.318 179.773 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -85.21 -28.18 25.59 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.498 -0.751 . . . . 0.0 110.063 179.882 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 17.9 mmtt -61.82 166.27 6.37 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.562 -0.711 . . . . 0.0 110.125 -179.98 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.316 -1.147 0 O-C-N 123.388 1.204 . . . . 0.0 110.361 -179.985 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.107 0.479 . . . . 0.0 110.26 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 19.9 mtpt -62.37 169.39 2.93 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.575 -0.703 . . . . 0.0 110.169 179.909 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -88.71 11.9 16.33 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.541 -0.724 . . . . 0.0 110.923 179.967 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 8.0 mtt -116.64 -30.86 5.69 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.255 -0.903 . . . . 0.0 110.439 179.961 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -66.52 -43.04 86.34 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.518 -0.739 . . . . 0.0 110.161 -179.966 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -61.66 -28.0 69.08 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.642 -0.661 . . . . 0.0 110.296 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.8 mtt-85 -69.58 -27.91 65.51 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.593 -0.692 . . . . 0.0 110.293 179.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.3 mmm -70.51 -29.44 65.94 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.599 -0.688 . . . . 0.0 110.145 179.883 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.11 -29.07 65.93 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.627 -0.671 . . . . 0.0 110.09 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tp -69.39 -28.03 65.83 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.67 -0.644 . . . . 0.0 110.161 179.903 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.1 tp10 -70.46 -30.16 66.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.563 -0.711 . . . . 0.0 110.111 179.985 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -73.55 -43.1 60.72 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.637 -0.664 . . . . 0.0 109.84 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.8 m -67.45 -30.55 70.3 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.701 -0.625 . . . . 0.0 109.596 179.503 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -67.6 -27.9 67.29 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.628 -0.67 . . . . 0.0 109.909 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.84 -40.6 91.92 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.507 -0.745 . . . . 0.0 110.119 179.872 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -73.75 -36.99 65.2 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.609 -0.682 . . . . 0.0 109.579 179.64 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 75.7 mt -73.02 -27.98 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.707 -0.62 . . . . 0.0 109.399 179.261 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.58 -34.91 72.7 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.61 -0.681 . . . . 0.0 109.764 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -62.96 -36.13 82.43 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.557 -0.714 . . . . 0.0 109.753 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 15.5 mt -63.05 -28.61 70.21 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.61 -0.681 . . . . 0.0 109.919 179.696 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.02 -41.16 99.47 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.575 -0.703 . . . . 0.0 110.002 179.822 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.46 -32.19 66.06 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.683 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -77.17 -33.97 56.4 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.728 -0.607 . . . . 0.0 109.631 179.635 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.4 tp -75.72 -29.67 59.0 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.651 -0.656 . . . . 0.0 109.706 179.454 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tt -76.27 -34.77 59.14 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.716 -0.615 . . . . 0.0 109.649 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.31 -29.69 65.32 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.634 -0.666 . . . . 0.0 109.792 179.49 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.83 -40.19 69.26 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.63 -0.669 . . . . 0.0 109.725 179.736 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -69.45 -30.39 68.29 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.579 -0.7 . . . . 0.0 109.696 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -69.02 -29.5 67.67 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.738 -0.601 . . . . 0.0 109.769 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -65.75 -41.62 91.91 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.642 -0.661 . . . . 0.0 109.826 179.879 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -67.9 -29.69 68.84 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.59 -0.694 . . . . 0.0 109.791 179.623 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -68.29 -31.42 70.85 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.687 -0.633 . . . . 0.0 109.861 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 51.6 tp60 -68.15 -35.83 78.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.594 -0.691 . . . . 0.0 109.731 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.8 mt -63.43 -32.2 73.58 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.661 -0.649 . . . . 0.0 109.851 179.702 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -61.5 -38.85 88.81 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.555 -0.716 . . . . 0.0 109.789 179.73 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 44.4 mt -73.73 -30.66 62.96 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.709 -0.619 . . . . 0.0 109.663 179.492 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -86.9 -16.99 34.32 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.59 -0.694 . . . . 0.0 110.688 179.65 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.4 tp . . . . . 0 N--CA 1.5 2.061 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.646 179.996 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.409 ' CD1' ' N ' ' B' ' 168' ' ' SER . 2.9 pp -139.54 -44.59 0.45 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.617 -0.931 . . . . 0.0 110.54 -179.911 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 168' ' ' SER . . . . . 0.409 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 20.5 t -153.85 15.16 0.49 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.407 -0.808 . . . . 0.0 111.299 -179.99 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.9 tptm 49.51 26.44 1.7 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.095 -1.003 . . . . 0.0 111.059 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.63 -46.77 0.1 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.695 -0.628 . . . . 0.0 110.064 179.991 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -73.49 -37.29 65.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.575 -0.703 . . . . 0.0 109.119 179.483 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.3 tt -74.39 -27.59 60.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.746 -0.597 . . . . 0.0 109.408 178.821 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.3 mm -69.53 -33.68 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.591 -0.693 . . . . 0.0 109.277 179.388 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -70.7 -30.56 67.15 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.711 -0.618 . . . . 0.0 109.722 179.538 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -70.03 -41.37 74.37 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.68 -0.637 . . . . 0.0 109.86 179.594 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.35 -32.63 73.44 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.704 -0.623 . . . . 0.0 109.888 179.669 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -73.07 -29.41 62.93 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.71 -0.619 . . . . 0.0 109.969 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -73.03 -33.13 65.53 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.627 -0.671 . . . . 0.0 109.966 179.863 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 61.3 t -71.23 -30.68 41.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.622 -0.674 . . . . 0.0 109.668 179.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.26 -30.45 68.57 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 120.123 -0.631 . . . . 0.0 109.891 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -76.16 -28.35 57.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.678 -0.639 . . . . 0.0 109.941 179.585 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -76.35 -34.16 58.96 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.564 -0.71 . . . . 0.0 110.016 179.771 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 85.1 mt -74.34 -29.97 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.673 -0.642 . . . . 0.0 109.653 179.676 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 26.3 m -72.52 -30.75 64.75 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.549 -0.72 . . . . 0.0 109.778 179.479 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.4 mtp -73.64 -44.64 56.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.625 -0.672 . . . . 0.0 109.688 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -72.08 -30.84 37.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.585 -0.697 . . . . 0.0 109.399 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -74.4 -29.33 61.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.625 -0.672 . . . . 0.0 109.747 179.358 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.23 -30.95 68.15 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.695 -0.628 . . . . 0.0 109.81 179.609 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -36.04 68.9 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.632 -0.667 . . . . 0.0 109.824 179.638 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 75.7 mt -71.57 -31.05 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.687 -0.633 . . . . 0.0 109.439 179.704 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 11.5 m -68.41 -37.89 80.75 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.633 -0.667 . . . . 0.0 109.474 179.519 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 39.2 mttm -74.85 -36.25 62.35 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 120.098 -0.641 . . . . 0.0 109.37 179.349 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.18 -31.32 65.81 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.167 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? -67.56 -39.75 84.92 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.664 -0.648 . . . . 0.0 109.489 179.407 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -31.74 73.0 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.689 -0.632 . . . . 0.0 109.317 179.284 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -63.48 -37.03 85.75 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.71 -0.619 . . . . 0.0 109.411 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -62.05 -29.8 70.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.775 -0.578 . . . . 0.0 109.66 179.458 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -61.69 -46.28 90.39 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.683 -0.635 . . . . 0.0 109.906 179.662 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -63.87 -40.8 97.4 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.752 -0.592 . . . . 0.0 109.863 179.751 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 21.9 tp -71.71 -32.68 68.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.632 -0.668 . . . . 0.0 109.814 179.692 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -76.22 -32.49 58.95 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.569 -0.707 . . . . 0.0 109.814 179.718 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -75.07 -30.41 60.96 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.643 -0.661 . . . . 0.0 109.599 179.525 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -69.86 -30.41 67.87 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.624 -0.673 . . . . 0.0 109.571 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -63.03 -30.01 71.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.643 -0.661 . . . . 0.0 109.732 179.5 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -105.98 24.91 11.61 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.661 -0.649 . . . . 0.0 110.345 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 11.9 mttm -129.3 74.24 81.12 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.489 -0.757 . . . . 0.0 110.173 179.904 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.317 -1.08 0 O-C-N 123.31 1.163 . . . . 0.0 110.407 179.962 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.8 mttt . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.089 0.471 . . . . 0.0 110.3 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -94.04 -168.51 1.88 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.633 -0.667 . . . . 0.0 110.206 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -81.76 -27.8 33.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.615 -0.678 . . . . 0.0 110.336 179.959 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.4 mmm -70.83 -28.54 64.68 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.533 -0.729 . . . . 0.0 110.163 -179.984 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.38 -29.62 59.9 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.604 -0.685 . . . . 0.0 110.06 179.946 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -74.53 -29.08 61.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.645 -0.659 . . . . 0.0 109.984 179.814 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -73.37 -28.71 62.18 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.565 -0.709 . . . . 0.0 110.047 179.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.6 mtt -71.72 -29.84 64.99 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.539 -0.726 . . . . 0.0 109.972 179.824 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.0 m -68.8 -30.09 68.59 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.706 -0.621 . . . . 0.0 109.907 179.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.7 tp -65.55 -28.88 69.48 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.659 -0.651 . . . . 0.0 109.965 179.688 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -63.62 -32.19 73.59 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.653 -0.654 . . . . 0.0 110.081 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -67.8 -52.0 42.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.61 -0.681 . . . . 0.0 109.946 179.667 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.2 m -62.95 -31.92 73.12 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.701 -0.624 . . . . 0.0 109.484 179.504 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -65.46 -28.38 69.17 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.647 -0.658 . . . . 0.0 109.773 179.415 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -62.21 -42.41 99.27 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.572 -0.705 . . . . 0.0 109.935 179.814 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -75.5 -33.26 60.75 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.584 -0.698 . . . . 0.0 109.403 179.417 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -75.63 -26.52 18.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.212 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.8 tp -72.2 -34.04 68.08 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.576 -0.703 . . . . 0.0 109.825 179.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -66.21 -37.48 85.65 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.525 -0.735 . . . . 0.0 109.808 179.696 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.0 mt -64.88 -29.19 70.13 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.695 -0.628 . . . . 0.0 109.92 179.737 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -66.52 -34.37 77.76 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.58 -0.7 . . . . 0.0 109.897 179.837 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -76.61 -31.83 57.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.707 -0.621 . . . . 0.0 109.558 179.589 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -76.2 -30.32 57.95 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.811 -0.555 . . . . 0.0 109.716 179.712 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.1 tp -77.11 -31.99 56.21 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.628 -0.67 . . . . 0.0 109.661 179.581 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.98 -34.6 62.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.622 -0.674 . . . . 0.0 109.558 179.502 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.85 -29.99 67.36 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.784 179.452 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.03 -44.27 66.19 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.636 -0.665 . . . . 0.0 109.609 179.575 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -66.81 -30.85 71.14 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.588 -0.695 . . . . 0.0 109.664 179.445 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.8 -30.2 69.57 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.772 -0.58 . . . . 0.0 109.802 179.593 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.68 -44.26 86.79 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.643 -0.661 . . . . 0.0 109.805 179.765 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -62.83 -33.06 74.44 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.574 -0.704 . . . . 0.0 109.619 179.556 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -62.66 -31.26 72.1 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.703 -0.623 . . . . 0.0 109.962 179.772 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -70.9 -35.95 72.51 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.712 -0.617 . . . . 0.0 109.785 179.689 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.89 -30.52 71.52 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.684 -0.635 . . . . 0.0 109.671 179.611 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -62.43 -36.46 82.47 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.661 -0.649 . . . . 0.0 109.8 179.726 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mp -73.07 -29.51 63.01 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.756 -0.59 . . . . 0.0 109.965 179.656 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -85.86 -23.86 26.93 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.67 -0.644 . . . . 0.0 110.345 179.829 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.2 tp . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.471 -179.977 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.406 ' CD1' ' N ' ' B' ' 168' ' ' SER . 3.0 pp -140.76 -43.65 0.39 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.607 -0.937 . . . . 0.0 110.597 -179.77 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 168' ' ' SER . . . . . 0.406 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 33.3 t -153.21 16.55 0.55 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.344 -0.848 . . . . 0.0 111.141 179.851 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 10.6 tptm 49.84 26.37 1.9 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.133 -0.979 . . . . 0.0 111.12 179.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -154.58 -45.86 0.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.628 -0.67 . . . . 0.0 110.331 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.21 -31.04 62.47 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.436 179.8 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.5 tt -79.69 -29.77 40.88 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.671 -0.643 . . . . 0.0 109.606 179.182 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . 0.428 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.3 mp -75.83 -34.33 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 179.322 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -65.09 -32.73 74.58 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -75.56 -33.43 60.64 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.03 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -35.89 74.39 Favored 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.54 179.549 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -72.86 -30.5 64.04 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.651 -0.656 . . . . 0.0 109.81 179.708 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -29.63 64.47 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.641 -0.662 . . . . 0.0 109.888 179.7 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 65.5 t -69.76 -29.91 42.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.589 -0.694 . . . . 0.0 109.805 179.728 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -68.72 -30.4 69.03 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.61 -0.681 . . . . 0.0 109.841 179.819 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.04 -29.49 61.93 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.643 -0.661 . . . . 0.0 109.897 179.783 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -74.81 -37.45 62.32 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.685 -0.634 . . . . 0.0 109.949 179.699 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . 0.418 HG21 HD11 ' B' ' 183' ' ' ILE . 85.9 mt -72.08 -29.25 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.698 -0.626 . . . . 0.0 109.674 179.606 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 25.2 m -72.49 -31.76 65.64 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.56 -0.713 . . . . 0.0 109.847 179.555 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -42.52 65.74 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.592 -0.693 . . . . 0.0 109.796 179.631 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.69 -31.44 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.695 -0.628 . . . . 0.0 109.457 179.584 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -72.13 -29.75 64.37 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.63 -0.669 . . . . 0.0 109.818 179.579 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -30.86 69.54 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.569 -0.707 . . . . 0.0 109.803 179.739 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -75.59 -35.16 60.63 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.666 -0.646 . . . . 0.0 109.766 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.426 HG23 HD11 ' B' ' 190' ' ' ILE . 79.1 mt -73.39 -31.55 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.58 -0.7 . . . . 0.0 109.43 179.616 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.9 m -70.02 -35.94 74.7 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.7 -0.625 . . . . 0.0 109.327 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -75.2 -37.22 61.24 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.594 -0.691 . . . . 0.0 109.283 179.299 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.75 -30.96 66.16 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.677 -0.639 . . . . 0.0 109.436 179.196 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -68.83 -36.93 78.79 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.697 -0.627 . . . . 0.0 109.753 179.587 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -62.8 -30.28 71.35 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.584 -0.698 . . . . 0.0 109.628 179.571 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -39.33 94.45 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.692 -0.63 . . . . 0.0 109.621 179.443 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -62.69 -29.19 70.47 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.716 -0.615 . . . . 0.0 109.704 179.494 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -61.75 -38.12 86.8 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.665 -0.647 . . . . 0.0 109.771 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -68.01 -39.68 83.13 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.707 -0.62 . . . . 0.0 109.727 179.635 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 11.0 tp -74.07 -30.75 62.53 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.632 -0.667 . . . . 0.0 109.685 179.552 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -77.24 -29.5 54.05 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.604 -0.685 . . . . 0.0 109.852 179.544 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -76.35 -29.21 57.12 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.6 -0.688 . . . . 0.0 109.926 179.647 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.0 -28.03 57.64 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.613 -0.679 . . . . 0.0 110.044 179.778 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.15 -25.96 52.53 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.565 -0.709 . . . . 0.0 110.362 179.87 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -89.7 -27.51 20.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.507 -0.746 . . . . 0.0 110.211 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -78.46 158.95 75.7 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.504 -0.748 . . . . 0.0 110.245 179.964 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 C--N 1.317 -1.112 0 O-C-N 123.388 1.204 . . . . 0.0 110.37 -179.965 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.121 0.486 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -98.44 -174.27 2.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.58 -0.7 . . . . 0.0 110.207 179.965 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 52.85 26.71 4.8 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.508 -0.745 . . . . 0.0 110.858 -179.968 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.5 tmm? -144.0 -46.05 0.27 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.583 -0.698 . . . . 0.0 110.22 179.836 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -66.8 -30.01 70.1 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.643 -0.661 . . . . 0.0 109.92 179.903 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.44 -28.37 61.93 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.652 -0.655 . . . . 0.0 109.946 179.752 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -72.09 -28.58 63.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.565 -0.709 . . . . 0.0 110.06 179.817 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 13.0 mtp -70.33 -34.91 73.24 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.559 -0.713 . . . . 0.0 109.942 179.887 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 t -64.55 -30.14 71.16 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.626 -0.671 . . . . 0.0 109.858 179.727 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.17 -29.36 70.72 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.68 -0.638 . . . . 0.0 109.953 179.673 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -61.78 -33.25 73.77 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.546 -0.721 . . . . 0.0 110.063 179.911 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.29 -48.84 63.9 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.615 -0.678 . . . . 0.0 109.796 179.782 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.4 m -63.04 -33.53 75.63 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 120.266 -0.573 . . . . 0.0 109.599 179.523 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.89 -28.74 69.75 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.66 -0.65 . . . . 0.0 109.819 179.651 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -63.21 -36.78 84.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.601 -0.687 . . . . 0.0 110.056 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -75.0 -35.85 62.0 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.66 -0.65 . . . . 0.0 109.65 179.656 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.445 HG21 HD11 ' A' ' 69' ' ' ILE . 50.8 mm -72.82 -28.46 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.679 -0.638 . . . . 0.0 109.545 179.434 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.5 tp -73.18 -40.16 65.02 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.555 -0.716 . . . . 0.0 109.875 179.516 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.6 ttpp -69.36 -32.57 71.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.622 -0.674 . . . . 0.0 109.597 179.54 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -69.42 -36.28 76.55 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.721 -0.612 . . . . 0.0 109.719 179.55 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -64.54 -33.46 75.96 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.629 -0.67 . . . . 0.0 109.727 179.712 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -74.38 -31.74 62.48 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.673 -0.642 . . . . 0.0 109.448 179.505 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -68.62 -30.47 69.2 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.768 -0.582 . . . . 0.0 109.747 179.599 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.2 tp -73.0 -34.36 66.35 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.56 -0.713 . . . . 0.0 109.696 179.664 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.82 -36.71 64.99 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.253 -0.579 . . . . 0.0 109.611 179.51 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.54 -29.98 67.7 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.708 -0.62 . . . . 0.0 109.723 179.565 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.64 -44.01 58.02 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.67 -0.644 . . . . 0.0 109.624 179.607 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -68.68 -30.79 69.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.619 -0.675 . . . . 0.0 109.538 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.56 -29.56 68.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.602 -0.686 . . . . 0.0 109.703 179.527 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -67.42 -45.91 74.74 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.693 -0.629 . . . . 0.0 109.88 179.703 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.2 tttm -62.86 -29.98 71.16 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.529 -0.732 . . . . 0.0 109.682 179.466 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -64.18 -29.41 70.52 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.669 -0.644 . . . . 0.0 109.863 179.595 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.97 -39.22 79.58 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.521 -0.737 . . . . 0.0 109.797 179.74 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 mt -61.86 -31.06 71.3 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.544 -0.722 . . . . 0.0 109.873 179.727 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -61.84 -40.41 95.2 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.535 -0.728 . . . . 0.0 109.78 179.748 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.4 mt -72.5 -31.38 65.31 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.684 -0.635 . . . . 0.0 109.486 179.392 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -86.15 -14.76 43.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.756 -0.59 . . . . 0.0 110.634 179.533 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.7 tp . . . . . 0 N--CA 1.5 2.062 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.572 -179.895 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.353 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.411 ' CD1' ' N ' ' B' ' 168' ' ' SER . 2.6 pp -139.83 -45.98 0.44 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.614 -0.933 . . . . 0.0 110.458 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 168' ' ' SER . . . . . 0.411 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 37.4 t -156.82 12.38 0.25 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.343 -0.848 . . . . 0.0 111.931 -179.945 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 39.5 tptt 49.24 26.48 1.53 Allowed 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.085 -1.01 . . . . 0.0 111.197 -179.826 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -152.23 -47.77 0.1 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.761 -0.587 . . . . 0.0 109.647 179.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.29 -34.0 63.41 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.374 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.7 tt -75.18 -27.91 59.85 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.798 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.6 mm -68.54 -31.5 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.6 -0.688 . . . . 0.0 109.374 179.475 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -68.52 -30.11 68.84 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.746 -0.596 . . . . 0.0 109.789 179.657 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -74.94 -29.26 60.89 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.63 -0.669 . . . . 0.0 109.924 179.808 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.03 -24.34 55.19 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.641 -0.662 . . . . 0.0 110.243 179.889 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.75 -27.05 31.33 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.451 -0.781 . . . . 0.0 109.691 179.464 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -37.82 37.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.564 -0.71 . . . . 0.0 109.868 179.729 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 11.3 p -73.92 -25.62 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 C-N-CA 119.88 -0.728 . . . . 0.0 109.831 179.508 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -73.97 -30.5 62.55 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.564 -0.71 . . . . 0.0 109.688 179.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 12.3 mtp180 -72.73 -29.91 63.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.618 -0.676 . . . . 0.0 109.784 179.62 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.09 -31.0 69.42 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.598 -0.689 . . . . 0.0 109.872 179.705 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.9 mt -70.39 -31.39 46.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.696 -0.628 . . . . 0.0 109.629 179.695 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.33 -38.09 71.69 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.678 -0.639 . . . . 0.0 109.708 179.582 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 7.2 ttm -67.66 -39.34 84.54 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.612 -0.68 . . . . 0.0 109.746 179.621 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 70.1 t -72.34 -30.86 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.604 -0.685 . . . . 0.0 109.543 179.622 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -73.13 -28.44 62.25 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.654 -0.654 . . . . 0.0 109.977 179.664 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -72.66 -32.29 65.74 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.638 -0.664 . . . . 0.0 109.998 179.855 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -73.88 -38.88 64.26 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.715 -0.615 . . . . 0.0 109.823 179.807 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.452 HD11 HG23 ' B' ' 190' ' ' ILE . 79.4 mt -71.52 -31.52 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.468 179.577 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.0 m -67.91 -35.36 78.32 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.662 -0.649 . . . . 0.0 109.256 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.3 mmtp -77.92 -33.0 52.0 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 179.181 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.85 -31.5 61.67 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.135 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.54 -40.94 76.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.692 -0.63 . . . . 0.0 109.425 179.4 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -31.0 71.47 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.248 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -63.68 -36.5 84.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.666 -0.646 . . . . 0.0 109.375 179.245 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 31.8 tp60 -62.82 -30.45 71.49 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.793 -0.567 . . . . 0.0 109.692 179.504 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -61.28 -42.75 99.17 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.711 -0.618 . . . . 0.0 109.898 179.685 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -62.3 -43.02 99.8 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.707 -0.621 . . . . 0.0 109.84 179.719 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 14.0 tp -72.66 -30.27 64.13 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.659 -0.651 . . . . 0.0 109.656 179.46 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -77.75 -30.71 51.71 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.608 -0.683 . . . . 0.0 109.889 179.548 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -77.59 -29.09 51.83 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.634 -0.667 . . . . 0.0 109.94 179.726 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -78.69 -28.74 45.25 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.62 -0.675 . . . . 0.0 109.941 179.646 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.92 -25.7 43.71 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.661 -0.649 . . . . 0.0 110.259 179.738 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.36 -25.43 29.16 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.54 -0.725 . . . . 0.0 110.244 179.913 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 13.8 mmtt -57.46 110.34 2.4 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.524 -0.735 . . . . 0.0 110.362 -179.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 C--N 1.319 -0.993 0 O-C-N 123.231 1.122 . . . . 0.0 110.427 -179.893 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.13 0.49 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -89.73 -169.82 2.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.6 -0.688 . . . . 0.0 110.191 179.955 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 52.89 27.61 5.67 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.48 -0.763 . . . . 0.0 110.844 179.952 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.13 -42.44 1.71 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.562 -0.712 . . . . 0.0 110.242 179.96 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.48 -27.62 69.4 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.68 -0.637 . . . . 0.0 110.205 179.872 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -71.29 -28.63 64.26 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.593 -0.692 . . . . 0.0 110.264 -179.981 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.16 -32.16 69.99 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.553 -0.717 . . . . 0.0 110.05 179.879 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -30.49 70.95 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.632 -0.667 . . . . 0.0 109.939 179.813 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.1 m -65.04 -29.04 69.9 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.672 -0.642 . . . . 0.0 110.044 179.807 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.83 -28.4 69.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.655 -0.653 . . . . 0.0 110.223 179.93 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -75.42 -36.72 60.76 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.573 -0.705 . . . . 0.0 110.113 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -74.49 -30.54 61.86 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.691 -0.63 . . . . 0.0 109.922 179.735 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 70.4 m -74.81 -29.26 61.03 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.617 -0.677 . . . . 0.0 109.832 179.505 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.0 mmtt -72.47 -26.9 61.98 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.612 -0.68 . . . . 0.0 110.219 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.27 -31.89 64.34 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.521 -0.737 . . . . 0.0 110.305 179.986 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.9 tp60 -75.91 -33.36 59.9 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.525 -0.734 . . . . 0.0 109.877 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.3 mt -74.16 -26.87 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.663 -0.648 . . . . 0.0 109.8 179.706 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 tt -74.93 -37.42 62.04 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.487 -0.758 . . . . 0.0 109.499 179.331 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -62.6 -29.91 70.95 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.646 -0.659 . . . . 0.0 109.521 179.202 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.72 -30.01 69.71 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.616 -0.678 . . . . 0.0 109.935 179.654 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -61.99 -38.17 87.58 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.647 -0.658 . . . . 0.0 109.776 179.763 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.96 -31.85 56.87 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.217 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.8 tttm -75.43 -31.56 60.39 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.82 -0.55 . . . . 0.0 109.781 179.561 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 46.9 tp -76.03 -33.36 59.64 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.592 -0.692 . . . . 0.0 109.709 179.633 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.2 tt -75.35 -35.37 61.15 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.728 -0.607 . . . . 0.0 109.473 179.314 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.51 68.19 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 120.228 -0.589 . . . . 0.0 109.656 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.75 -43.92 74.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.616 -0.678 . . . . 0.0 109.828 179.73 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -66.86 -31.12 71.52 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.586 -0.697 . . . . 0.0 109.623 179.586 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -68.05 -28.4 67.35 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.671 -0.643 . . . . 0.0 109.819 179.546 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.5 -43.27 85.76 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.57 -0.706 . . . . 0.0 109.954 179.858 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.8 ttpp -62.62 -30.13 71.12 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.593 -0.692 . . . . 0.0 109.822 179.818 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -64.48 -38.6 91.58 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.564 -0.71 . . . . 0.0 109.75 179.799 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -64.7 -29.43 70.42 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.707 -0.621 . . . . 0.0 109.708 179.59 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.1 -31.74 73.1 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.68 -0.637 . . . . 0.0 109.793 179.822 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -66.48 -45.68 78.85 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.663 -0.648 . . . . 0.0 110.143 179.998 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.8 mp -62.21 -32.71 73.4 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.69 -0.631 . . . . 0.0 109.899 179.777 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -86.71 -22.04 26.28 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.732 -0.605 . . . . 0.0 110.372 179.714 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.957 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.634 -179.907 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.408 ' CD1' ' N ' ' B' ' 168' ' ' SER . 2.8 pp -140.16 -44.92 0.42 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.59 -0.947 . . . . 0.0 110.582 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 168' ' ' SER . . . . . 0.408 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 10.5 t -153.81 15.12 0.49 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.354 -0.841 . . . . 0.0 111.35 -179.99 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.0 tptt 49.64 26.41 1.78 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.091 -1.006 . . . . 0.0 111.048 -179.835 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -152.5 -46.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.697 -0.627 . . . . 0.0 110.052 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.44 -34.62 63.24 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.215 179.45 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.5 tt -75.92 -27.32 57.57 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.864 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.8 mm -68.76 -32.02 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.627 -0.671 . . . . 0.0 109.336 179.331 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -72.98 -28.51 62.44 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.725 -0.609 . . . . 0.0 109.891 179.542 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.48 -29.52 64.92 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.682 -0.636 . . . . 0.0 109.994 179.818 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.28 -30.73 68.88 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.583 -0.698 . . . . 0.0 109.871 179.923 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -77.03 -31.41 56.27 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.707 -0.621 . . . . 0.0 109.718 179.67 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 5.2 tpm_? -74.51 -30.26 61.73 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.675 -0.641 . . . . 0.0 109.784 179.57 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 65.4 t -71.79 -29.78 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.685 -0.635 . . . . 0.0 109.735 179.66 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -78.26 -23.46 47.27 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.614 -0.679 . . . . 0.0 110.306 179.751 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.48 -28.41 37.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.437 -0.789 . . . . 0.0 109.087 179.448 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -72.0 -29.4 64.17 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.49 -0.756 . . . . 0.0 109.952 179.613 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 84.8 mt -73.83 -29.66 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.647 -0.658 . . . . 0.0 109.826 179.808 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 12.9 m -72.86 -30.14 63.74 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.622 -0.674 . . . . 0.0 109.96 179.787 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.7 mtt -73.99 -40.71 62.77 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.673 -0.642 . . . . 0.0 109.906 179.767 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.4 t -71.48 -30.37 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.621 -0.674 . . . . 0.0 109.577 179.718 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -73.34 -28.81 62.27 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.616 -0.677 . . . . 0.0 109.991 179.638 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.39 -28.51 63.04 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.575 -0.703 . . . . 0.0 110.085 179.806 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -30.66 58.54 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.565 -0.71 . . . . 0.0 110.082 179.969 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 76.4 mt -76.79 -31.13 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.583 -0.698 . . . . 0.0 109.789 179.834 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 14.7 m -73.78 -31.27 63.22 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.744 -0.597 . . . . 0.0 109.609 179.37 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 26.1 mmtm -76.63 -34.73 58.31 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.416 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -34.63 73.23 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.307 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -63.96 -45.15 90.42 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.331 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -71.31 -31.11 67.05 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.023 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -69.98 -35.03 74.11 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.222 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.11 -30.1 71.19 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.678 -0.639 . . . . 0.0 109.602 179.464 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -61.41 -43.05 99.53 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.742 -0.598 . . . . 0.0 109.92 179.695 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -61.97 -38.62 89.23 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.673 -0.642 . . . . 0.0 109.908 179.836 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.08 -29.79 60.75 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.607 -0.683 . . . . 0.0 109.766 179.554 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.5 -29.45 46.63 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.634 -0.666 . . . . 0.0 109.802 179.676 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -79.12 -29.66 43.32 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.506 -0.746 . . . . 0.0 109.828 179.706 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -78.51 -28.15 46.22 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.573 -0.704 . . . . 0.0 109.87 179.618 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.69 -24.17 45.21 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.581 -0.699 . . . . 0.0 110.338 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.36 -25.54 29.07 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.38 -0.825 . . . . 0.0 110.268 179.875 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.7 149.85 69.8 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.481 -0.762 . . . . 0.0 110.32 179.993 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 C--N 1.318 -1.072 0 O-C-N 123.339 1.179 . . . . 0.0 110.414 -179.974 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.7 mptt . . . . . 0 N--CA 1.493 1.714 0 CA-C-O 121.161 0.505 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -115.34 -166.37 1.12 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.503 -0.748 . . . . 0.0 110.161 -179.948 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 53.32 26.11 5.01 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.329 -0.857 . . . . 0.0 110.788 -179.969 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.01 -29.34 15.27 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.615 -0.678 . . . . 0.0 110.0 179.804 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.78 -27.52 68.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.589 -0.694 . . . . 0.0 110.266 179.989 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -75.17 -29.08 60.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.572 -0.705 . . . . 0.0 110.108 179.934 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.2 ttm105 -76.3 -31.61 58.3 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.556 -0.715 . . . . 0.0 110.094 179.843 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.0 mtm -75.88 -30.36 58.83 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.6 -0.688 . . . . 0.0 109.886 179.716 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.4 p -75.49 -29.05 59.43 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.61 -0.681 . . . . 0.0 109.946 179.632 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.06 -29.01 61.68 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.647 -0.658 . . . . 0.0 110.025 179.642 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -72.57 -34.62 67.59 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.552 -0.718 . . . . 0.0 109.917 179.798 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -76.46 -33.54 58.73 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.675 -0.641 . . . . 0.0 109.562 179.521 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.9 m -74.2 -30.8 62.37 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.732 -0.605 . . . . 0.0 109.428 179.351 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -69.76 -27.9 65.32 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.705 -0.622 . . . . 0.0 109.987 179.663 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.94 -37.69 75.93 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.473 -0.767 . . . . 0.0 110.15 179.982 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.13 -40.79 64.64 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.593 -0.692 . . . . 0.0 109.634 179.644 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.442 HD12 HG21 ' A' ' 69' ' ' ILE . 94.7 mt -68.29 -26.92 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.746 -0.596 . . . . 0.0 109.433 179.367 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.4 mt -67.09 -38.55 85.9 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.455 -0.778 . . . . 0.0 109.635 179.433 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -31.15 65.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.532 -0.73 . . . . 0.0 109.614 179.386 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.6 mt -71.69 -34.24 69.47 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.684 -0.635 . . . . 0.0 109.725 179.516 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -67.89 -30.83 70.27 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.587 -0.696 . . . . 0.0 109.746 179.652 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.31 -30.16 57.62 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.678 -0.639 . . . . 0.0 109.674 179.556 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -72.47 -29.15 63.39 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.712 -0.617 . . . . 0.0 109.884 179.667 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.1 tp -70.88 -35.56 72.41 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.515 -0.741 . . . . 0.0 109.838 179.817 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 87.9 mt -75.3 -32.73 61.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.696 -0.628 . . . . 0.0 109.664 179.606 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.83 -30.0 62.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.722 -0.611 . . . . 0.0 109.642 179.444 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.89 -39.7 69.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.677 -0.64 . . . . 0.0 109.694 179.65 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -71.82 -32.17 67.3 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.559 -0.713 . . . . 0.0 109.452 179.404 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -68.15 -29.77 68.74 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.79 -0.569 . . . . 0.0 109.544 179.348 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -62.84 -43.03 99.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.685 -0.635 . . . . 0.0 109.707 179.639 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -66.29 -32.27 73.57 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.554 -0.716 . . . . 0.0 109.484 179.48 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -63.74 -31.61 72.84 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.695 -0.628 . . . . 0.0 109.754 179.459 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -71.08 -35.11 71.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.642 -0.661 . . . . 0.0 109.619 179.566 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.84 -30.18 71.17 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.568 -0.707 . . . . 0.0 109.637 179.559 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -61.93 -40.16 94.56 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.69 -0.631 . . . . 0.0 109.766 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.81 -30.71 71.68 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.704 -0.623 . . . . 0.0 109.738 179.64 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -84.14 -17.41 40.16 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.634 -0.666 . . . . 0.0 110.572 179.696 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.1 tp . . . . . 0 N--CA 1.501 2.097 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.531 -179.939 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . . . . . . . . . 2.9 pp -139.54 -44.2 0.45 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.647 -0.913 . . . . 0.0 110.534 -179.917 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 69.4 m -153.66 15.82 0.51 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.35 -0.843 . . . . 0.0 111.248 179.834 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 8.3 tptt 49.34 26.48 1.6 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.104 -0.998 . . . . 0.0 110.984 -179.789 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -151.65 -46.44 0.11 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.658 -0.651 . . . . 0.0 110.151 -179.926 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -36.55 65.59 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.177 179.609 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.9 tt -74.22 -28.17 61.13 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.894 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . 0.476 HG22 HD11 ' B' ' 173' ' ' ILE . 50.0 mm -66.89 -34.58 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.264 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -72.57 -29.07 63.21 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.611 179.257 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -70.63 -40.38 73.12 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.685 -0.634 . . . . 0.0 109.958 179.634 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.94 -30.77 71.82 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.655 -0.653 . . . . 0.0 109.749 179.87 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -75.45 -28.73 59.42 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.606 -0.684 . . . . 0.0 109.87 179.535 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -73.52 -31.31 63.62 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.563 -0.71 . . . . 0.0 110.139 179.893 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 57.6 t -72.26 -29.58 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.621 -0.674 . . . . 0.0 109.807 179.784 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -72.55 -30.25 64.28 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.55 -0.719 . . . . 0.0 109.928 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 1.3 tpt85 -74.68 -28.99 61.06 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.757 -0.589 . . . . 0.0 109.913 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -73.96 -33.01 63.73 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.612 -0.68 . . . . 0.0 110.018 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 67.5 mt -71.17 -29.23 35.5 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 O-C-N 121.644 -0.66 . . . . 0.0 109.727 179.742 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -34.58 75.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.621 -0.674 . . . . 0.0 109.783 179.651 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.0 ttt -67.99 -46.28 71.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.68 -0.638 . . . . 0.0 109.815 179.674 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 61.3 t -68.54 -30.27 46.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.552 -0.717 . . . . 0.0 109.573 179.66 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -73.7 -29.44 62.28 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.669 -0.644 . . . . 0.0 109.916 179.659 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -72.04 -30.58 65.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.638 -0.664 . . . . 0.0 109.987 179.819 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -40.25 61.99 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.652 -0.655 . . . . 0.0 109.694 179.662 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.443 HD13 HG22 ' B' ' 190' ' ' ILE . 79.7 mt -70.5 -29.78 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.677 -0.639 . . . . 0.0 109.656 179.572 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -34.59 73.79 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.619 -0.675 . . . . 0.0 109.553 179.515 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 55.7 mmtt -75.86 -35.86 59.78 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.677 -0.64 . . . . 0.0 109.654 179.666 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.14 -19.72 56.52 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.694 -0.628 . . . . 0.0 110.257 179.466 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 22.3 mmtt -84.73 -28.43 26.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.279 -0.888 . . . . 0.0 109.455 179.316 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.4 mmtm -78.61 -36.25 44.42 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.733 -0.604 . . . . 0.0 109.734 179.48 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.74 -28.06 63.41 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.494 179.41 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -68.64 -29.22 67.66 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.613 -0.679 . . . . 0.0 109.466 179.253 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -46.69 88.36 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.68 -0.638 . . . . 0.0 109.599 179.525 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -61.38 -35.89 78.75 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.738 -0.601 . . . . 0.0 109.881 179.669 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 6.8 tp -77.65 -31.86 52.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.574 -0.704 . . . . 0.0 109.601 179.412 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -79.59 -31.1 41.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.717 -0.615 . . . . 0.0 109.681 179.447 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -78.42 -29.01 46.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.593 -0.692 . . . . 0.0 109.662 179.453 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -75.94 -28.09 57.82 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.56 -0.713 . . . . 0.0 109.84 179.446 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -73.99 -24.87 59.66 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.574 -0.704 . . . . 0.0 110.29 179.779 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -89.09 -27.92 20.45 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.524 -0.735 . . . . 0.0 110.053 179.859 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -87.42 150.49 49.09 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.616 -0.678 . . . . 0.0 110.234 179.998 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo . . . . . 0 C--N 1.316 -1.137 0 O-C-N 123.376 1.198 . . . . 0.0 110.363 -179.94 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.6 mmmt . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.086 0.47 . . . . 0.0 110.238 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -95.94 -174.65 3.18 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.604 -0.685 . . . . 0.0 110.214 -179.935 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -101.87 -28.28 12.51 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.571 -0.706 . . . . 0.0 110.276 -179.989 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.78 -28.62 40.29 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.603 -0.686 . . . . 0.0 110.26 179.968 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -69.35 -28.38 66.16 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.636 -0.665 . . . . 0.0 110.162 179.885 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -71.28 -28.07 63.88 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.556 -0.715 . . . . 0.0 110.217 179.971 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.72 -31.09 67.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.626 -0.671 . . . . 0.0 110.123 179.918 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 mmt -73.06 -30.11 63.47 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.645 -0.659 . . . . 0.0 109.958 179.857 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.17 -28.59 64.36 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.655 -0.653 . . . . 0.0 109.942 179.664 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.8 tt -68.97 -29.24 67.43 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.621 -0.674 . . . . 0.0 110.026 179.854 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -67.58 -39.46 84.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.568 -0.708 . . . . 0.0 110.022 179.959 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -73.41 -30.82 63.5 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.675 -0.641 . . . . 0.0 109.753 179.624 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.2 m -74.44 -29.59 61.54 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.632 -0.667 . . . . 0.0 109.714 179.551 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -71.32 -28.12 63.87 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.655 -0.653 . . . . 0.0 110.047 179.711 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -70.21 -33.63 71.91 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.636 -0.665 . . . . 0.0 110.145 179.911 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -76.46 -34.36 58.7 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.651 -0.655 . . . . 0.0 109.857 179.669 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.5 mt -74.85 -27.87 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.667 -0.645 . . . . 0.0 109.683 179.498 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.3 tt -74.12 -29.72 61.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.587 -0.696 . . . . 0.0 109.982 179.666 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -74.74 -38.89 62.13 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.517 -0.739 . . . . 0.0 109.931 179.748 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.401 ' CD2' ' CD1' ' B' ' 193' ' ' LEU . 2.7 tp -70.9 -27.42 63.78 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.603 -0.686 . . . . 0.0 109.922 179.573 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -71.76 -33.25 68.49 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.541 -0.724 . . . . 0.0 109.553 179.371 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -74.31 -30.34 62.01 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.787 -0.571 . . . . 0.0 109.577 179.496 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.8 tttt -72.15 -37.7 69.33 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.586 -0.696 . . . . 0.0 109.824 179.685 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 24.1 tp -66.91 -31.16 71.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.56 -0.712 . . . . 0.0 109.967 179.703 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 tp -76.61 -34.14 58.39 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.683 -0.636 . . . . 0.0 109.849 179.75 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.65 -28.17 60.75 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 120.254 -0.578 . . . . 0.0 109.932 179.558 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.07 -36.12 59.11 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.581 -0.699 . . . . 0.0 109.81 179.751 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -72.78 -29.06 62.98 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.576 -0.702 . . . . 0.0 109.886 179.618 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -72.36 -28.25 62.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.658 -0.651 . . . . 0.0 109.965 179.564 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.24 -41.21 70.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.673 -0.642 . . . . 0.0 110.033 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 tttm -65.19 -29.52 70.34 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.511 -0.743 . . . . 0.0 109.753 179.742 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -64.79 -33.4 75.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.599 -0.688 . . . . 0.0 109.83 179.662 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -69.27 -29.87 67.85 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.649 -0.657 . . . . 0.0 109.784 179.687 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.15 -37.04 83.09 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.695 -0.628 . . . . 0.0 109.893 179.738 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -61.52 -33.49 73.91 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.585 -0.697 . . . . 0.0 109.97 179.921 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.3 mp -77.99 -29.37 49.6 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.602 -0.686 . . . . 0.0 109.804 179.686 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -88.7 -21.01 24.11 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.655 -0.653 . . . . 0.0 110.545 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.1 tp . . . . . 0 N--CA 1.5 2.049 0 CA-C-O 118.014 -0.994 . . . . 0.0 110.545 -179.931 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.41 HD13 ' OG ' ' B' ' 168' ' ' SER . 3.2 pp -143.08 -42.24 0.3 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.687 -0.89 . . . . 0.0 110.761 -179.527 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 168' ' ' SER . . . . . 0.41 ' OG ' HD13 ' B' ' 167' ' ' LEU . 53.1 m -153.07 17.85 0.57 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.32 -0.863 . . . . 0.0 111.039 179.999 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 4.8 tptm 49.73 26.63 1.92 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.244 -0.91 . . . . 0.0 110.884 -179.729 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -151.79 -46.77 0.11 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.7 -0.625 . . . . 0.0 110.133 -179.996 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.48 -30.79 61.98 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.798 -0.761 . . . . 0.0 109.294 179.512 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 2.9 tt -78.31 -30.43 48.27 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.727 -0.608 . . . . 0.0 109.583 179.176 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . 0.446 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 1.9 mp -73.03 -33.97 44.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.409 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.23 -32.55 72.82 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.955 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -73.02 -38.57 66.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.715 -0.615 . . . . 0.0 109.427 179.222 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.79 -30.63 71.65 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.696 -0.628 . . . . 0.0 109.645 179.637 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -78.89 -30.95 45.2 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.655 -0.653 . . . . 0.0 109.831 179.738 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.37 -29.89 47.68 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.744 -0.597 . . . . 0.0 109.684 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 68.4 t -76.3 -29.73 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.72 -0.613 . . . . 0.0 109.58 179.57 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -73.43 -30.59 63.32 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.523 -0.735 . . . . 0.0 109.915 179.833 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.21 -29.3 60.27 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.674 -0.642 . . . . 0.0 109.942 179.714 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -75.93 -36.7 59.27 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.634 -0.666 . . . . 0.0 109.914 179.831 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 72.8 mt -71.28 -29.92 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.705 -0.622 . . . . 0.0 109.511 179.663 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 86.0 m -72.21 -39.32 68.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.61 -0.681 . . . . 0.0 109.743 179.594 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 mtp -72.53 -37.7 68.26 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.635 -0.665 . . . . 0.0 109.495 179.525 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 66.5 t -72.56 -34.79 49.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 179.283 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -64.87 -33.27 75.61 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.748 -0.595 . . . . 0.0 109.526 179.485 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -67.39 -26.1 66.28 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.677 -0.639 . . . . 0.0 109.933 179.562 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -76.31 -25.34 54.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.52 -0.737 . . . . 0.0 110.361 179.871 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.477 HD11 HG23 ' B' ' 190' ' ' ILE . 25.6 mm -80.38 -35.95 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.484 -0.76 . . . . 0.0 109.398 -179.945 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 14.9 m -76.01 -29.38 58.12 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.755 -0.591 . . . . 0.0 109.839 179.595 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 7.3 mmmt -77.51 -31.58 53.56 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.624 -0.672 . . . . 0.0 109.786 179.708 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . 0.401 ' CD1' ' CD2' ' A' ' 72' ' ' LEU . 0.4 OUTLIER -75.68 -29.71 59.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.546 -0.721 . . . . 0.0 109.49 179.491 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -34.52 71.07 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.63 -0.669 . . . . 0.0 109.762 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -71.78 -31.23 66.39 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.676 -0.64 . . . . 0.0 109.71 179.561 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -68.4 -31.51 70.91 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.674 -0.641 . . . . 0.0 109.576 179.509 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -66.7 -30.43 70.67 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.69 -0.631 . . . . 0.0 109.734 179.533 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -62.65 -40.79 98.13 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.651 -0.656 . . . . 0.0 109.794 179.706 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -62.25 -39.73 93.83 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.779 179.681 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 8.7 tp -73.59 -33.21 64.51 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.563 -0.71 . . . . 0.0 109.71 179.473 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.84 -29.94 56.1 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.72 -0.612 . . . . 0.0 109.753 179.553 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -77.55 -29.05 52.02 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.609 -0.682 . . . . 0.0 109.953 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -78.06 -28.26 48.86 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.524 -0.735 . . . . 0.0 110.081 179.71 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -80.07 -26.23 39.72 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.585 -0.697 . . . . 0.0 110.289 179.868 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -89.32 -27.39 20.55 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.415 -0.803 . . . . 0.0 110.258 179.93 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -72.65 148.55 90.18 Favored Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.55 -0.719 . . . . 0.0 110.154 179.943 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo . . . . . 0 C--N 1.317 -1.085 0 O-C-N 123.402 1.211 . . . . 0.0 110.42 179.948 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.1 mttt . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.074 0.464 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -144.71 166.0 26.44 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.639 -0.663 . . . . 0.0 110.241 -179.921 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -94.27 -27.2 16.26 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.581 -0.699 . . . . 0.0 110.371 -179.963 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.7 ttt -74.81 -27.92 60.49 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.494 -0.754 . . . . 0.0 110.332 -179.983 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -66.75 -33.65 76.09 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.531 -0.73 . . . . 0.0 110.141 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -67.97 -29.88 69.02 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.613 -0.68 . . . . 0.0 109.916 179.735 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -66.07 -29.98 70.41 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.656 -0.653 . . . . 0.0 109.898 179.823 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -43.01 98.09 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.681 -0.637 . . . . 0.0 109.892 179.831 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 5.3 p -68.09 -30.82 70.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.655 -0.653 . . . . 0.0 109.78 179.686 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.86 -29.07 67.3 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.813 179.617 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.92 -32.65 74.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.594 -0.691 . . . . 0.0 109.934 179.81 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -75.48 -36.98 60.52 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.598 -0.689 . . . . 0.0 109.771 179.68 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 32.3 m -72.91 -30.57 64.02 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.694 -0.628 . . . . 0.0 109.557 179.438 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.04 -28.2 65.28 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.689 -0.632 . . . . 0.0 109.803 179.514 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -66.65 -37.92 85.8 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.585 -0.697 . . . . 0.0 110.081 179.926 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.46 -40.33 67.07 Favored 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.64 179.605 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.1 mt -68.41 -26.84 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.793 -0.567 . . . . 0.0 109.502 179.457 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.67 -37.42 79.6 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.533 -0.729 . . . . 0.0 109.796 179.563 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -68.39 -31.6 71.07 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.588 -0.695 . . . . 0.0 109.846 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.9 mt -68.65 -29.37 67.84 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.655 -0.653 . . . . 0.0 110.039 179.84 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -70.88 -31.16 67.74 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.595 -0.691 . . . . 0.0 109.958 179.824 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -78.12 -31.35 49.89 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.554 -0.716 . . . . 0.0 109.712 179.572 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -74.72 -29.45 61.19 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.707 -0.621 . . . . 0.0 109.771 179.506 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.8 tp -72.29 -34.77 68.41 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.626 -0.671 . . . . 0.0 109.883 179.756 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.8 mt -75.18 -36.45 61.47 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.643 -0.66 . . . . 0.0 109.426 179.513 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.12 -28.45 67.33 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.082 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.1 tp -67.9 -48.16 66.79 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.72 -0.613 . . . . 0.0 110.054 179.698 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -63.06 -25.91 68.6 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.612 -0.68 . . . . 0.0 110.366 179.868 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.57 -29.96 63.99 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.426 -0.796 . . . . 0.0 110.148 179.88 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -76.76 -46.9 23.41 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.591 -0.693 . . . . 0.0 109.603 179.555 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -65.67 -24.34 66.99 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.647 -0.821 . . . . 0.0 108.815 178.686 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -60.82 -26.57 67.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.428 -0.795 . . . . 0.0 109.266 178.403 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.3 tp60 -59.15 -38.92 80.84 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.512 -0.743 . . . . 0.0 109.733 179.191 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.69 -34.33 76.69 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 179.137 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.424 ' CG ' ' HE1' ' B' ' 176' ' ' MET . 2.4 m-85 -61.84 -29.82 70.43 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.741 -0.599 . . . . 0.0 109.818 179.524 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.07 -28.08 65.14 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.657 -0.652 . . . . 0.0 109.993 179.673 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -95.02 -7.24 40.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.623 -0.673 . . . . 0.0 111.063 179.946 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.034 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.418 -179.969 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.412 ' CD1' ' CB ' ' B' ' 171' ' ' GLU . 1.3 pp -50.92 -47.14 61.01 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.848 -0.795 . . . . 0.0 111.594 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.6 t -152.96 15.99 0.56 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.228 -0.92 . . . . 0.0 111.278 179.982 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 6.9 tptm 49.7 26.33 1.8 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.179 -0.951 . . . . 0.0 110.985 -179.893 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -151.71 -46.83 0.11 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.659 -0.65 . . . . 0.0 109.974 -179.944 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . 0.412 ' CB ' ' CD1' ' B' ' 167' ' ' LEU . 1.9 mt-10 -75.08 -32.21 61.41 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 119.881 -0.728 . . . . 0.0 109.182 179.407 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 1.5 tt -78.45 -28.23 46.54 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 178.886 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 49.6 mm -71.69 -32.28 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.655 -0.653 . . . . 0.0 109.433 179.52 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 65.5 mm-40 -68.2 -32.79 73.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.655 -0.653 . . . . 0.0 109.671 179.541 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 -63.52 -46.04 87.9 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.482 179.384 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.424 ' HE1' ' CG ' ' A' ' 87' ' ' PHE . 8.2 mtt -52.85 -31.86 41.56 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.665 -0.647 . . . . 0.0 110.73 179.765 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -68.8 -52.95 24.67 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.683 -0.635 . . . . 0.0 109.75 179.839 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -28.19 67.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.736 -0.603 . . . . 0.0 109.78 179.48 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 94.3 t -77.88 -32.08 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.636 -0.665 . . . . 0.0 109.752 179.703 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -74.92 -31.38 61.52 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.562 -0.711 . . . . 0.0 109.64 179.553 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -25.27 64.18 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.724 -0.61 . . . . 0.0 109.86 179.345 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -68.62 -42.25 78.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.534 -0.729 . . . . 0.0 110.419 179.994 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 69.7 mt -66.94 -28.91 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.429 179.697 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 24.5 m -63.55 -32.05 73.39 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.608 -0.682 . . . . 0.0 109.623 179.43 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 1.2 ttt -68.52 -51.02 47.71 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.59 -0.694 . . . . 0.0 109.783 179.62 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.8 t -68.73 -31.61 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.546 -0.721 . . . . 0.0 109.425 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -75.3 -28.34 59.66 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.735 -0.603 . . . . 0.0 109.895 179.584 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -74.6 -27.87 60.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.605 -0.685 . . . . 0.0 110.085 179.76 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -74.23 -33.28 63.31 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.597 -0.689 . . . . 0.0 109.967 179.852 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . . . . . . . . . 72.1 mt -73.26 -31.08 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.647 -0.658 . . . . 0.0 109.495 179.769 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.23 -31.81 71.57 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.716 -0.615 . . . . 0.0 109.48 179.377 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 23.7 mmtt -77.25 -34.1 55.87 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.678 -0.639 . . . . 0.0 109.511 179.381 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.72 -31.49 65.01 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.294 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.9 tptp -66.5 -40.83 89.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.623 -0.673 . . . . 0.0 109.372 179.323 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.92 -30.41 70.55 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.224 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -63.35 -36.93 85.34 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.319 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -63.24 -30.64 71.75 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.692 -0.63 . . . . 0.0 109.519 179.464 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -61.32 -38.52 87.18 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.725 -0.609 . . . . 0.0 109.785 179.684 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.85 -39.83 93.21 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.719 -0.613 . . . . 0.0 109.862 179.772 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.8 tp -72.76 -30.7 64.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.658 -0.651 . . . . 0.0 109.831 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.15 -30.22 54.97 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.61 -0.682 . . . . 0.0 109.782 179.639 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -75.86 -28.72 58.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.645 -0.659 . . . . 0.0 109.994 179.732 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.88 -27.85 57.9 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.559 -0.713 . . . . 0.0 110.184 179.752 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.75 -27.82 50.52 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.501 -0.749 . . . . 0.0 110.268 179.936 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -91.08 -28.11 18.15 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.627 -0.671 . . . . 0.0 110.28 179.991 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 15.2 mmtt -73.63 150.61 88.93 Favored Pre-proline 0 N--CA 1.496 1.832 0 O-C-N 121.518 -0.739 . . . . 0.0 110.18 -179.947 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.317 -1.113 0 O-C-N 123.334 1.176 . . . . 0.0 110.408 179.981 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.09 0.472 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -127.09 178.61 5.9 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.536 -0.727 . . . . 0.0 110.208 -179.986 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 52.93 29.01 7.18 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.434 -0.792 . . . . 0.0 110.84 -179.928 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.7 mtt -148.26 -45.45 0.16 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.588 -0.695 . . . . 0.0 110.222 -179.983 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -62.46 -27.69 69.3 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.706 -0.621 . . . . 0.0 110.352 -179.99 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -72.56 -27.92 62.5 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.534 -0.729 . . . . 0.0 110.359 -179.973 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -74.77 -28.7 60.85 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.54 -0.725 . . . . 0.0 110.218 179.956 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.3 mtt -73.99 -30.15 62.33 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.597 -0.69 . . . . 0.0 110.011 179.766 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.2 m -70.14 -29.07 65.9 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.639 -0.663 . . . . 0.0 109.942 179.606 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 tp -67.27 -28.79 68.32 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.621 -0.674 . . . . 0.0 110.066 179.725 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -66.27 -29.49 69.73 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.575 -0.703 . . . . 0.0 110.162 179.997 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -72.72 -44.61 61.48 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.589 -0.694 . . . . 0.0 109.886 179.786 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.6 m -65.27 -30.27 71.12 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.646 -0.659 . . . . 0.0 109.648 179.51 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -66.4 -28.22 68.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.704 -0.623 . . . . 0.0 109.945 179.608 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.15 -44.01 89.98 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.614 -0.679 . . . . 0.0 110.101 179.938 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -39.05 72.7 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.651 -0.656 . . . . 0.0 109.642 179.739 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.404 HD12 HG21 ' A' ' 69' ' ' ILE . 81.5 mt -71.03 -25.89 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.719 -0.613 . . . . 0.0 109.634 179.42 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.2 tt -72.32 -34.42 68.06 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.534 -0.728 . . . . 0.0 110.001 179.755 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp -67.3 -36.63 81.9 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.491 -0.755 . . . . 0.0 109.91 179.806 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.3 mt -64.74 -28.29 69.49 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.669 -0.645 . . . . 0.0 109.944 179.748 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -66.08 -38.3 87.95 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.593 -0.692 . . . . 0.0 110.13 179.962 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.96 -31.08 61.39 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.611 -0.681 . . . . 0.0 109.743 179.654 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -77.9 -30.41 50.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.618 -0.676 . . . . 0.0 109.635 179.691 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -78.78 -30.87 45.82 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.62 -0.675 . . . . 0.0 109.725 179.604 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.5 mt -77.28 -30.54 54.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.642 -0.661 . . . . 0.0 109.753 179.584 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.01 -28.4 60.51 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.667 -0.646 . . . . 0.0 110.032 179.638 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.65 -36.06 57.61 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.596 -0.69 . . . . 0.0 109.875 179.796 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -74.72 -27.38 60.35 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.616 -0.677 . . . . 0.0 109.993 179.731 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -76.53 -27.7 56.05 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.565 -0.709 . . . . 0.0 109.782 179.597 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.71 -41.95 59.24 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.663 -0.648 . . . . 0.0 109.886 179.63 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.4 ptmt -65.65 -26.31 67.74 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.758 -0.777 . . . . 0.0 109.672 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -63.8 -29.42 70.63 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.572 -0.705 . . . . 0.0 109.621 179.258 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -63.97 -35.43 80.67 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.6 -0.687 . . . . 0.0 109.877 179.717 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.01 -33.11 75.05 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.6 -0.688 . . . . 0.0 109.605 179.723 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.421 ' CG ' ' HE3' ' B' ' 176' ' ' MET . 6.7 m-85 -62.77 -29.27 70.57 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.609 -0.682 . . . . 0.0 110.049 179.782 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.35 -29.09 59.83 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.589 -0.695 . . . . 0.0 110.14 179.834 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -87.57 -26.66 23.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.653 -0.654 . . . . 0.0 110.371 179.894 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.4 tp . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.21 -179.978 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' B' B ' 167' ' ' LEU . . . . . 0.407 ' CD1' ' N ' ' B' ' 168' ' ' SER . 3.0 pp -141.46 -42.94 0.36 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.567 -0.961 . . . . 0.0 110.724 -179.735 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 168' ' ' SER . . . . . 0.407 ' N ' ' CD1' ' B' ' 167' ' ' LEU . 48.1 t -153.34 16.97 0.54 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.317 -0.864 . . . . 0.0 111.234 179.934 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.3 tptt 50.03 26.26 1.99 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.099 -1.001 . . . . 0.0 111.084 -179.954 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -154.3 -45.52 0.09 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.6 -0.687 . . . . 0.0 110.409 179.982 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.48 -30.75 61.97 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.899 -0.72 . . . . 0.0 109.434 179.691 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 3.3 tt -79.29 -29.56 42.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.733 -0.605 . . . . 0.0 109.601 179.18 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 173' ' ' ILE . . . . . 0.426 ' CD1' ' N ' ' B' ' 173' ' ' ILE . 2.5 mp -77.56 -34.55 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.405 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -65.27 -33.61 76.39 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.832 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -75.58 -36.21 60.4 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.976 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 176' ' ' MET . . . . . 0.421 ' HE3' ' CG ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -68.05 -30.71 69.99 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.678 -0.638 . . . . 0.0 109.804 179.437 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -75.34 -34.51 61.2 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.644 -0.66 . . . . 0.0 109.677 179.655 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -30.05 67.99 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.689 -0.632 . . . . 0.0 109.63 179.488 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 82.4 t -66.28 -32.14 56.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.695 -0.628 . . . . 0.0 109.699 179.711 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . 0.415 ' O ' ' OG1' ' B' ' 184' ' ' THR . 1.9 m-20 -65.56 -43.18 90.63 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.7 -0.625 . . . . 0.0 109.93 179.882 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -34.07 75.59 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.733 -0.605 . . . . 0.0 109.97 179.8 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -71.16 -45.91 62.51 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.521 -0.737 . . . . 0.0 109.855 179.842 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 78.0 mt -69.73 -29.45 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.649 -0.657 . . . . 0.0 109.38 179.513 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 184' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 87.7 m -70.22 -32.49 70.4 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.633 -0.667 . . . . 0.0 109.43 179.343 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.4 ttm -70.22 -48.33 57.49 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.623 -0.673 . . . . 0.0 109.754 179.511 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.8 t -69.84 -31.32 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.551 -0.718 . . . . 0.0 109.376 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -73.99 -29.79 62.14 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.705 -0.622 . . . . 0.0 109.757 179.522 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.24 -30.7 67.83 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.625 -0.672 . . . . 0.0 109.827 179.54 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -37.65 67.64 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.673 -0.642 . . . . 0.0 109.621 179.652 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 190' ' ' ILE . . . . . 0.421 HG23 HD12 ' B' ' 190' ' ' ILE . 82.1 mt -69.26 -31.43 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.623 -0.673 . . . . 0.0 109.495 179.542 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.13 -41.59 85.88 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.659 -0.651 . . . . 0.0 109.617 179.55 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -70.69 -35.87 72.99 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.635 -0.665 . . . . 0.0 109.583 179.528 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.71 -31.32 68.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.673 -0.642 . . . . 0.0 109.501 179.399 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.4 tptp -69.14 -41.13 77.72 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.637 -0.664 . . . . 0.0 109.699 179.482 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -62.79 -31.69 72.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.665 -0.647 . . . . 0.0 109.508 179.518 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -37.16 86.17 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.696 -0.628 . . . . 0.0 109.382 179.256 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -62.72 -29.6 70.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.734 -0.604 . . . . 0.0 109.642 179.496 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.76 -43.61 98.52 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.632 -0.667 . . . . 0.0 109.741 179.695 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -63.09 -44.71 94.96 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.712 -0.618 . . . . 0.0 109.853 179.796 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 18.4 tp -71.6 -31.28 66.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.589 -0.694 . . . . 0.0 109.809 179.59 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -78.26 -29.92 48.32 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.622 -0.674 . . . . 0.0 109.834 179.595 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -78.07 -29.11 49.03 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.537 -0.727 . . . . 0.0 109.86 179.701 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.91 -28.11 49.65 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.66 -0.65 . . . . 0.0 110.034 179.596 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -79.3 -24.8 42.61 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.621 -0.674 . . . . 0.0 110.394 179.874 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -86.33 -27.97 23.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.42 -0.8 . . . . 0.0 110.132 179.88 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 5.0 mtmt -65.85 156.1 84.54 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.622 -0.674 . . . . 0.0 110.141 -179.992 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 C--N 1.316 -1.154 0 O-C-N 123.391 1.206 . . . . 0.0 110.394 -179.927 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.722 HD11 ' HG2' ' B' ' 201' ' ' GLU . 6.3 tt . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 121.155 0.502 . . . . 0.0 109.882 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -67.47 -29.93 69.5 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.544 -0.722 . . . . 0.0 109.955 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -74.94 -35.59 62.15 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.651 -0.656 . . . . 0.0 109.943 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 88.3 m -71.29 -30.81 66.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.763 -0.586 . . . . 0.0 109.682 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -68.74 -28.71 67.06 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.618 -0.676 . . . . 0.0 109.899 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -66.86 -32.36 73.58 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.585 -0.697 . . . . 0.0 110.022 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -78.18 -31.34 49.53 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.644 -0.66 . . . . 0.0 109.695 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.672 HG12 HD22 ' B' ' 193' ' ' LEU . 85.4 mt -77.28 -29.67 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.663 -0.648 . . . . 0.0 109.539 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.97 -33.35 63.82 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.639 -0.663 . . . . 0.0 109.651 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.9 tptt -66.31 -30.7 71.16 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.655 -0.653 . . . . 0.0 109.563 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.65 HD11 HD13 ' B' ' 193' ' ' LEU . 10.4 mt -62.38 -31.24 71.87 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.669 -0.644 . . . . 0.0 109.856 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -63.01 -36.59 84.06 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.57 -0.707 . . . . 0.0 109.787 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -76.36 -31.52 58.11 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.694 -0.629 . . . . 0.0 109.576 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -77.07 -30.49 55.52 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.702 -0.624 . . . . 0.0 109.671 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 41.5 tp -77.91 -32.8 51.94 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.614 -0.679 . . . . 0.0 109.633 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.3 mt -75.18 -31.63 61.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.706 -0.621 . . . . 0.0 109.565 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.66 -30.41 67.01 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.645 -0.66 . . . . 0.0 109.731 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.484 HD12 HG12 ' B' ' 183' ' ' ILE . 0.6 OUTLIER -68.16 -41.81 80.98 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.72 -0.613 . . . . 0.0 109.641 179.649 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -68.15 -31.14 70.49 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.609 -0.682 . . . . 0.0 109.674 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.91 -30.53 69.88 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.657 -0.652 . . . . 0.0 109.62 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.07 -45.84 83.62 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.672 -0.642 . . . . 0.0 109.749 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.3 tttm -64.34 -32.2 73.71 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.568 -0.707 . . . . 0.0 109.45 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 39.1 t-80 -64.78 -30.13 71.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.722 -0.611 . . . . 0.0 109.844 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.7 tm0? -65.99 -33.58 76.13 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.601 -0.687 . . . . 0.0 109.736 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.8 mt -65.76 -32.32 73.79 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.631 -0.668 . . . . 0.0 109.661 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -61.28 -35.83 78.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.654 -0.654 . . . . 0.0 109.83 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' A' ' 88' ' ' LEU . 1.1 mm? -61.73 -29.94 70.45 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.74 -0.6 . . . . 0.0 109.832 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -101.71 -19.6 15.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.676 -0.64 . . . . 0.0 110.553 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.789 HD11 ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.047 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.552 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.755 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.1 OUTLIER -144.88 -67.47 0.32 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.61 -0.935 . . . . 0.0 110.751 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 11.0 t -145.39 16.68 1.5 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.145 -0.972 . . . . 0.0 110.919 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.3 tptt 50.68 25.76 2.21 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.171 -0.955 . . . . 0.0 110.684 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -148.93 -46.77 0.14 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.655 -0.653 . . . . 0.0 109.472 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.574 ' HB2' HD12 ' B' ' 167' ' ' LEU . 2.1 mm-40 -68.9 -33.17 73.32 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 119.95 -0.7 . . . . 0.0 109.262 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.755 ' N ' HD11 ' B' ' 167' ' ' LEU . 1.5 tt -77.87 -27.75 49.81 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.789 ' CD1' HD11 ' A' ' 90' ' ' LEU . 49.1 mm -71.14 -31.08 43.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.632 -0.667 . . . . 0.0 109.399 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -70.35 -29.49 66.18 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.689 -0.632 . . . . 0.0 109.984 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.564 ' O ' HG23 ' B' ' 179' ' ' VAL . 82.0 m-20 -69.29 -29.08 66.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.605 -0.684 . . . . 0.0 110.081 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.787 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -71.46 -29.34 64.73 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.527 -0.733 . . . . 0.0 110.045 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -75.6 -29.96 59.44 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.603 -0.686 . . . . 0.0 110.168 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.4 ttp180 -76.11 -32.21 59.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.619 -0.675 . . . . 0.0 109.95 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.564 HG23 ' O ' ' B' ' 175' ' ' ASN . 72.1 t -74.08 -29.86 26.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.684 -0.635 . . . . 0.0 109.652 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -71.76 -28.59 63.75 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.667 -0.645 . . . . 0.0 110.022 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 19.4 mtp180 -74.15 -28.39 61.29 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.568 -0.708 . . . . 0.0 110.077 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -73.82 -29.12 61.97 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.588 -0.695 . . . . 0.0 110.128 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.484 HG12 HD12 ' A' ' 79' ' ' LEU . 85.0 mt -72.53 -27.81 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.587 -0.696 . . . . 0.0 109.894 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.2 m -71.2 -31.01 67.09 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.56 -0.712 . . . . 0.0 109.937 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.3 ttp -71.7 -44.08 64.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.637 -0.664 . . . . 0.0 109.934 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.0 t -71.28 -31.24 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.615 -0.678 . . . . 0.0 109.554 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -75.21 -29.11 60.21 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.717 -0.614 . . . . 0.0 109.779 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 188' ' ' GLN . . . . . 0.4 ' O ' ' OG ' ' B' ' 191' ' ' SER . 11.5 tp-100 -73.27 -28.5 62.16 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.654 -0.654 . . . . 0.0 110.068 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -32.49 64.13 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.572 -0.705 . . . . 0.0 109.962 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.638 HG12 HD22 ' A' ' 72' ' ' LEU . 77.0 mt -73.41 -31.67 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.677 -0.64 . . . . 0.0 109.776 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 191' ' ' SER . . . . . 0.4 ' OG ' ' O ' ' B' ' 188' ' ' GLN . 19.0 p -69.9 -35.61 74.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.649 -0.657 . . . . 0.0 109.636 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -76.91 -32.28 57.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.659 -0.651 . . . . 0.0 109.431 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.672 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -73.89 -30.8 62.81 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.685 -0.634 . . . . 0.0 109.374 179.277 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -67.76 -40.32 84.09 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.647 -0.658 . . . . 0.0 109.514 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -68.48 -33.11 73.58 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.634 -0.666 . . . . 0.0 109.344 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 1.5 ttpp -63.91 -34.54 78.2 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -29.87 71.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.753 -0.592 . . . . 0.0 109.469 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -47.65 85.36 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.652 -0.655 . . . . 0.0 109.74 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -62.41 -41.49 98.73 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.198 -0.601 . . . . 0.0 109.925 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.58 -36.31 68.15 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.619 -0.676 . . . . 0.0 109.733 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.722 ' HG2' HD11 ' A' ' 62' ' ' LEU . 55.9 mt-10 . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.642 -0.661 . . . . 0.0 109.826 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.4 HD11 ' OE2' ' B' ' 201' ' ' GLU . 4.8 tp . . . . . 0 N--CA 1.497 1.892 0 CA-C-O 121.099 0.476 . . . . 0.0 109.987 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -76.64 -32.69 58.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.605 -0.684 . . . . 0.0 110.089 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -76.83 -30.7 56.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.598 -0.689 . . . . 0.0 109.771 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.3 m -74.53 -29.98 61.59 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.727 -0.608 . . . . 0.0 109.704 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -70.41 -27.04 63.98 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.611 -0.681 . . . . 0.0 109.997 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -69.37 -33.22 72.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.581 -0.7 . . . . 0.0 110.189 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -76.11 -36.05 59.05 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.581 -0.699 . . . . 0.0 109.711 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.42 HD12 ' OE1' ' B' ' 197' ' ' GLN . 82.5 mt -71.79 -27.19 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.737 -0.602 . . . . 0.0 109.533 179.368 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.4 -37.37 77.46 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.599 -0.688 . . . . 0.0 109.717 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -71.06 -30.38 66.51 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.594 -0.691 . . . . 0.0 109.781 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.937 HD13 HD13 ' B' ' 193' ' ' LEU . 0.4 OUTLIER -72.32 -27.08 62.2 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.639 -0.663 . . . . 0.0 110.067 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -74.16 -32.82 63.27 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.493 -0.754 . . . . 0.0 109.622 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.91 -31.69 63.22 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.733 -0.604 . . . . 0.0 109.392 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -67.82 -30.8 70.29 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.734 -0.604 . . . . 0.0 109.666 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.1 tp -74.38 -30.02 61.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.633 -0.667 . . . . 0.0 109.851 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.89 -33.41 62.05 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.625 -0.672 . . . . 0.0 109.739 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.4 -29.43 66.06 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.709 -0.619 . . . . 0.0 109.858 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.476 HD12 HG12 ' B' ' 183' ' ' ILE . 0.3 OUTLIER -71.78 -42.41 67.17 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.715 -0.616 . . . . 0.0 109.761 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -66.88 -30.52 70.71 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.567 -0.708 . . . . 0.0 109.696 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -67.17 -29.42 69.1 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.706 -0.621 . . . . 0.0 109.803 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -47.64 71.05 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.598 -0.688 . . . . 0.0 109.614 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -62.78 -28.92 70.32 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.558 -0.714 . . . . 0.0 109.67 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -65.14 -29.54 70.39 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.654 -0.654 . . . . 0.0 109.996 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -65.36 -41.46 93.8 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.612 -0.68 . . . . 0.0 109.693 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.513 HD23 HD21 ' B' ' 172' ' ' LEU . 3.5 mt -61.77 -29.22 69.99 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.609 -0.682 . . . . 0.0 109.868 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.22 -35.72 79.78 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.594 -0.691 . . . . 0.0 109.636 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.4 mt -77.46 -29.59 52.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.739 -0.601 . . . . 0.0 109.789 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.574 ' HG2' HD11 ' B' ' 172' ' ' LEU . 10.8 tt0 -90.04 -14.52 33.7 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.671 -0.643 . . . . 0.0 110.807 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.461 HD11 HD11 ' B' ' 173' ' ' ILE . 52.0 tp . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.515 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.929 HD21 HD12 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -145.75 -75.52 0.21 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.621 -0.929 . . . . 0.0 110.492 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 3.9 t -138.0 19.51 2.82 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.124 -0.985 . . . . 0.0 110.924 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 169' ' ' LYS . . . . . 0.459 ' C ' HD13 ' B' ' 173' ' ' ILE . 18.5 tptm 50.82 25.91 2.36 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.134 -0.979 . . . . 0.0 110.67 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -150.73 -45.84 0.12 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.715 -0.615 . . . . 0.0 109.661 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.629 ' HB2' HD12 ' B' ' 167' ' ' LEU . 1.4 mp0 -68.23 -30.26 69.28 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.671 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.929 HD12 HD21 ' B' ' 167' ' ' LEU . 2.0 tt -81.51 -30.46 33.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.648 -0.657 . . . . 0.0 109.483 179.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.617 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.1 mp -74.13 -30.88 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -63.97 -32.73 74.37 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.488 ' O ' HG23 ' B' ' 179' ' ' VAL . 80.6 m-20 -76.18 -31.3 58.44 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.447 ' HE2' ' C ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -69.11 -29.01 67.0 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.664 -0.647 . . . . 0.0 109.83 179.547 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -75.04 -29.65 60.84 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.568 -0.708 . . . . 0.0 110.243 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -75.25 -29.73 60.28 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.59 -0.694 . . . . 0.0 110.043 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.488 HG23 ' O ' ' B' ' 175' ' ' ASN . 60.7 t -76.19 -28.63 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.629 -0.669 . . . . 0.0 109.837 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 180' ' ' ASP . . . . . 0.404 ' HA ' HD12 ' B' ' 183' ' ' ILE . 37.5 t70 -75.77 -28.63 58.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.631 -0.668 . . . . 0.0 110.07 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -28.49 59.89 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.588 -0.695 . . . . 0.0 110.117 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.7 -30.66 61.62 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.618 -0.676 . . . . 0.0 110.138 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.476 HG12 HD12 ' A' ' 79' ' ' LEU . 75.7 mt -73.42 -30.11 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.633 -0.667 . . . . 0.0 109.749 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.9 -32.45 69.41 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.669 -0.645 . . . . 0.0 109.713 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 5.5 mtp -71.99 -46.09 58.58 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.617 -0.677 . . . . 0.0 109.693 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -66.97 -31.31 52.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 119.989 -0.685 . . . . 0.0 109.286 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -66.24 -33.99 77.0 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.756 -0.59 . . . . 0.0 110.027 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 65.8 mm-40 -66.58 -27.53 67.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.582 -0.699 . . . . 0.0 110.0 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -23.32 57.7 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.586 -0.696 . . . . 0.0 110.408 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.624 HD13 HD22 ' A' ' 72' ' ' LEU . 33.8 mm -79.79 -36.8 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.369 -0.832 . . . . 0.0 109.55 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -30.53 63.95 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.735 -0.603 . . . . 0.0 109.736 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -75.33 -38.75 60.05 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.649 -0.657 . . . . 0.0 109.783 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.937 HD13 HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -72.0 -30.23 65.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.578 -0.701 . . . . 0.0 109.348 179.351 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -67.03 -37.69 84.56 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.351 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 24.4 tptt -66.43 -30.96 71.44 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.63 -0.669 . . . . 0.0 109.361 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -62.96 -37.57 87.61 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.702 -0.624 . . . . 0.0 109.464 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 197' ' ' GLN . . . . . 0.42 ' OE1' HD12 ' A' ' 69' ' ' ILE . 9.5 tp60 -62.49 -30.65 71.42 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.78 -0.575 . . . . 0.0 109.609 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -61.3 -41.31 96.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.705 -0.622 . . . . 0.0 110.016 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -63.28 -39.93 95.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.735 -0.603 . . . . 0.0 109.891 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.3 tp -72.83 -30.76 64.28 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.639 -0.663 . . . . 0.0 109.833 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.4 ' OE2' HD11 ' A' ' 62' ' ' LEU . 7.7 mm-40 . . . . . 0 N--CA 1.493 1.722 0 O-C-N 121.586 -0.696 . . . . 0.0 109.879 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.751 HD12 HD23 ' B' ' 200' ' ' LEU . 30.1 tp . . . . . 0 N--CA 1.495 1.783 0 CA-C-O 121.157 0.504 . . . . 0.0 110.015 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.24 -29.56 64.04 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.602 -0.686 . . . . 0.0 110.049 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -75.4 -33.27 60.96 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.592 -0.693 . . . . 0.0 109.892 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.7 m -71.18 -30.49 66.49 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.649 -0.657 . . . . 0.0 109.713 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -68.2 -29.14 67.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.607 -0.683 . . . . 0.0 109.978 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -66.58 -32.55 73.96 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.541 -0.725 . . . . 0.0 110.05 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -76.7 -32.82 58.12 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.643 -0.66 . . . . 0.0 109.853 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.69 HG12 HD22 ' B' ' 193' ' ' LEU . 83.9 mt -75.66 -28.96 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.719 -0.613 . . . . 0.0 109.597 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.7 tp -74.4 -33.6 63.06 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.662 -0.649 . . . . 0.0 109.845 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.63 -35.76 70.53 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.639 -0.663 . . . . 0.0 109.808 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.895 HD23 HD13 ' B' ' 190' ' ' ILE . 2.0 tp -68.67 -27.87 66.36 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.608 -0.683 . . . . 0.0 109.849 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -67.4 -35.51 79.45 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.544 -0.722 . . . . 0.0 109.493 179.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.19 -31.44 60.95 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -71.06 -30.79 67.04 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.753 -0.592 . . . . 0.0 109.712 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' B' ' 187' ' ' GLU . 13.1 tp -72.08 -31.31 65.96 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.592 -0.693 . . . . 0.0 109.689 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.09 -32.8 56.9 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.655 -0.653 . . . . 0.0 109.677 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.41 -31.24 63.74 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 120.121 -0.631 . . . . 0.0 109.376 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.709 HD23 ' HA ' ' B' ' 183' ' ' ILE . 3.3 tp -65.06 -33.85 77.03 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.663 -0.648 . . . . 0.0 109.425 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.27 -31.32 65.66 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.697 -0.627 . . . . 0.0 109.49 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -67.98 -30.09 69.28 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.691 -0.63 . . . . 0.0 109.735 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -66.27 -44.96 82.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.646 -0.659 . . . . 0.0 109.914 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -66.91 -30.15 70.23 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.597 -0.69 . . . . 0.0 109.863 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.1 t-80 -70.32 -29.27 65.94 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.713 -0.617 . . . . 0.0 109.894 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -67.4 -32.21 72.95 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.629 -0.67 . . . . 0.0 109.866 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.71 -30.55 69.22 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.593 -0.692 . . . . 0.0 109.969 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -68.54 -27.89 66.5 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.597 -0.689 . . . . 0.0 110.187 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.5 -28.66 64.07 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.524 -0.735 . . . . 0.0 110.025 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -117.82 25.6 10.26 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.627 -0.67 . . . . 0.0 110.532 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.1 HD23 ' HE3' ' B' ' 176' ' ' MET . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.061 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.928 HD21 HD13 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -139.78 -82.75 0.26 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.554 -0.968 . . . . 0.0 110.536 -179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 88.6 p -130.49 20.81 5.17 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.246 -0.909 . . . . 0.0 110.94 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.1 tptt 50.92 25.62 2.29 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.234 -0.916 . . . . 0.0 110.729 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -150.64 -46.09 0.12 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.724 -0.61 . . . . 0.0 109.643 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.626 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.4 OUTLIER -66.38 -29.88 70.14 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.982 -0.687 . . . . 0.0 109.447 179.418 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.928 HD13 HD21 ' B' ' 167' ' ' LEU . 14.8 tp -81.49 -33.2 32.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.704 -0.622 . . . . 0.0 109.386 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.62 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.1 mp -74.76 -31.37 26.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -64.06 -32.14 73.59 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.82 ' O ' HG23 ' B' ' 179' ' ' VAL . 78.4 m-20 -75.38 -32.72 60.89 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 176' ' ' MET . . . . . 1.1 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -66.45 -33.13 75.02 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.172 -0.611 . . . . 0.0 109.555 179.47 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -76.33 -31.59 58.21 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.639 -0.663 . . . . 0.0 109.751 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -74.31 -29.58 61.68 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.701 -0.624 . . . . 0.0 109.864 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.82 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.8 t -73.43 -29.57 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.658 -0.651 . . . . 0.0 109.763 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -75.37 -32.83 60.96 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.568 -0.707 . . . . 0.0 110.04 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -73.02 -29.43 63.0 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.71 -0.619 . . . . 0.0 109.864 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -73.42 -39.66 64.86 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.616 -0.677 . . . . 0.0 109.925 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.709 ' HA ' HD23 ' A' ' 79' ' ' LEU . 96.3 mt -66.81 -28.49 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.67 -0.644 . . . . 0.0 109.723 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 79.0 m -67.95 -37.07 81.14 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.609 -0.682 . . . . 0.0 109.672 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 19.9 tpp -70.73 -44.4 66.91 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.64 -0.662 . . . . 0.0 109.485 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 68.3 t -66.85 -35.79 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 187' ' ' GLU . . . . . 0.417 ' HA ' HD13 ' A' ' 76' ' ' LEU . 12.2 tt0 -63.7 -34.23 77.4 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.726 -0.609 . . . . 0.0 109.815 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.88 -24.88 62.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.681 -0.637 . . . . 0.0 110.033 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -24.83 57.33 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.547 -0.72 . . . . 0.0 110.458 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.895 HD13 HD23 ' A' ' 72' ' ' LEU . 32.8 mm -79.16 -34.86 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.354 -0.842 . . . . 0.0 109.601 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.1 m -75.55 -30.8 59.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.729 -0.607 . . . . 0.0 109.684 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 39.0 mmtt -74.68 -32.59 62.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.689 -0.632 . . . . 0.0 109.678 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.69 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -71.61 -35.83 70.6 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.566 -0.709 . . . . 0.0 109.424 179.459 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.2 -40.8 94.68 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.64 -0.663 . . . . 0.0 109.407 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -70.83 -32.05 68.96 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.687 -0.633 . . . . 0.0 109.378 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.451 ' HE2' HD23 ' B' ' 193' ' ' LEU . 16.8 ttpt -67.64 -31.88 72.19 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -65.46 -30.67 71.48 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.726 -0.608 . . . . 0.0 109.676 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -62.2 -43.47 98.76 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.713 -0.617 . . . . 0.0 109.829 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -61.54 -40.73 95.74 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.777 -0.577 . . . . 0.0 109.842 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.751 HD23 HD12 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -73.93 -32.53 63.55 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.533 -0.729 . . . . 0.0 109.558 179.502 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.499 ' HG2' HD21 ' A' ' 62' ' ' LEU . 4.8 mt-10 . . . . . 0 N--CA 1.492 1.671 0 O-C-N 121.791 -0.568 . . . . 0.0 109.747 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' B' ' 201' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 121.085 0.469 . . . . 0.0 110.021 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -75.22 -37.46 61.09 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.61 -0.681 . . . . 0.0 109.91 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -74.01 -30.55 62.51 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.733 -0.604 . . . . 0.0 109.672 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.506 HG21 ' NZ ' ' B' ' 196' ' ' LYS . 79.0 m -72.71 -29.94 63.79 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.677 -0.639 . . . . 0.0 109.71 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -68.94 -27.74 66.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.647 -0.658 . . . . 0.0 110.051 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -68.24 -33.21 73.96 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.45 -0.781 . . . . 0.0 110.14 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -75.65 -33.86 60.47 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.678 -0.639 . . . . 0.0 109.722 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.7 mt -71.82 -28.25 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.768 -0.583 . . . . 0.0 109.617 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.23 -38.27 78.43 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.558 -0.714 . . . . 0.0 109.796 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.3 tptp -68.74 -29.89 68.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.584 -0.697 . . . . 0.0 109.766 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.805 HD22 HG12 ' B' ' 190' ' ' ILE . 8.4 mt -68.58 -32.17 71.88 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.69 -0.631 . . . . 0.0 110.023 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -68.29 -33.46 74.39 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.64 -0.663 . . . . 0.0 109.829 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -75.34 -30.07 60.14 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.655 -0.653 . . . . 0.0 109.814 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -74.61 -30.12 61.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.698 -0.626 . . . . 0.0 109.905 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.407 HD13 HD12 ' B' ' 190' ' ' ILE . 28.8 tp -74.94 -34.01 62.04 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.661 -0.649 . . . . 0.0 109.901 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 22.0 mt -74.97 -32.31 61.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.674 -0.641 . . . . 0.0 109.743 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.68 -29.75 62.48 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.71 -0.618 . . . . 0.0 109.767 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.45 -41.13 56.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.712 -0.617 . . . . 0.0 109.614 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -71.05 -29.19 65.02 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.65 -0.656 . . . . 0.0 109.743 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -71.11 -29.65 65.53 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.593 -0.692 . . . . 0.0 109.716 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -68.03 -42.23 80.94 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.678 -0.639 . . . . 0.0 109.867 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -66.91 -28.96 68.73 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.546 -0.721 . . . . 0.0 109.864 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -68.76 -30.94 69.65 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.644 -0.66 . . . . 0.0 109.95 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -65.04 -38.07 89.65 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.606 -0.684 . . . . 0.0 109.784 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.426 ' C ' ' HE2' ' B' ' 176' ' ' MET . 2.0 mt -61.25 -33.84 74.18 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.707 -0.621 . . . . 0.0 109.98 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -63.35 -46.06 88.33 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.511 -0.743 . . . . 0.0 109.905 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 42.4 mt -69.31 -28.63 66.43 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.734 -0.604 . . . . 0.0 109.862 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -100.52 7.95 43.79 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.673 -0.642 . . . . 0.0 110.997 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.786 HD12 HD22 ' B' ' 172' ' ' LEU . 53.0 tp . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.304 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.938 HD21 HD12 ' B' ' 172' ' ' LEU . 0.1 OUTLIER -141.86 -84.08 0.19 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.51 -0.994 . . . . 0.0 110.454 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 66.7 m -127.84 19.35 6.62 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.064 -1.022 . . . . 0.0 110.819 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 16.7 tptt 50.71 25.92 2.29 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.237 -0.915 . . . . 0.0 110.652 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -148.96 -46.74 0.14 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.643 -0.661 . . . . 0.0 109.453 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.586 ' HB2' HD12 ' B' ' 167' ' ' LEU . 1.1 mt-10 -66.3 -34.75 78.7 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.248 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.938 HD12 HD21 ' B' ' 167' ' ' LEU . 5.5 tt -77.63 -29.35 51.75 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.492 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.5 mm -68.56 -31.07 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.702 -0.624 . . . . 0.0 109.358 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -76.29 -30.31 57.73 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.672 -0.643 . . . . 0.0 109.835 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.784 ' O ' HG23 ' B' ' 179' ' ' VAL . 76.2 m-20 -75.05 -30.1 60.92 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.718 -0.614 . . . . 0.0 109.847 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.452 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -72.05 -31.19 65.91 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.636 -0.665 . . . . 0.0 109.848 179.766 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.72 -29.97 56.44 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.956 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -76.81 -30.1 56.26 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.608 -0.683 . . . . 0.0 109.829 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.784 HG23 ' O ' ' B' ' 175' ' ' ASN . 71.1 t -74.48 -29.69 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.616 -0.677 . . . . 0.0 109.687 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -71.63 -28.8 64.02 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.583 -0.698 . . . . 0.0 109.99 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 22.1 mtp180 -74.88 -29.49 61.03 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.591 -0.693 . . . . 0.0 110.031 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 182' ' ' GLU . . . . . 0.501 ' O ' HG23 ' B' ' 186' ' ' VAL . 3.0 tp10 -74.64 -34.44 62.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.725 -0.609 . . . . 0.0 110.039 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 78.3 mt -71.18 -28.77 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.715 -0.616 . . . . 0.0 109.768 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.6 m -72.17 -33.59 67.82 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.59 -0.694 . . . . 0.0 109.803 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 11.2 ttt -75.46 -36.86 60.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.62 -0.675 . . . . 0.0 109.733 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 186' ' ' VAL . . . . . 0.501 HG23 ' O ' ' B' ' 182' ' ' GLU . 58.5 t -74.88 -30.58 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.7 -0.625 . . . . 0.0 109.528 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -75.48 -28.77 59.34 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.716 -0.615 . . . . 0.0 109.915 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -74.44 -28.98 61.29 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.648 -0.657 . . . . 0.0 109.992 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.27 -36.71 63.84 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.637 -0.665 . . . . 0.0 109.952 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.805 HG12 HD22 ' A' ' 72' ' ' LEU . 82.0 mt -72.1 -31.55 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.621 -0.674 . . . . 0.0 109.607 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 3.7 m -71.36 -35.85 71.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.698 -0.626 . . . . 0.0 109.571 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 14.7 mmtt -75.52 -32.47 60.49 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.517 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.691 HD13 HD11 ' A' ' 72' ' ' LEU . 0.3 OUTLIER -77.0 -17.65 58.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.695 -0.628 . . . . 0.0 110.426 179.49 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 7.3 tptt -85.53 -27.0 25.87 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.349 -0.844 . . . . 0.0 109.545 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -76.45 -32.84 58.66 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.624 -0.673 . . . . 0.0 110.006 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.506 ' NZ ' HG21 ' A' ' 65' ' ' THR . 0.0 OUTLIER -70.56 -25.07 62.92 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.495 -0.753 . . . . 0.0 109.896 179.533 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -70.39 -30.07 66.88 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.509 -0.744 . . . . 0.0 109.591 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.61 -46.69 87.1 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.596 -0.69 . . . . 0.0 109.513 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -61.74 -36.94 82.44 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.738 -0.601 . . . . 0.0 109.899 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 19.6 tp -75.47 -35.32 60.89 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.603 -0.686 . . . . 0.0 109.658 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.585 ' HA ' HD11 ' A' ' 62' ' ' LEU . 13.5 mt-10 . . . . . 0 N--CA 1.493 1.716 0 O-C-N 121.66 -0.65 . . . . 0.0 109.641 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.717 ' HG ' HD23 ' B' ' 200' ' ' LEU . 2.0 mp . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 121.094 0.473 . . . . 0.0 109.97 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -67.23 -30.63 70.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.543 -0.723 . . . . 0.0 110.007 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -75.03 -39.23 61.18 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.608 -0.682 . . . . 0.0 109.87 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 47.3 m -72.21 -30.75 65.23 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.655 -0.653 . . . . 0.0 109.638 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -71.72 -27.47 63.02 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.647 -0.658 . . . . 0.0 109.967 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -69.64 -34.84 74.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.626 -0.671 . . . . 0.0 110.175 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 -75.67 -35.27 60.42 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.612 -0.68 . . . . 0.0 109.652 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.3 mt -72.34 -27.52 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.781 -0.574 . . . . 0.0 109.554 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.405 HD23 ' C ' ' A' ' 70' ' ' LEU . 9.6 tt -71.13 -38.88 72.27 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.635 -0.666 . . . . 0.0 109.915 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -35.02 79.51 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.596 -0.69 . . . . 0.0 109.676 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.614 ' CD1' HD13 ' B' ' 193' ' ' LEU . 5.5 mt -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.719 -0.613 . . . . 0.0 109.825 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.9 -36.13 83.38 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.607 -0.683 . . . . 0.0 109.977 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -76.1 -30.98 58.48 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.634 -0.666 . . . . 0.0 109.724 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tttm -77.19 -31.71 55.55 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.715 -0.616 . . . . 0.0 109.774 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 36.4 tp -77.74 -30.65 51.73 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.624 -0.672 . . . . 0.0 109.681 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.79 -30.94 56.66 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.678 -0.639 . . . . 0.0 109.639 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.32 -29.99 61.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.593 -0.692 . . . . 0.0 109.956 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.405 HD12 HG12 ' B' ' 183' ' ' ILE . 0.4 OUTLIER -76.34 -38.2 56.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.639 -0.663 . . . . 0.0 109.631 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -71.69 -29.07 64.17 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.589 -0.694 . . . . 0.0 109.748 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -71.4 -29.47 64.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.581 -0.7 . . . . 0.0 109.866 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -70.8 -43.57 68.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.619 -0.676 . . . . 0.0 109.852 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -62.96 -29.31 70.71 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.587 -0.696 . . . . 0.0 109.748 179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -63.44 -31.14 72.21 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.622 -0.674 . . . . 0.0 109.848 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -62.8 -32.82 74.08 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.672 -0.643 . . . . 0.0 109.852 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.487 HD13 ' HG2' ' B' ' 176' ' ' MET . 0.4 OUTLIER -68.39 -35.93 78.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.647 -0.658 . . . . 0.0 109.81 179.692 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -64.18 -29.24 70.36 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.682 -0.636 . . . . 0.0 110.052 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 tp -65.85 -30.12 70.68 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.58 -0.7 . . . . 0.0 110.004 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.58 27.38 9.23 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.601 -0.687 . . . . 0.0 110.289 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.772 HD11 ' CD1' ' B' ' 173' ' ' ILE . 51.2 tp . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 118.045 -0.978 . . . . 0.0 110.168 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.882 HD21 HD13 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -140.84 -84.07 0.21 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.578 -0.954 . . . . 0.0 110.561 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -128.64 19.66 6.16 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.143 -0.973 . . . . 0.0 110.9 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 7.6 tptm 50.76 26.09 2.4 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.21 -0.931 . . . . 0.0 110.604 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -149.33 -45.87 0.14 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.627 -0.67 . . . . 0.0 109.694 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.599 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.1 OUTLIER -66.45 -35.85 81.33 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.804 -0.759 . . . . 0.0 109.292 179.498 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.882 HD13 HD21 ' B' ' 167' ' ' LEU . 10.2 tp -76.9 -28.79 55.45 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 178.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.772 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.7 mm -66.59 -31.38 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.616 -0.677 . . . . 0.0 109.196 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -74.98 -31.08 61.35 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.124 -0.63 . . . . 0.0 109.775 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.596 ' O ' HG23 ' B' ' 179' ' ' VAL . 83.7 m-20 -75.03 -34.72 61.91 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.681 -0.637 . . . . 0.0 109.77 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.574 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -70.01 -30.67 68.03 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.743 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -67.15 -35.26 79.33 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.666 -0.647 . . . . 0.0 109.727 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.51 -30.73 59.92 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.72 -0.612 . . . . 0.0 109.686 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.596 HG23 ' O ' ' B' ' 175' ' ' ASN . 69.3 t -76.67 -30.96 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.702 -0.624 . . . . 0.0 109.569 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -75.24 -29.72 60.31 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.728 -0.608 . . . . 0.0 109.907 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -73.47 -30.16 62.99 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.691 -0.631 . . . . 0.0 109.851 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -72.53 -36.91 68.41 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.652 -0.655 . . . . 0.0 109.965 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.405 HG12 HD12 ' A' ' 79' ' ' LEU . 82.0 mt -70.02 -30.52 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.705 -0.622 . . . . 0.0 109.652 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.8 m -68.58 -35.04 76.82 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.673 -0.642 . . . . 0.0 109.652 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -46.63 74.79 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.582 -0.699 . . . . 0.0 109.659 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 60.5 t -70.57 -33.03 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.634 -0.666 . . . . 0.0 109.307 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -72.86 -29.95 63.6 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.775 -0.578 . . . . 0.0 109.675 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 37.5 mm-40 -68.89 -30.27 68.73 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.636 -0.665 . . . . 0.0 109.781 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.55 -36.83 63.11 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.594 -0.691 . . . . 0.0 109.841 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.609 ' CG1' HD22 ' A' ' 72' ' ' LEU . 79.4 mt -69.54 -30.58 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.627 -0.671 . . . . 0.0 109.523 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 20.4 m -66.67 -40.29 88.53 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.701 -0.624 . . . . 0.0 109.612 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -72.32 -31.53 65.75 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 120.087 -0.645 . . . . 0.0 109.495 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.614 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.4 OUTLIER -72.39 -35.41 68.41 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.756 -0.59 . . . . 0.0 109.418 179.364 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -68.5 -43.09 77.6 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.693 -0.63 . . . . 0.0 109.497 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -67.3 -32.0 72.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.667 -0.646 . . . . 0.0 109.327 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -34.89 79.25 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -63.01 -30.37 71.55 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.795 -0.566 . . . . 0.0 109.637 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.42 -46.24 90.93 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.705 -0.622 . . . . 0.0 109.743 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.09 -46.2 90.11 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.714 -0.617 . . . . 0.0 109.843 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.717 HD23 ' HG ' ' A' ' 62' ' ' LEU . 4.9 tp -69.48 -34.34 74.19 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.623 -0.673 . . . . 0.0 109.822 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.649 -0.657 . . . . 0.0 109.811 179.507 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.665 HD11 ' HG2' ' B' ' 201' ' ' GLU . 6.1 tp . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 121.115 0.483 . . . . 0.0 110.131 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -76.29 -31.71 58.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.579 -0.701 . . . . 0.0 110.082 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -76.78 -30.8 56.63 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.596 -0.69 . . . . 0.0 109.798 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.459 HG22 HD11 ' A' ' 69' ' ' ILE . 5.9 m -75.16 -30.04 60.62 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.686 -0.634 . . . . 0.0 109.755 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.1 mmtt -72.33 -27.21 62.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.624 -0.672 . . . . 0.0 110.137 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -72.86 -35.32 67.18 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.562 -0.711 . . . . 0.0 110.206 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.1 tp60 -76.07 -35.09 59.56 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.502 -0.748 . . . . 0.0 109.706 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.806 HG12 HD23 ' B' ' 193' ' ' LEU . 67.6 mt -75.39 -28.62 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.771 -0.58 . . . . 0.0 109.503 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.469 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.3 tt -75.19 -36.93 61.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.625 -0.672 . . . . 0.0 109.601 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -66.31 -29.45 69.65 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.469 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.629 HD22 HG12 ' B' ' 190' ' ' ILE . 6.6 mt -62.04 -33.03 73.62 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.695 -0.628 . . . . 0.0 109.899 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -61.6 -36.04 79.56 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.523 -0.736 . . . . 0.0 109.888 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -77.31 -31.46 54.66 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.71 -0.618 . . . . 0.0 109.353 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.596 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -74.3 -30.67 62.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.705 -0.622 . . . . 0.0 109.621 179.517 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -74.01 -34.89 64.32 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.667 -0.646 . . . . 0.0 109.647 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tp -71.83 -36.71 70.3 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.693 -0.629 . . . . 0.0 109.61 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.69 -30.38 71.06 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.745 -0.597 . . . . 0.0 109.481 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' B' ' 183' ' ' ILE . 2.8 mp -61.6 -41.88 98.08 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.707 -0.621 . . . . 0.0 109.828 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -67.58 -30.26 69.84 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.614 -0.679 . . . . 0.0 109.753 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -30.18 69.42 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.688 -0.632 . . . . 0.0 109.765 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.33 -49.29 57.09 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.657 -0.652 . . . . 0.0 109.782 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.9 ttpt -66.96 -31.27 71.73 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.578 -0.701 . . . . 0.0 109.494 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -70.12 -30.24 67.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.753 -0.592 . . . . 0.0 109.775 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -67.43 -29.72 69.28 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.571 -0.706 . . . . 0.0 109.886 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.59 HD23 HD21 ' B' ' 172' ' ' LEU . 0.7 OUTLIER -66.47 -39.55 88.85 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.579 -0.701 . . . . 0.0 109.922 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -61.14 -29.26 69.67 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.546 -0.721 . . . . 0.0 110.14 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.9 tp -70.32 -27.65 64.54 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.628 -0.67 . . . . 0.0 110.199 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -119.84 26.99 8.96 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.528 -0.733 . . . . 0.0 110.412 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.71 HD13 ' CE ' ' B' ' 176' ' ' MET . 29.2 tp . . . . . 0 N--CA 1.496 1.861 0 CA-C-O 117.933 -1.032 . . . . 0.0 109.989 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.779 HD21 HD12 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -142.43 -77.59 0.25 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.553 -0.969 . . . . 0.0 110.536 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 18.1 t -136.48 18.62 3.12 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.105 -0.997 . . . . 0.0 110.876 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 40.6 tptt 50.67 25.95 2.28 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.238 -0.914 . . . . 0.0 110.562 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -148.23 -46.66 0.16 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.692 -0.63 . . . . 0.0 109.386 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.598 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.4 OUTLIER -68.18 -32.56 72.88 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.21 179.331 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.779 HD12 HD21 ' B' ' 167' ' ' LEU . 3.9 tt -78.96 -29.28 43.88 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.531 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.8 mm -68.61 -30.55 47.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.721 -0.612 . . . . 0.0 109.4 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -72.67 -30.55 64.36 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.6 -0.688 . . . . 0.0 109.803 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.793 ' O ' HG23 ' B' ' 179' ' ' VAL . 96.9 m-20 -74.67 -31.7 62.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.619 -0.676 . . . . 0.0 109.701 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.71 ' CE ' HD13 ' A' ' 90' ' ' LEU . 1.6 mtt -70.16 -30.83 68.08 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.763 -0.586 . . . . 0.0 109.869 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -76.95 -30.94 56.25 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.635 -0.666 . . . . 0.0 109.886 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -29.84 57.37 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.661 -0.649 . . . . 0.0 109.735 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.793 HG23 ' O ' ' B' ' 175' ' ' ASN . 73.9 t -74.39 -28.45 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.6 -0.688 . . . . 0.0 109.81 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -74.65 -36.72 62.86 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.613 -0.68 . . . . 0.0 110.047 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 15.3 mtt85 -70.09 -26.32 63.93 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.639 -0.663 . . . . 0.0 109.977 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -72.87 -36.1 67.31 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.515 -0.741 . . . . 0.0 110.142 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.752 ' HA ' HD23 ' A' ' 79' ' ' LEU . 87.3 mt -67.89 -27.94 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.57 -0.707 . . . . 0.0 109.874 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 7.8 m -67.97 -34.61 76.89 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.559 -0.713 . . . . 0.0 109.787 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 mtm -73.78 -37.71 64.9 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.6 -0.688 . . . . 0.0 109.742 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 186' ' ' VAL . . . . . 0.678 HG21 HD21 ' A' ' 79' ' ' LEU . 57.7 t -73.29 -30.42 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.642 -0.661 . . . . 0.0 109.616 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.56 -29.22 61.27 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.6 -0.688 . . . . 0.0 109.991 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -73.52 -30.85 63.37 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.651 -0.655 . . . . 0.0 109.939 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -32.57 69.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.625 -0.672 . . . . 0.0 109.942 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.629 HG12 HD22 ' A' ' 72' ' ' LEU . 78.1 mt -75.3 -30.71 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.546 -0.721 . . . . 0.0 109.739 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 27.6 m -75.53 -35.86 60.62 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.632 -0.667 . . . . 0.0 109.654 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 28.5 mtmt -73.48 -34.19 65.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.662 -0.649 . . . . 0.0 109.538 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.806 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -69.28 -35.6 76.21 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -64.15 -47.32 80.37 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -67.43 -31.93 72.45 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -64.83 -34.18 77.77 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -63.41 -30.85 71.91 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 120.223 -0.591 . . . . 0.0 109.48 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -60.98 -45.89 92.96 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.655 -0.653 . . . . 0.0 109.885 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -61.82 -39.51 92.04 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.745 -0.597 . . . . 0.0 109.739 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 13.7 tp -74.89 -30.52 61.33 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.65 -0.656 . . . . 0.0 109.582 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.665 ' HG2' HD11 ' A' ' 62' ' ' LEU . 24.5 mt-10 . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.644 -0.66 . . . . 0.0 109.761 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.499 HD11 ' CG ' ' B' ' 201' ' ' GLU . 10.3 tt . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 121.112 0.482 . . . . 0.0 110.082 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -64.58 -31.41 72.61 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.626 -0.671 . . . . 0.0 110.067 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -72.25 -33.15 67.29 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.595 -0.69 . . . . 0.0 109.924 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.8 m -70.56 -38.51 74.15 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.689 -0.632 . . . . 0.0 109.76 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -63.99 -27.04 68.86 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.625 -0.672 . . . . 0.0 109.943 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -66.82 -39.58 87.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.532 -0.73 . . . . 0.0 110.204 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.0 tp60 -76.07 -31.48 58.8 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.608 -0.682 . . . . 0.0 109.624 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.816 HG12 HD23 ' B' ' 193' ' ' LEU . 90.8 mt -77.42 -28.12 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.743 -0.598 . . . . 0.0 109.533 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 24.5 tp -75.14 -38.12 61.14 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.585 -0.697 . . . . 0.0 109.536 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -65.54 -30.95 71.76 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.623 -0.673 . . . . 0.0 109.565 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.613 HD22 HG12 ' B' ' 190' ' ' ILE . 6.7 mt -62.64 -35.72 80.54 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.655 -0.653 . . . . 0.0 110.06 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.403 ' O ' HD13 ' A' ' 77' ' ' LEU . 3.1 tt0 -61.99 -35.69 79.24 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.598 -0.689 . . . . 0.0 110.033 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -76.16 -30.66 58.18 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.612 -0.68 . . . . 0.0 109.731 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.6 tttt -75.81 -28.95 58.51 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.658 -0.651 . . . . 0.0 109.888 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.7 tp -76.83 -32.37 57.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.676 -0.64 . . . . 0.0 109.984 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 73' ' ' GLU . 0.9 OUTLIER -76.64 -31.56 57.45 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.652 -0.655 . . . . 0.0 109.792 179.7 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.24 -27.71 59.6 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.699 -0.626 . . . . 0.0 110.068 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.761 HD23 ' HA ' ' B' ' 183' ' ' ILE . 7.1 tp -76.55 -31.66 57.72 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.543 -0.723 . . . . 0.0 110.086 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -75.07 -30.48 60.99 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.642 -0.661 . . . . 0.0 109.784 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -71.91 -28.13 63.29 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.689 -0.632 . . . . 0.0 109.81 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -68.76 -37.5 79.4 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.565 -0.709 . . . . 0.0 110.012 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -70.32 -29.65 66.42 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.474 -0.766 . . . . 0.0 109.923 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -69.67 -29.83 67.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.591 -0.693 . . . . 0.0 109.75 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.0 tm0? -64.85 -34.19 77.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.647 -0.658 . . . . 0.0 109.959 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.44 HD23 HD21 ' B' ' 172' ' ' LEU . 0.5 OUTLIER -64.24 -38.62 91.7 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.586 -0.696 . . . . 0.0 109.858 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.405 ' N ' ' HE2' ' B' ' 176' ' ' MET . 9.6 m-85 -60.76 -28.59 68.84 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.628 -0.67 . . . . 0.0 110.141 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 66.7 mt -72.85 -28.72 62.7 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.572 -0.705 . . . . 0.0 110.138 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -116.99 25.82 10.23 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.628 -0.67 . . . . 0.0 110.433 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.106 HD23 ' HE3' ' B' ' 176' ' ' MET . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.805 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.903 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.741 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.0 OUTLIER -149.66 -80.03 0.13 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.476 -1.014 . . . . 0.0 110.524 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 3.1 t -134.18 19.2 3.72 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.234 -0.916 . . . . 0.0 110.919 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 25.4 tptt 50.63 25.92 2.24 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.175 -0.953 . . . . 0.0 110.598 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -148.2 -46.66 0.16 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.722 -0.611 . . . . 0.0 109.354 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.626 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.8 mm-40 -67.77 -32.16 72.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.593 -0.692 . . . . 0.0 109.32 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.782 HD22 HD22 ' A' ' 90' ' ' LEU . 1.3 tt -78.95 -28.17 43.66 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.762 ' CD1' HD11 ' A' ' 90' ' ' LEU . 49.6 mm -70.6 -31.41 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.652 -0.655 . . . . 0.0 109.418 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 52.9 tp60 -71.07 -28.22 64.2 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.666 -0.646 . . . . 0.0 109.939 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.722 ' O ' HG23 ' B' ' 179' ' ' VAL . 70.7 m-20 -70.34 -28.62 65.28 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.622 -0.674 . . . . 0.0 110.151 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 176' ' ' MET . . . . . 1.106 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -75.27 -31.84 60.87 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.49 -0.757 . . . . 0.0 110.049 179.845 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -73.18 -30.02 63.25 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.614 -0.679 . . . . 0.0 109.967 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -77.69 -30.52 51.94 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.645 -0.659 . . . . 0.0 109.865 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.722 HG23 ' O ' ' B' ' 175' ' ' ASN . 65.7 t -76.8 -30.31 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.698 -0.626 . . . . 0.0 109.738 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -76.98 -29.64 55.61 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.7 -0.625 . . . . 0.0 109.989 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.5 -28.32 59.13 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.655 -0.653 . . . . 0.0 109.971 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -74.96 -33.85 61.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.613 -0.68 . . . . 0.0 110.052 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.761 ' HA ' HD23 ' A' ' 79' ' ' LEU . 89.1 mt -71.47 -28.23 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.589 -0.694 . . . . 0.0 109.817 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.7 m -71.51 -34.73 70.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.57 -0.706 . . . . 0.0 109.918 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -39.21 62.87 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.597 -0.689 . . . . 0.0 109.775 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 60.2 t -74.34 -29.89 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.569 -0.707 . . . . 0.0 109.564 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -76.34 -28.48 56.89 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.623 -0.673 . . . . 0.0 109.958 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -75.13 -28.06 60.04 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.539 -0.725 . . . . 0.0 110.11 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.89 -29.22 61.95 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.585 -0.697 . . . . 0.0 110.022 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.613 HG12 HD22 ' A' ' 72' ' ' LEU . 81.0 mt -76.04 -34.28 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.632 -0.667 . . . . 0.0 109.71 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 86.9 p -70.57 -30.95 67.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.74 -0.6 . . . . 0.0 109.501 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 25.2 mmtt -77.36 -33.86 55.2 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.638 -0.664 . . . . 0.0 109.591 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.816 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -72.5 -31.52 65.42 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.594 -0.691 . . . . 0.0 109.27 179.283 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -66.96 -41.27 87.18 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.614 -0.679 . . . . 0.0 109.476 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -71.32 -31.77 67.81 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.676 -0.64 . . . . 0.0 109.284 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 9.7 ttpt -67.88 -32.39 72.85 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -64.77 -30.07 71.06 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.706 -0.621 . . . . 0.0 109.485 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.77 -46.07 91.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.652 -0.655 . . . . 0.0 109.81 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -61.92 -37.72 85.71 Favored 'General case' 0 N--CA 1.496 1.842 0 C-N-CA 120.228 -0.589 . . . . 0.0 109.807 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.6 tp -73.59 -33.61 64.69 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.583 -0.698 . . . . 0.0 109.673 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.499 ' CG ' HD11 ' A' ' 62' ' ' LEU . 8.4 mt-10 . . . . . 0 N--CA 1.493 1.695 0 O-C-N 121.684 -0.635 . . . . 0.0 109.707 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.654 ' HG ' HD23 ' B' ' 200' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 121.044 0.45 . . . . 0.0 110.059 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -72.23 -34.29 68.2 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.035 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -75.06 -31.33 61.24 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.635 -0.665 . . . . 0.0 109.779 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 56.7 m -72.52 -29.79 63.91 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.717 -0.614 . . . . 0.0 109.76 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -69.15 -26.98 65.14 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.619 -0.676 . . . . 0.0 110.149 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -70.36 -31.89 69.35 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.586 -0.697 . . . . 0.0 110.328 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.1 tp60 -77.51 -34.25 54.12 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.492 -0.755 . . . . 0.0 109.847 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.762 HG12 HD22 ' B' ' 193' ' ' LEU . 81.1 mt -74.08 -26.98 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.721 -0.612 . . . . 0.0 109.56 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.9 mt -72.38 -37.27 68.8 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.5 -0.75 . . . . 0.0 109.882 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -65.26 -30.63 71.53 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.585 -0.697 . . . . 0.0 109.846 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.699 HD12 HG12 ' B' ' 190' ' ' ILE . 1.6 mm? -68.72 -29.27 67.65 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.65 -0.656 . . . . 0.0 110.049 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.514 ' O ' HD13 ' A' ' 77' ' ' LEU . 22.8 mt-10 -69.44 -33.74 73.39 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.546 -0.721 . . . . 0.0 110.033 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -30.0 58.56 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.646 -0.659 . . . . 0.0 109.87 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -76.19 -29.42 57.66 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.686 -0.634 . . . . 0.0 109.986 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.687 HD13 HD12 ' B' ' 190' ' ' ILE . 13.5 tp -76.76 -32.12 57.51 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.585 -0.697 . . . . 0.0 109.863 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 73' ' ' GLU . 5.6 mp -76.55 -32.56 58.27 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.747 -0.595 . . . . 0.0 109.782 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.1 -28.73 61.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.698 -0.626 . . . . 0.0 109.811 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.529 HD12 HG12 ' B' ' 183' ' ' ILE . 0.8 OUTLIER -74.0 -36.69 64.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.619 -0.676 . . . . 0.0 109.89 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -69.25 -28.37 66.27 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.593 -0.692 . . . . 0.0 110.014 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -70.94 -27.92 64.11 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.564 -0.71 . . . . 0.0 110.052 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -44.18 64.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.532 -0.73 . . . . 0.0 109.804 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.6 ttpp -62.78 -27.66 69.45 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.513 -0.742 . . . . 0.0 109.673 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -63.95 -32.95 74.66 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.565 -0.71 . . . . 0.0 110.023 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -64.49 -34.88 79.24 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.534 -0.729 . . . . 0.0 109.792 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' B' ' 176' ' ' MET . 0.6 OUTLIER -64.22 -35.22 80.1 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.599 -0.688 . . . . 0.0 109.896 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -60.75 -35.45 76.42 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.585 -0.697 . . . . 0.0 110.029 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mt -62.81 -30.31 71.38 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.637 -0.664 . . . . 0.0 109.674 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -96.77 -26.79 15.01 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.693 -0.63 . . . . 0.0 110.095 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.759 HD11 ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.005 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.494 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 166' ' ' GLY . . . . . 0.716 ' HA2' HD22 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.75 HD12 ' N ' ' B' ' 168' ' ' SER . 0.5 OUTLIER -119.5 -28.62 5.29 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.589 -0.947 . . . . 0.0 110.615 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.75 ' N ' HD12 ' B' ' 167' ' ' LEU . 8.3 t -165.84 18.12 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.349 -0.845 . . . . 0.0 111.62 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 48.66 26.58 1.26 Allowed 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.095 -1.003 . . . . 0.0 111.291 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -154.44 -46.56 0.09 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.723 -0.611 . . . . 0.0 110.109 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.465 ' HB2' HD13 ' B' ' 167' ' ' LEU . 5.2 mt-10 -74.12 -35.38 64.12 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.921 -0.712 . . . . 0.0 109.291 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.735 ' N ' HD11 ' B' ' 167' ' ' LEU . 19.3 tp -76.01 -26.48 56.71 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.759 ' CD1' HD11 ' A' ' 90' ' ' LEU . 49.1 mm -69.22 -32.85 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -70.44 -30.18 66.96 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.716 -0.615 . . . . 0.0 109.869 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.416 ' O ' HG23 ' B' ' 179' ' ' VAL . 89.8 m-20 -67.22 -32.24 73.16 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.612 -0.68 . . . . 0.0 109.858 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.562 ' HE1' ' HG ' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -71.14 -31.51 67.81 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.713 -0.617 . . . . 0.0 109.746 179.611 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.79 -30.27 63.96 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.707 -0.621 . . . . 0.0 109.856 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -39.94 61.96 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.619 -0.676 . . . . 0.0 109.926 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.416 HG23 ' O ' ' B' ' 175' ' ' ASN . 61.2 t -72.09 -30.97 38.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.675 -0.641 . . . . 0.0 109.458 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.73 -30.09 65.25 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.664 -0.648 . . . . 0.0 109.748 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -67.33 -32.75 73.92 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.645 -0.659 . . . . 0.0 109.768 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 182' ' ' GLU . . . . . 0.525 ' O ' HG23 ' B' ' 186' ' ' VAL . 16.4 tt0 -74.14 -35.87 64.1 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.58 -0.7 . . . . 0.0 109.942 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.529 HG12 HD12 ' A' ' 79' ' ' LEU . 82.5 mt -72.99 -29.76 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.703 -0.623 . . . . 0.0 109.705 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 53.7 m -74.15 -32.7 63.24 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.633 -0.667 . . . . 0.0 109.806 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.0 mtt -74.33 -39.27 62.94 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.669 -0.644 . . . . 0.0 109.705 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 186' ' ' VAL . . . . . 0.525 HG23 ' O ' ' B' ' 182' ' ' GLU . 57.3 t -72.33 -30.83 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.586 -0.696 . . . . 0.0 109.511 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -72.72 -29.7 63.58 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.711 -0.618 . . . . 0.0 109.905 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -70.44 -29.89 66.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.641 -0.662 . . . . 0.0 109.899 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.06 -34.05 63.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.706 -0.621 . . . . 0.0 109.989 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.699 HG12 HD12 ' A' ' 72' ' ' LEU . 72.9 mt -73.86 -31.77 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.583 -0.698 . . . . 0.0 109.742 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 89.8 p -72.21 -34.88 68.69 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.615 -0.678 . . . . 0.0 109.462 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 4.0 mmmt -76.35 -32.51 58.69 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.366 179.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.762 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -71.08 -31.37 67.73 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 179.276 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.9 tptt -68.83 -46.68 67.94 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.592 -0.693 . . . . 0.0 109.651 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 3.2 tptp -66.58 -31.47 72.19 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.563 -0.71 . . . . 0.0 109.287 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -65.25 -34.87 79.37 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -65.3 -29.11 69.84 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.688 -0.633 . . . . 0.0 109.676 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -62.16 -40.19 95.16 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.629 -0.669 . . . . 0.0 109.76 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -62.49 -34.63 77.22 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.79 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.654 HD23 ' HG ' ' A' ' 62' ' ' LEU . 11.0 tp -76.88 -30.69 56.33 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.653 -0.655 . . . . 0.0 109.702 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.514 ' HG2' HD11 ' A' ' 62' ' ' LEU . 8.8 mt-10 . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.613 -0.68 . . . . 0.0 109.713 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.907 HD22 HD23 ' B' ' 200' ' ' LEU . 1.5 mm? . . . . . 0 N--CA 1.495 1.778 0 CA-C-O 121.028 0.442 . . . . 0.0 109.842 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -63.24 -41.82 99.13 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.666 -0.646 . . . . 0.0 109.997 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -72.16 -37.55 69.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.667 -0.646 . . . . 0.0 109.642 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.49 HG22 ' CD1' ' A' ' 69' ' ' ILE . 89.7 m -73.62 -30.9 63.25 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.757 -0.59 . . . . 0.0 109.413 179.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -69.9 -27.66 64.98 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 120.166 -0.614 . . . . 0.0 109.92 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.47 -38.54 81.16 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.587 -0.695 . . . . 0.0 110.084 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -75.99 -36.02 59.36 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.612 -0.68 . . . . 0.0 109.606 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.738 HG12 HD23 ' B' ' 193' ' ' LEU . 86.1 mt -75.61 -26.2 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.777 -0.577 . . . . 0.0 109.644 179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.419 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.0 tt -76.03 -33.89 59.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.549 -0.72 . . . . 0.0 109.812 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.9 mmtm -70.41 -32.97 70.82 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.601 -0.687 . . . . 0.0 109.655 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.704 HD22 HG12 ' B' ' 190' ' ' ILE . 6.9 mt -65.8 -29.96 70.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.679 -0.638 . . . . 0.0 109.707 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.11 -44.18 96.39 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.648 -0.658 . . . . 0.0 109.82 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.08 -32.5 72.87 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.693 -0.63 . . . . 0.0 109.428 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -67.53 -35.2 78.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.773 -0.579 . . . . 0.0 109.743 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -71.19 -31.64 67.88 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.719 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.65 -38.72 67.58 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.718 -0.614 . . . . 0.0 109.572 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.17 -30.57 71.08 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.714 -0.617 . . . . 0.0 109.742 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.418 ' HA ' HD13 ' A' ' 79' ' ' LEU . 1.1 mm? -70.33 -46.75 63.55 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.708 -0.62 . . . . 0.0 109.734 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -64.28 -31.04 72.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.633 -0.667 . . . . 0.0 109.602 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.75 -29.43 69.95 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.688 -0.633 . . . . 0.0 109.781 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -64.62 -47.65 77.78 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.656 -0.653 . . . . 0.0 109.669 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 tptm -63.1 -30.77 71.86 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.671 -0.643 . . . . 0.0 109.619 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -64.93 -34.31 78.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.744 -0.598 . . . . 0.0 109.832 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -70.52 -37.35 74.11 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.709 -0.619 . . . . 0.0 109.745 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.641 HD23 HD21 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -66.1 -29.42 69.74 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.711 -0.618 . . . . 0.0 109.763 179.557 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -29.53 69.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.57 -0.706 . . . . 0.0 109.829 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.0 mp -76.62 -28.83 56.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.702 -0.624 . . . . 0.0 110.044 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -95.72 1.61 53.51 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.578 -0.701 . . . . 0.0 111.071 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.533 HD11 ' CD1' ' B' ' 173' ' ' ILE . 55.1 tp . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.272 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.852 HD21 HD12 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -146.26 -79.48 0.16 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.561 -0.964 . . . . 0.0 110.471 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 35.5 t -134.35 18.85 3.66 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.19 -0.944 . . . . 0.0 110.799 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 7.4 tptm 50.76 25.9 2.32 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.222 -0.924 . . . . 0.0 110.558 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -148.44 -46.49 0.15 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.612 -0.68 . . . . 0.0 109.417 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.619 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.3 mm-40 -67.39 -33.08 74.44 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.286 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.852 HD12 HD21 ' B' ' 167' ' ' LEU . 1.2 tt -78.5 -28.42 46.33 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 178.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.533 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.7 mm -68.5 -30.82 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -71.76 -30.27 65.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.648 -0.658 . . . . 0.0 109.979 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.744 ' O ' HG23 ' B' ' 179' ' ' VAL . 96.6 m-20 -74.72 -32.9 62.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.636 -0.665 . . . . 0.0 109.716 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.456 ' CE ' HD13 ' A' ' 90' ' ' LEU . 1.4 mtt -70.13 -29.77 66.78 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.692 -0.63 . . . . 0.0 109.983 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -73.81 -35.12 64.83 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.584 -0.697 . . . . 0.0 110.044 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -75.55 -29.93 59.54 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.636 -0.665 . . . . 0.0 109.876 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.744 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.4 t -76.05 -29.88 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.608 -0.682 . . . . 0.0 109.653 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 180' ' ' ASP . . . . . 0.406 ' HA ' HD12 ' B' ' 183' ' ' ILE . 17.8 t70 -75.73 -35.93 60.09 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.653 -0.654 . . . . 0.0 109.834 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.4 mtt85 -71.46 -28.45 63.96 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.632 -0.668 . . . . 0.0 109.723 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -70.19 -32.96 71.14 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.531 -0.731 . . . . 0.0 109.953 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' B' ' 180' ' ' ASP . 76.0 mt -70.88 -29.05 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.568 -0.707 . . . . 0.0 109.766 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.9 m -71.34 -34.73 70.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.574 -0.704 . . . . 0.0 109.742 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.22 -43.85 66.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.615 -0.678 . . . . 0.0 109.731 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 73.4 t -71.95 -31.53 40.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.577 -0.702 . . . . 0.0 109.426 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.49 -30.18 59.79 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.659 -0.651 . . . . 0.0 109.704 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 12.0 tp-100 -73.03 -30.13 63.52 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.643 -0.66 . . . . 0.0 109.843 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -37.44 73.73 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.683 -0.636 . . . . 0.0 109.823 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.704 HG12 HD22 ' A' ' 72' ' ' LEU . 75.8 mt -71.26 -31.15 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.63 -0.668 . . . . 0.0 109.554 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 6.4 m -68.49 -35.0 76.9 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.679 -0.638 . . . . 0.0 109.517 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 3.5 mmmm -74.73 -37.05 62.64 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.702 -0.624 . . . . 0.0 109.393 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.738 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -70.92 -31.82 68.56 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.635 -0.665 . . . . 0.0 109.367 179.297 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.7 tptm -66.56 -40.25 88.92 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.724 -0.61 . . . . 0.0 109.446 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -64.37 -31.62 72.9 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.666 -0.646 . . . . 0.0 109.43 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -63.74 -36.39 83.73 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.671 -0.643 . . . . 0.0 109.462 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -62.83 -30.03 71.18 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.774 -0.579 . . . . 0.0 109.632 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.54 -44.24 97.41 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.646 -0.659 . . . . 0.0 109.894 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -63.55 -39.98 95.82 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.699 -0.626 . . . . 0.0 109.699 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.907 HD23 HD22 ' A' ' 62' ' ' LEU . 3.6 tp -70.8 -40.64 72.4 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.655 -0.653 . . . . 0.0 109.721 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 . . . . . 0 N--CA 1.494 1.73 0 O-C-N 121.656 -0.653 . . . . 0.0 109.668 179.472 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.0 tp . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.099 0.476 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.16 -32.38 61.28 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.534 -0.729 . . . . 0.0 110.127 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -75.89 -36.79 59.36 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.629 -0.669 . . . . 0.0 109.735 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.412 HG22 HD11 ' A' ' 69' ' ' ILE . 89.6 m -71.87 -30.51 65.5 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.734 -0.603 . . . . 0.0 109.446 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -67.1 -28.91 68.56 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.593 -0.692 . . . . 0.0 109.767 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -63.49 -40.17 96.38 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.623 -0.673 . . . . 0.0 110.058 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -74.22 -34.54 63.71 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.653 -0.654 . . . . 0.0 109.609 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.486 HG12 HD22 ' B' ' 193' ' ' LEU . 73.8 mt -74.63 -27.05 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.744 -0.598 . . . . 0.0 109.578 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.481 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.3 tt -73.01 -31.56 64.55 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.544 -0.723 . . . . 0.0 109.843 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -30.88 70.94 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.509 -0.744 . . . . 0.0 109.843 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.663 HD22 HG12 ' B' ' 190' ' ' ILE . 18.9 mt -65.02 -29.1 69.99 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.624 -0.673 . . . . 0.0 110.036 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.605 ' O ' HD13 ' A' ' 77' ' ' LEU . 2.6 tp10 -66.76 -35.32 79.83 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.653 -0.654 . . . . 0.0 110.076 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.5 -32.8 58.53 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.603 -0.686 . . . . 0.0 109.826 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.7 tmtm? -77.73 -30.19 51.53 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.729 -0.607 . . . . 0.0 109.586 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.552 HD13 HD12 ' B' ' 190' ' ' ILE . 27.8 tp -79.16 -30.19 43.42 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.665 -0.647 . . . . 0.0 109.78 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.605 HD13 ' O ' ' A' ' 73' ' ' GLU . 1.4 mp -77.68 -31.28 52.41 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.634 -0.666 . . . . 0.0 109.719 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.26 -28.66 59.9 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.655 -0.653 . . . . 0.0 109.875 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.75 HD23 ' HA ' ' B' ' 183' ' ' ILE . 4.6 tp -76.48 -36.24 57.94 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.603 -0.686 . . . . 0.0 109.893 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -73.04 -30.46 63.74 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.614 -0.679 . . . . 0.0 109.694 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -70.85 -27.95 64.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.677 -0.64 . . . . 0.0 109.875 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -39.67 81.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.571 -0.706 . . . . 0.0 109.935 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -68.99 -29.72 67.98 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.592 -0.693 . . . . 0.0 109.91 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -69.91 -29.75 67.01 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.7 -0.625 . . . . 0.0 109.943 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -67.15 -36.27 81.48 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.66 -0.65 . . . . 0.0 109.861 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.413 HD13 ' HG2' ' B' ' 176' ' ' MET . 3.7 mt -59.99 -36.59 77.51 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.659 -0.651 . . . . 0.0 110.01 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -63.6 -51.66 64.31 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.618 -0.676 . . . . 0.0 109.666 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.6 mt -62.14 -27.36 68.89 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.696 -0.627 . . . . 0.0 109.611 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -107.78 21.12 17.88 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.621 -0.674 . . . . 0.0 110.417 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.698 ' HA ' HD23 ' B' ' 172' ' ' LEU . 3.4 mt . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.445 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 1.022 HD21 HD13 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -49.67 -61.9 1.86 Allowed 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.545 -0.974 . . . . 0.0 111.596 -179.658 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 5.3 t -149.14 14.74 0.9 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.995 -1.065 . . . . 0.0 111.328 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 19.6 tptt 49.94 26.21 1.92 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.081 -1.012 . . . . 0.0 110.867 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -150.86 -46.48 0.12 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.695 -0.628 . . . . 0.0 109.753 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.76 -42.64 85.8 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.355 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 1.022 HD13 HD21 ' B' ' 167' ' ' LEU . 9.8 tp -71.44 -28.78 64.21 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.0 mm -66.35 -32.1 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -74.94 -31.17 61.43 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.734 -0.604 . . . . 0.0 109.637 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.797 ' O ' HG23 ' B' ' 179' ' ' VAL . 89.3 m-20 -71.64 -29.95 65.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.692 -0.63 . . . . 0.0 109.805 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.466 ' HE1' HD11 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -68.06 -32.31 72.57 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.657 -0.652 . . . . 0.0 109.938 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -72.65 -34.49 67.3 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.616 -0.677 . . . . 0.0 109.933 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.41 -29.68 61.62 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.823 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.797 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.6 t -74.44 -30.17 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.638 -0.664 . . . . 0.0 109.75 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -71.94 -30.84 65.73 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.671 -0.643 . . . . 0.0 110.045 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -28.8 61.31 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.635 -0.666 . . . . 0.0 109.933 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -74.63 -37.24 62.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.587 -0.696 . . . . 0.0 109.928 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.75 ' HA ' HD23 ' A' ' 79' ' ' LEU . 90.3 mt -71.19 -29.66 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.689 -0.632 . . . . 0.0 109.592 179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 184' ' ' THR . . . . . 0.405 HG22 ' OE1' ' B' ' 188' ' ' GLN . 65.5 m -70.71 -33.79 71.23 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.664 -0.648 . . . . 0.0 109.664 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.0 mtt -70.18 -44.54 68.52 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.637 -0.664 . . . . 0.0 109.686 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 67.4 t -66.92 -30.98 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.676 -0.64 . . . . 0.0 109.563 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.88 -30.69 68.19 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.654 -0.653 . . . . 0.0 109.808 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 188' ' ' GLN . . . . . 0.405 ' OE1' HG22 ' B' ' 184' ' ' THR . 0.0 OUTLIER -67.97 -36.59 80.32 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.663 -0.648 . . . . 0.0 109.712 179.716 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -38.56 82.06 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.633 -0.667 . . . . 0.0 109.85 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.663 HG12 HD22 ' A' ' 72' ' ' LEU . 72.9 mt -70.62 -37.09 68.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.623 -0.673 . . . . 0.0 109.667 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 32.5 m -68.87 -33.39 73.72 Favored 'General case' 0 N--CA 1.496 1.842 0 C-N-CA 120.192 -0.603 . . . . 0.0 109.605 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -77.01 -33.03 57.51 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.629 -0.67 . . . . 0.0 109.488 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.65 HD13 HD11 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -73.31 -33.14 65.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.68 -0.638 . . . . 0.0 109.324 179.186 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 16.5 tptt -65.4 -38.69 90.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.567 -0.708 . . . . 0.0 109.394 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -67.57 -31.24 71.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.627 -0.67 . . . . 0.0 109.336 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -37.1 86.01 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.664 -0.648 . . . . 0.0 109.422 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -62.79 -30.35 71.4 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.702 -0.624 . . . . 0.0 109.691 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -61.52 -41.2 96.95 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.672 -0.643 . . . . 0.0 109.874 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -62.29 -41.83 98.83 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.24 -0.584 . . . . 0.0 109.849 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.3 tp -72.36 -30.66 64.91 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.69 -0.631 . . . . 0.0 109.765 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 . . . . . 0 N--CA 1.493 1.714 0 O-C-N 121.679 -0.638 . . . . 0.0 109.832 179.602 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.682 HD12 HD23 ' B' ' 200' ' ' LEU . 1.6 tp . . . . . 0 N--CA 1.495 1.81 0 CA-C-O 121.153 0.501 . . . . 0.0 109.923 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -65.75 -30.0 70.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.53 -0.731 . . . . 0.0 110.009 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -48.99 66.1 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.59 -0.694 . . . . 0.0 109.976 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.429 HG23 ' NZ ' ' B' ' 196' ' ' LYS . 26.6 m -67.02 -30.61 70.75 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.612 -0.68 . . . . 0.0 109.472 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -68.97 -28.12 66.34 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.681 -0.637 . . . . 0.0 109.883 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -65.19 -39.08 92.37 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.553 -0.717 . . . . 0.0 109.943 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.73 -41.09 65.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.615 -0.678 . . . . 0.0 109.42 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.439 HG12 HD23 ' B' ' 193' ' ' LEU . 87.4 mt -66.43 -27.21 39.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 mt -62.65 -41.32 98.99 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.588 -0.695 . . . . 0.0 109.629 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -65.14 -30.35 71.27 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.53 -0.731 . . . . 0.0 109.621 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.727 ' CD1' HD13 ' B' ' 193' ' ' LEU . 12.3 mt -73.05 -29.02 62.66 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.691 -0.63 . . . . 0.0 109.95 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.78 -34.71 72.07 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.599 -0.688 . . . . 0.0 109.881 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -74.03 -29.94 62.18 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.619 -0.676 . . . . 0.0 109.73 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -73.66 -30.02 62.67 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.637 -0.664 . . . . 0.0 109.916 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.945 HD13 HD12 ' B' ' 190' ' ' ILE . 13.0 tp -75.32 -32.51 60.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.638 -0.664 . . . . 0.0 109.935 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.54 -30.94 57.32 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.633 -0.667 . . . . 0.0 109.748 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.23 -28.84 60.06 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.688 -0.632 . . . . 0.0 109.845 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.432 ' HA ' HD13 ' A' ' 79' ' ' LEU . 1.1 mm? -75.08 -36.95 61.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.536 -0.728 . . . . 0.0 109.823 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -70.63 -29.85 66.34 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.538 -0.726 . . . . 0.0 109.802 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -69.78 -27.85 65.25 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.693 -0.629 . . . . 0.0 109.973 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -40.37 83.8 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.544 -0.723 . . . . 0.0 109.849 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -69.14 -30.46 68.72 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.474 -0.766 . . . . 0.0 109.627 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.4 t-80 -67.19 -29.62 69.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.655 -0.653 . . . . 0.0 109.826 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -63.06 -36.17 82.7 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.624 -0.672 . . . . 0.0 109.936 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.693 HD23 HD21 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -67.52 -32.56 73.44 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.582 -0.699 . . . . 0.0 109.887 179.814 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -66.9 -29.48 69.37 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.658 -0.651 . . . . 0.0 109.996 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.0 mt -66.86 -29.29 69.17 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.601 -0.687 . . . . 0.0 110.049 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -120.14 29.28 7.59 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.58 -0.7 . . . . 0.0 110.161 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.705 HD13 ' CE ' ' B' ' 176' ' ' MET . 27.7 tp . . . . . 0 N--CA 1.497 1.906 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.053 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.764 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.0 OUTLIER -141.74 -82.62 0.21 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.681 -0.893 . . . . 0.0 110.413 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 59.8 p -129.5 19.52 5.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.13 -0.981 . . . . 0.0 110.825 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 5.7 tptm 50.61 25.99 2.26 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.272 -0.893 . . . . 0.0 110.616 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -148.79 -46.0 0.15 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.648 -0.657 . . . . 0.0 109.605 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.604 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.8 OUTLIER -68.33 -33.16 73.79 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.92 -0.712 . . . . 0.0 109.322 179.467 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.764 ' N ' HD11 ' B' ' 167' ' ' LEU . 2.7 tt -78.11 -28.37 48.59 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 178.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.426 HD13 HD11 ' A' ' 90' ' ' LEU . 50.8 mm -67.54 -30.76 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.736 -0.602 . . . . 0.0 109.381 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -72.04 -29.73 64.46 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.668 -0.645 . . . . 0.0 109.926 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -75.44 -30.95 60.16 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.611 -0.681 . . . . 0.0 109.8 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.705 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.9 OUTLIER -71.92 -29.14 63.99 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.734 -0.604 . . . . 0.0 109.84 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -70.42 -29.96 66.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.592 -0.692 . . . . 0.0 110.027 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.9 ttp180 -71.99 -36.36 69.75 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.617 -0.677 . . . . 0.0 109.923 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 58.4 t -67.22 -29.82 47.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.707 -0.62 . . . . 0.0 109.881 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -69.12 -28.95 66.92 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.632 -0.667 . . . . 0.0 110.141 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.36 -30.0 63.01 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.654 -0.654 . . . . 0.0 110.066 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -74.63 -35.74 62.9 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.597 -0.689 . . . . 0.0 109.956 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.9 mt -71.82 -30.85 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.705 -0.622 . . . . 0.0 109.56 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.7 m -69.71 -35.14 74.78 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.63 -0.669 . . . . 0.0 109.617 179.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.7 ttp -66.61 -44.84 81.0 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.654 -0.654 . . . . 0.0 109.815 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 64.6 t -68.96 -30.65 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.628 -0.67 . . . . 0.0 109.476 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -70.18 -28.51 65.38 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.67 -0.644 . . . . 0.0 110.021 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -67.47 -32.86 73.99 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.582 -0.699 . . . . 0.0 110.041 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.05 -33.65 57.22 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.663 -0.648 . . . . 0.0 109.67 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.945 HD12 HD13 ' A' ' 76' ' ' LEU . 75.2 mt -76.01 -27.91 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.615 -0.678 . . . . 0.0 109.705 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.33 -30.48 63.38 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.632 -0.667 . . . . 0.0 109.572 179.473 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 19.8 mmtt -76.27 -37.11 58.0 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.596 -0.69 . . . . 0.0 109.749 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.727 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.1 OUTLIER -71.03 -30.79 67.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.615 -0.678 . . . . 0.0 109.428 179.355 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.1 tptm -67.56 -38.26 83.88 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.635 -0.665 . . . . 0.0 109.614 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.3 tptt -69.62 -30.28 67.98 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.575 -0.703 . . . . 0.0 109.533 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.429 ' NZ ' HG23 ' A' ' 65' ' ' THR . 31.2 ttpt -67.52 -32.77 73.8 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.603 -0.685 . . . . 0.0 109.606 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -65.27 -30.91 71.82 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.692 -0.63 . . . . 0.0 109.684 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -43.42 98.88 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.765 -0.584 . . . . 0.0 109.93 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -46.76 87.84 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.696 -0.627 . . . . 0.0 109.942 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.682 HD23 HD12 ' A' ' 62' ' ' LEU . 4.8 tp -70.27 -32.87 70.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.649 -0.657 . . . . 0.0 109.725 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.642 -0.661 . . . . 0.0 109.878 179.617 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.606 HD21 ' HG2' ' B' ' 201' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 121.091 0.472 . . . . 0.0 110.168 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -70.68 -29.32 65.6 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.55 -0.719 . . . . 0.0 110.184 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -74.74 -40.22 61.39 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.58 -0.7 . . . . 0.0 109.973 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.7 m -71.48 -29.75 65.19 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.729 -0.607 . . . . 0.0 109.723 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.421 ' HA ' HD12 ' A' ' 69' ' ' ILE . 3.5 mmtp -72.5 -28.48 62.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.649 -0.657 . . . . 0.0 109.925 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -34.6 73.12 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.59 -0.694 . . . . 0.0 109.979 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -37.17 65.64 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.668 -0.645 . . . . 0.0 109.706 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.518 HG22 ' OE2' ' A' ' 73' ' ' GLU . 66.5 mt -68.77 -27.77 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.714 -0.616 . . . . 0.0 109.619 179.472 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.22 -35.93 80.62 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.58 -0.7 . . . . 0.0 109.936 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.0 mttt -70.03 -30.18 67.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.6 -0.687 . . . . 0.0 109.96 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.705 HD12 HG12 ' B' ' 190' ' ' ILE . 2.9 mm? -70.86 -28.7 64.76 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.61 -0.681 . . . . 0.0 109.964 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.518 ' OE2' HG22 ' A' ' 69' ' ' ILE . 0.4 OUTLIER -69.34 -35.82 76.3 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.535 -0.728 . . . . 0.0 110.099 179.863 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -73.11 -31.7 64.49 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.716 -0.615 . . . . 0.0 109.827 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -75.04 -34.71 61.89 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.687 -0.633 . . . . 0.0 109.788 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.855 HD13 HD12 ' B' ' 190' ' ' ILE . 10.0 tp -74.19 -30.42 62.21 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.663 -0.648 . . . . 0.0 109.703 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.5 tp -74.8 -35.34 62.5 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.74 -0.6 . . . . 0.0 109.69 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.97 -29.82 68.12 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.707 -0.621 . . . . 0.0 109.758 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.75 HD23 ' HA ' ' B' ' 183' ' ' ILE . 2.8 mp -69.81 -43.1 72.76 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.767 -0.583 . . . . 0.0 109.813 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -66.64 -29.14 69.09 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.657 -0.652 . . . . 0.0 109.89 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -69.33 -30.46 68.51 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.557 -0.714 . . . . 0.0 109.826 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.4 -48.26 50.99 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.619 -0.676 . . . . 0.0 109.729 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.5 tttp -63.87 -29.52 70.7 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.587 -0.696 . . . . 0.0 109.568 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -66.08 -29.98 70.41 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.675 -0.641 . . . . 0.0 109.948 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -64.15 -40.62 96.52 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.638 -0.664 . . . . 0.0 109.86 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.835 HD23 HD21 ' B' ' 172' ' ' LEU . 2.8 mt -60.41 -33.5 72.58 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.557 -0.715 . . . . 0.0 110.066 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -63.8 -47.13 82.09 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.59 -0.694 . . . . 0.0 109.786 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.54 -28.63 68.69 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.722 -0.611 . . . . 0.0 109.678 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.48 13.06 36.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.679 -0.638 . . . . 0.0 110.81 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.52 HD11 ' CD1' ' B' ' 173' ' ' ILE . 27.7 tp . . . . . 0 N--CA 1.499 1.984 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.315 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.956 HD21 HD12 ' B' ' 172' ' ' LEU . 0.1 OUTLIER -144.64 -68.93 0.3 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.556 -0.967 . . . . 0.0 110.67 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 13.1 t -145.44 16.41 1.48 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.225 -0.922 . . . . 0.0 110.974 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.7 tptm 50.65 26.06 2.32 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.119 -0.988 . . . . 0.0 110.615 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -149.14 -46.58 0.14 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.606 -0.684 . . . . 0.0 109.491 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.607 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.8 mt-10 -66.26 -37.13 84.76 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.979 -0.688 . . . . 0.0 109.395 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.956 HD12 HD21 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -75.2 -28.66 60.08 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.859 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.52 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.5 mm -66.84 -30.49 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.67 -0.644 . . . . 0.0 109.341 179.345 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -74.56 -30.12 61.62 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.68 -0.638 . . . . 0.0 109.847 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.58 ' O ' HG23 ' B' ' 179' ' ' VAL . 83.7 m-20 -74.38 -29.3 61.49 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.639 -0.663 . . . . 0.0 109.979 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.456 ' HE2' ' C ' ' A' ' 86' ' ' LEU . 0.8 OUTLIER -72.49 -29.63 63.8 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.68 -0.638 . . . . 0.0 109.952 179.764 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -75.79 -28.96 58.58 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.657 -0.652 . . . . 0.0 110.138 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.91 -31.76 56.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.582 -0.699 . . . . 0.0 109.898 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.58 HG23 ' O ' ' B' ' 175' ' ' ASN . 66.4 t -74.93 -29.29 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.668 -0.645 . . . . 0.0 109.774 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 180' ' ' ASP . . . . . 0.403 ' O ' ' OG1' ' B' ' 184' ' ' THR . 14.6 t70 -73.7 -28.26 61.63 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.59 -0.694 . . . . 0.0 110.089 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.09 -31.38 64.32 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.625 -0.672 . . . . 0.0 110.101 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -73.53 -37.65 65.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.609 -0.682 . . . . 0.0 110.004 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.75 ' HA ' HD23 ' A' ' 79' ' ' LEU . 85.1 mt -68.57 -28.1 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.704 -0.623 . . . . 0.0 109.702 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 184' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 2.7 m -67.46 -34.54 77.39 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.492 -0.755 . . . . 0.0 109.85 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -48.26 69.41 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.552 -0.718 . . . . 0.0 109.833 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 186' ' ' VAL . . . . . 0.441 HG21 HD21 ' A' ' 79' ' ' LEU . 58.5 t -64.44 -28.93 45.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.61 -0.681 . . . . 0.0 109.816 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -70.81 -28.94 65.0 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.638 -0.664 . . . . 0.0 110.068 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -68.95 -31.31 70.09 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.548 -0.72 . . . . 0.0 110.047 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -40.53 65.48 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.703 -0.623 . . . . 0.0 109.893 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.855 HD12 HD13 ' A' ' 76' ' ' LEU . 77.2 mt -70.5 -28.51 35.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.687 -0.633 . . . . 0.0 109.819 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.0 m -73.85 -36.03 64.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.554 -0.716 . . . . 0.0 109.842 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -77.17 -31.08 55.22 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.615 -0.678 . . . . 0.0 109.611 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.474 HD23 ' HE2' ' B' ' 196' ' ' LYS . 0.2 OUTLIER -77.78 -21.76 51.18 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.576 -0.702 . . . . 0.0 110.159 179.411 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.8 tptm -81.35 -27.54 34.87 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.325 -0.86 . . . . 0.0 109.673 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 27.4 tptt -75.67 -35.3 60.42 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.54 -0.725 . . . . 0.0 109.94 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.474 ' HE2' HD23 ' B' ' 193' ' ' LEU . 13.8 pttt -69.04 -25.42 64.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.511 -0.743 . . . . 0.0 109.892 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -71.8 -29.96 65.01 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.521 -0.737 . . . . 0.0 109.603 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -62.38 -41.91 99.01 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.705 -0.622 . . . . 0.0 109.751 179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.75 -38.79 91.94 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.733 -0.604 . . . . 0.0 109.639 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.513 HD23 HD12 ' A' ' 62' ' ' LEU . 2.6 tp -75.7 -32.33 60.04 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.61 -0.681 . . . . 0.0 109.508 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.606 ' HG2' HD21 ' A' ' 62' ' ' LEU . 2.7 mm-40 . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.658 -0.651 . . . . 0.0 109.738 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.7 tp . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 121.182 0.515 . . . . 0.0 110.048 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -69.97 -48.65 57.43 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.479 -0.763 . . . . 0.0 109.982 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.92 -30.94 70.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.73 -0.606 . . . . 0.0 109.797 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.55 HG22 HD11 ' A' ' 69' ' ' ILE . 84.1 m -74.67 -30.71 61.68 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.69 -0.631 . . . . 0.0 109.742 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -71.41 -27.18 63.13 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.603 -0.686 . . . . 0.0 110.064 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -72.41 -35.1 68.3 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.598 -0.688 . . . . 0.0 110.22 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 -76.22 -35.07 59.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.69 -0.631 . . . . 0.0 109.792 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.55 HD11 HG22 ' A' ' 65' ' ' THR . 62.2 mt -75.2 -27.14 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.683 -0.636 . . . . 0.0 109.494 179.462 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.83 -34.55 62.35 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.58 -0.7 . . . . 0.0 109.887 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -71.41 -33.51 69.51 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.564 -0.71 . . . . 0.0 109.613 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.812 HD22 HG12 ' B' ' 190' ' ' ILE . 5.6 mt -66.92 -33.0 74.64 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.655 -0.653 . . . . 0.0 109.853 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -67.67 -36.85 81.47 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.613 -0.679 . . . . 0.0 109.878 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -71.21 -32.0 68.3 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.63 -0.669 . . . . 0.0 109.412 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -67.86 -36.05 79.61 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.701 -0.624 . . . . 0.0 109.825 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 21.4 tp -68.49 -30.09 68.85 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.644 -0.66 . . . . 0.0 109.844 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.5 mt -75.07 -38.84 61.17 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.643 -0.661 . . . . 0.0 109.771 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.75 -28.99 66.25 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.688 -0.633 . . . . 0.0 109.902 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.642 HD23 ' HA ' ' B' ' 183' ' ' ILE . 5.9 tp -72.88 -37.25 67.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.587 -0.696 . . . . 0.0 110.022 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -70.04 -30.65 67.98 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.558 -0.713 . . . . 0.0 109.689 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -28.42 67.46 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.738 -0.601 . . . . 0.0 109.839 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -45.04 80.3 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.641 -0.662 . . . . 0.0 109.778 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.05 -30.86 71.85 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.605 -0.684 . . . . 0.0 109.665 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -65.32 -30.93 71.82 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.723 -0.61 . . . . 0.0 109.823 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -65.27 -32.33 73.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.594 -0.691 . . . . 0.0 109.839 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.529 HD23 HD21 ' B' ' 172' ' ' LEU . 0.5 OUTLIER -66.28 -33.92 76.83 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.642 -0.661 . . . . 0.0 109.71 179.633 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -60.85 -34.8 75.14 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.642 -0.661 . . . . 0.0 109.862 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.7 mp -69.86 -29.38 66.6 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.732 -0.605 . . . . 0.0 109.775 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -95.09 -15.74 23.18 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.631 -0.668 . . . . 0.0 110.634 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.785 ' HA ' HD13 ' B' ' 172' ' ' LEU . 16.8 tp . . . . . 0 N--CA 1.501 2.094 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.746 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.371 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.568 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.6 OUTLIER -50.13 -52.17 37.32 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.581 -0.952 . . . . 0.0 111.746 -179.912 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 25.2 p -153.07 15.23 0.54 Allowed 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.119 -0.988 . . . . 0.0 111.532 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 27.3 tptt 49.78 26.19 1.81 Allowed 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.077 -1.014 . . . . 0.0 110.893 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -150.5 -47.56 0.12 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.674 -0.641 . . . . 0.0 109.739 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.401 ' HB2' ' CD1' ' B' ' 167' ' ' LEU . 1.9 mt-10 -74.54 -31.56 62.16 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.053 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.785 HD13 ' HA ' ' A' ' 90' ' ' LEU . 2.9 tt -76.47 -28.18 56.41 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.627 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.0 mm -68.49 -30.2 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.642 -0.661 . . . . 0.0 109.624 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -70.89 -29.43 65.51 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.67 -0.644 . . . . 0.0 109.984 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.755 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.8 m-20 -75.71 -29.66 59.04 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.674 -0.642 . . . . 0.0 110.065 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.47 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -75.53 -29.38 59.43 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.625 -0.672 . . . . 0.0 110.023 179.749 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.2 -31.29 58.38 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.617 -0.677 . . . . 0.0 110.05 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -28.51 58.67 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.67 -0.644 . . . . 0.0 110.001 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.755 HG23 ' O ' ' B' ' 175' ' ' ASN . 60.1 t -76.12 -31.94 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.62 -0.675 . . . . 0.0 109.723 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -73.54 -29.92 62.75 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.591 -0.693 . . . . 0.0 109.917 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.2 -29.77 63.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.724 -0.61 . . . . 0.0 109.894 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -72.72 -38.82 67.33 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.653 -0.655 . . . . 0.0 109.953 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.642 ' HA ' HD23 ' A' ' 79' ' ' LEU . 88.1 mt -66.74 -28.02 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.694 -0.629 . . . . 0.0 109.702 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.0 m -67.26 -35.78 80.24 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.601 -0.687 . . . . 0.0 109.889 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.8 ttt -72.13 -37.52 69.42 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.648 -0.658 . . . . 0.0 109.856 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 186' ' ' VAL . . . . . 0.408 HG21 ' CD2' ' A' ' 79' ' ' LEU . 59.3 t -73.0 -30.69 32.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.591 -0.693 . . . . 0.0 109.618 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -74.12 -28.62 61.44 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.726 -0.608 . . . . 0.0 110.077 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -74.13 -29.33 61.77 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.603 -0.686 . . . . 0.0 110.044 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -37.63 61.15 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.7 -0.625 . . . . 0.0 109.94 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.812 HG12 HD22 ' A' ' 72' ' ' LEU . 81.4 mt -72.51 -30.52 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.602 -0.686 . . . . 0.0 109.635 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 17.8 m -71.65 -34.94 70.18 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.631 -0.668 . . . . 0.0 109.604 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.6 mmtp -75.34 -37.77 60.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.644 -0.66 . . . . 0.0 109.383 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.59 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -71.6 -30.26 65.6 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.743 -0.598 . . . . 0.0 109.455 179.27 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 17.1 tptt -70.29 -41.03 73.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.699 -0.626 . . . . 0.0 109.622 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.9 mmtm -67.14 -31.28 71.6 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.631 -0.668 . . . . 0.0 109.33 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -63.75 -36.15 82.94 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.681 -0.637 . . . . 0.0 109.293 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -63.07 -30.23 71.43 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.773 -0.58 . . . . 0.0 109.58 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -60.99 -41.95 97.47 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.691 -0.631 . . . . 0.0 109.911 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -61.75 -49.52 76.06 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.664 -0.647 . . . . 0.0 109.895 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 19.5 tp -68.27 -29.86 68.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.621 -0.675 . . . . 0.0 109.685 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 0.0 109.929 179.693 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.613 HD11 ' HG2' ' B' ' 201' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 121.113 0.482 . . . . 0.0 110.041 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -64.28 -31.54 72.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.641 -0.662 . . . . 0.0 110.001 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -70.44 -47.75 59.22 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.598 -0.689 . . . . 0.0 109.92 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.9 m -66.49 -31.36 72.05 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.739 -0.601 . . . . 0.0 109.538 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.92 -27.23 65.58 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.672 -0.642 . . . . 0.0 109.896 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -66.54 -36.02 81.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.498 -0.751 . . . . 0.0 109.988 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.0 tp60 -76.39 -34.56 58.85 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.567 -0.708 . . . . 0.0 109.563 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.9 mt -73.26 -27.51 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.691 -0.63 . . . . 0.0 109.491 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.1 tp -71.77 -38.78 70.29 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.556 -0.715 . . . . 0.0 109.953 179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.3 mmtt -65.64 -35.44 80.79 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.543 -0.723 . . . . 0.0 109.728 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.813 HD22 HG12 ' B' ' 190' ' ' ILE . 3.2 mt -69.54 -27.96 65.61 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.72 -0.612 . . . . 0.0 109.809 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -69.91 -38.91 76.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.579 -0.701 . . . . 0.0 109.975 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -67.38 -41.38 85.11 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.681 -0.637 . . . . 0.0 109.62 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.7 tptt -64.32 -35.23 80.18 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.77 -0.581 . . . . 0.0 109.713 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.546 HD13 HD12 ' B' ' 190' ' ' ILE . 18.5 tp -73.49 -31.41 63.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.679 -0.638 . . . . 0.0 109.529 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 tp -70.51 -34.83 72.76 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.693 -0.629 . . . . 0.0 109.702 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.04 -30.78 62.58 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.721 -0.612 . . . . 0.0 109.68 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.847 HD12 ' CG1' ' B' ' 183' ' ' ILE . 0.2 OUTLIER -76.16 -37.76 57.53 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.649 -0.657 . . . . 0.0 109.643 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -71.96 -29.75 64.59 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.617 -0.677 . . . . 0.0 109.686 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.5 -29.68 66.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 109.72 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -68.48 -43.67 76.41 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.612 -0.68 . . . . 0.0 109.744 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -64.7 -29.93 70.93 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.555 -0.716 . . . . 0.0 109.647 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -64.33 -32.56 74.22 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.699 -0.625 . . . . 0.0 109.829 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -73.57 -35.33 65.43 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.672 -0.642 . . . . 0.0 109.715 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.401 ' CD2' ' CD2' ' B' ' 172' ' ' LEU . 3.2 mt -70.87 -33.32 70.5 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.69 -0.631 . . . . 0.0 109.685 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.469 ' HA ' ' HE1' ' B' ' 176' ' ' MET . 0.2 OUTLIER -68.27 -33.12 73.79 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.715 -0.616 . . . . 0.0 109.718 179.848 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 tp -79.16 -30.0 43.31 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.643 -0.661 . . . . 0.0 109.764 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -89.11 -8.7 53.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.626 -0.672 . . . . 0.0 110.848 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.643 HD13 ' HE3' ' B' ' 176' ' ' MET . 56.4 tp . . . . . 0 N--CA 1.5 2.026 0 O-C-N 121.093 -1.004 . . . . 0.0 110.46 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.307 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.712 HD13 ' HB2' ' B' ' 171' ' ' GLU . 0.3 OUTLIER -117.75 -31.16 5.23 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.684 -0.892 . . . . 0.0 110.32 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.71 ' H ' HD12 ' B' ' 167' ' ' LEU . 1.4 m -167.53 18.08 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.375 -0.828 . . . . 0.0 111.808 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 24.4 tptt 48.3 26.98 1.21 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.04 -1.038 . . . . 0.0 110.99 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.32 -47.24 0.11 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.774 -0.579 . . . . 0.0 109.695 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.712 ' HB2' HD13 ' B' ' 167' ' ' LEU . 0.5 OUTLIER -69.79 -37.02 76.18 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.259 179.499 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.602 ' N ' HD11 ' B' ' 167' ' ' LEU . 3.2 mt -74.2 -28.14 61.13 Favored 'General case' 0 N--CA 1.493 1.679 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.443 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.1 mm -68.25 -31.84 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.687 -0.633 . . . . 0.0 109.404 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -74.43 -31.35 62.25 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.757 -0.589 . . . . 0.0 109.955 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -75.06 -34.21 61.79 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.62 -0.675 . . . . 0.0 109.885 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.643 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -71.42 -27.23 63.15 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.611 -0.681 . . . . 0.0 109.75 179.475 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.05 -31.71 69.47 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.553 -0.717 . . . . 0.0 110.104 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.58 -29.32 46.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.607 -0.683 . . . . 0.0 109.952 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.443 ' O ' HD12 ' B' ' 183' ' ' ILE . 76.0 t -79.29 -25.8 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.639 -0.663 . . . . 0.0 109.53 179.285 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -78.16 -38.7 43.0 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.463 -0.773 . . . . 0.0 110.073 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 10.3 ptt85 -73.09 -24.8 60.7 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 119.868 -0.733 . . . . 0.0 110.158 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 182' ' ' GLU . . . . . 0.503 ' O ' HG23 ' B' ' 186' ' ' VAL . 2.4 tp10 -80.78 -37.02 31.02 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.511 -0.743 . . . . 0.0 109.87 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.847 ' CG1' HD12 ' A' ' 79' ' ' LEU . 76.0 mt -76.52 -27.32 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.611 -0.681 . . . . 0.0 109.556 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 72.2 m -76.62 -30.98 57.12 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.496 -0.752 . . . . 0.0 109.676 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.5 mtp -76.07 -39.32 55.68 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.619 -0.676 . . . . 0.0 109.666 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 186' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 182' ' ' GLU . 59.3 t -72.98 -29.9 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.628 -0.67 . . . . 0.0 109.499 179.378 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -72.75 -28.15 62.45 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.539 -0.726 . . . . 0.0 109.984 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -71.94 -34.48 69.07 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.635 -0.666 . . . . 0.0 109.985 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -40.67 64.04 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.622 -0.674 . . . . 0.0 109.684 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.813 HG12 HD22 ' A' ' 72' ' ' LEU . 84.2 mt -71.04 -30.54 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.654 -0.654 . . . . 0.0 109.477 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 50.9 m -69.26 -35.57 76.21 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.688 -0.633 . . . . 0.0 109.41 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.9 mmmt -76.53 -36.4 57.72 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.451 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -71.75 -30.01 65.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.683 -0.636 . . . . 0.0 109.531 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -69.24 -37.75 78.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.613 -0.679 . . . . 0.0 109.764 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.6 -31.23 71.13 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.562 -0.711 . . . . 0.0 109.467 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -64.13 -36.49 84.2 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.659 -0.65 . . . . 0.0 109.742 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -63.77 -30.59 71.67 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.667 -0.646 . . . . 0.0 109.867 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.39 -38.61 90.28 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.59 -0.693 . . . . 0.0 109.897 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -62.22 -41.47 98.42 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.715 -0.615 . . . . 0.0 109.9 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.462 HD23 ' HG ' ' A' ' 62' ' ' LEU . 5.5 tp -73.14 -32.37 64.85 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.587 -0.695 . . . . 0.0 109.687 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.613 ' HG2' HD11 ' A' ' 62' ' ' LEU . 24.6 mt-10 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.685 -0.635 . . . . 0.0 109.812 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.751 HD11 ' HG2' ' B' ' 201' ' ' GLU . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.771 0 CA-C-O 121.161 0.505 . . . . 0.0 109.982 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -64.18 -30.0 71.08 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.66 -0.65 . . . . 0.0 109.954 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -68.45 -51.41 43.91 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.615 -0.678 . . . . 0.0 109.866 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 79.7 m -63.45 -32.08 73.42 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.637 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.41 -29.09 68.5 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.647 -0.658 . . . . 0.0 109.76 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.7 -36.7 84.72 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.66 -0.65 . . . . 0.0 109.956 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 36.6 tp60 -73.46 -35.75 65.76 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.652 -0.655 . . . . 0.0 109.708 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.5 mt -71.0 -28.31 32.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.656 -0.653 . . . . 0.0 109.553 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.418 HD23 ' C ' ' A' ' 70' ' ' LEU . 9.8 tt -68.71 -37.5 79.54 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.492 -0.755 . . . . 0.0 109.806 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -65.01 -37.96 89.35 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.66 -0.65 . . . . 0.0 109.701 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.627 HD22 HG12 ' B' ' 190' ' ' ILE . 12.3 mt -62.37 -29.55 70.55 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.689 -0.632 . . . . 0.0 109.939 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 tm-20 -63.3 -42.84 99.09 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.537 -0.727 . . . . 0.0 109.945 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.19 -34.48 74.97 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.671 -0.643 . . . . 0.0 109.559 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.01 -36.9 69.84 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.733 -0.605 . . . . 0.0 109.595 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.8 tp -75.11 -31.36 61.11 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.626 -0.671 . . . . 0.0 109.582 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tt -76.06 -32.2 59.16 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.738 -0.601 . . . . 0.0 109.604 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.411 ' HA ' ' HG2' ' A' ' 81' ' ' GLU . . . -73.26 -27.09 61.37 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.1 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.48 -27.07 41.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.46 -0.775 . . . . 0.0 109.813 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -76.34 -36.58 58.16 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.582 -0.699 . . . . 0.0 109.976 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.411 ' HG2' ' HA ' ' A' ' 78' ' ' ALA . 7.6 pt-20 -68.76 -24.62 64.46 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 119.889 -0.724 . . . . 0.0 109.822 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.05 -41.8 81.5 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.495 -0.753 . . . . 0.0 109.478 179.407 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.4 ttpm? -68.29 -31.05 70.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.593 -0.692 . . . . 0.0 109.435 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -65.5 -30.08 70.81 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.687 -0.633 . . . . 0.0 109.734 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -61.79 -34.72 76.41 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.63 -0.669 . . . . 0.0 109.726 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.866 HD23 HD21 ' B' ' 172' ' ' LEU . 0.8 OUTLIER -70.66 -30.31 66.88 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.635 -0.665 . . . . 0.0 109.81 179.571 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -69.79 -30.51 68.07 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.602 -0.686 . . . . 0.0 110.019 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.4 tp -67.5 -31.61 71.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.576 -0.703 . . . . 0.0 109.888 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -117.38 29.84 7.64 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.648 -0.657 . . . . 0.0 109.987 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.612 ' CD2' HD11 ' B' ' 173' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.498 1.945 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.305 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.369 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.784 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.0 OUTLIER -141.35 -82.6 0.22 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.556 -0.967 . . . . 0.0 110.453 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 8.4 t -129.48 20.74 5.64 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.946 . . . . 0.0 110.848 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 169' ' ' LYS . . . . . 0.459 ' C ' HD13 ' B' ' 173' ' ' ILE . 13.8 tptm 50.76 25.94 2.33 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.238 -0.914 . . . . 0.0 110.729 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -150.99 -45.58 0.12 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.694 -0.628 . . . . 0.0 109.724 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.617 ' HB2' HD12 ' B' ' 167' ' ' LEU . 1.4 mt-10 -67.7 -31.12 70.86 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 120.003 -0.679 . . . . 0.0 109.621 179.648 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.866 HD21 HD23 ' A' ' 86' ' ' LEU . 2.8 tt -80.94 -30.57 35.22 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.622 -0.674 . . . . 0.0 109.341 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.619 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.0 mp -72.53 -31.29 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -64.7 -32.62 74.38 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.524 ' O ' HG23 ' B' ' 179' ' ' VAL . 76.8 m-20 -74.16 -32.76 63.25 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.068 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -65.23 -29.46 70.26 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.785 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -72.12 -31.94 66.48 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.566 -0.709 . . . . 0.0 110.021 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.03 -30.17 58.36 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.617 -0.677 . . . . 0.0 109.838 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.524 HG23 ' O ' ' B' ' 175' ' ' ASN . 66.2 t -74.54 -29.57 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.673 -0.642 . . . . 0.0 109.689 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -72.64 -28.67 62.88 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.591 -0.693 . . . . 0.0 110.049 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -71.92 -29.52 64.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.591 -0.693 . . . . 0.0 110.02 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -72.85 -38.87 66.93 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.542 -0.724 . . . . 0.0 110.044 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 80.8 mt -68.53 -29.03 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 C-N-CA 120.172 -0.611 . . . . 0.0 109.678 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 24.6 m -68.72 -32.88 72.98 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.689 -0.632 . . . . 0.0 109.849 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.92 -47.81 60.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.556 -0.715 . . . . 0.0 109.724 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 65.6 t -70.42 -31.95 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.62 -0.675 . . . . 0.0 109.402 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -74.81 -28.89 60.9 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.771 -0.581 . . . . 0.0 109.715 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -72.59 -29.94 63.95 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.612 -0.68 . . . . 0.0 109.956 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -72.26 -34.72 68.45 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.639 -0.663 . . . . 0.0 109.841 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.627 HG12 HD22 ' A' ' 72' ' ' LEU . 80.5 mt -70.63 -31.3 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.666 -0.646 . . . . 0.0 109.511 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 4.8 m -67.31 -40.17 86.0 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.629 -0.67 . . . . 0.0 109.524 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -72.3 -34.37 68.08 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.678 -0.639 . . . . 0.0 109.337 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.543 HD23 ' HE2' ' B' ' 196' ' ' LYS . 0.3 OUTLIER -78.01 -10.97 59.85 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.682 -0.636 . . . . 0.0 110.558 179.423 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 18.4 tptt -91.72 -28.7 17.26 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.245 -0.91 . . . . 0.0 109.227 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.0 tptm -75.61 -32.68 60.38 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.702 -0.624 . . . . 0.0 109.733 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.543 ' HE2' HD23 ' B' ' 193' ' ' LEU . 0.0 OUTLIER -67.23 -28.58 68.18 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.493 179.335 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -69.27 -29.45 67.35 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.653 -0.654 . . . . 0.0 109.47 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -61.22 -41.72 97.35 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.641 -0.662 . . . . 0.0 109.789 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -62.37 -37.83 87.22 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.727 -0.608 . . . . 0.0 109.641 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.486 HD23 ' HG ' ' A' ' 62' ' ' LEU . 7.2 tp -75.08 -30.67 61.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.683 -0.636 . . . . 0.0 109.527 179.298 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.751 ' HG2' HD11 ' A' ' 62' ' ' LEU . 1.8 tm-20 . . . . . 0 N--CA 1.493 1.716 0 O-C-N 121.708 -0.62 . . . . 0.0 109.688 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.55 ' HG ' HD23 ' B' ' 200' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 121.083 0.468 . . . . 0.0 110.163 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -70.4 -36.1 73.84 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.619 -0.676 . . . . 0.0 110.157 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -74.7 -34.58 62.64 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.63 -0.669 . . . . 0.0 109.773 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.412 HG22 HD11 ' A' ' 69' ' ' ILE . 88.2 m -74.55 -30.55 61.79 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.705 -0.622 . . . . 0.0 109.665 179.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.13 -27.19 62.46 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.669 -0.645 . . . . 0.0 110.012 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -72.1 -36.23 69.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.483 -0.76 . . . . 0.0 110.187 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -72.32 -39.81 67.93 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.641 -0.662 . . . . 0.0 109.717 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.863 HG12 HD23 ' B' ' 193' ' ' LEU . 46.3 mt -66.74 -27.64 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.45 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.49 -41.44 96.46 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.623 -0.673 . . . . 0.0 109.484 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -69.96 -29.62 66.78 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.587 -0.695 . . . . 0.0 109.633 179.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.852 HD12 HD22 ' B' ' 193' ' ' LEU . 3.6 mt -71.11 -28.38 64.27 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.726 -0.609 . . . . 0.0 109.917 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -75.84 -34.49 60.09 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.595 -0.691 . . . . 0.0 109.929 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -31.73 68.7 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 120.182 -0.607 . . . . 0.0 109.543 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -64.58 -33.42 75.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.733 -0.604 . . . . 0.0 109.743 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 20.2 tp -72.07 -28.77 63.54 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.637 -0.665 . . . . 0.0 109.953 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 mt -75.04 -34.89 61.93 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.667 -0.646 . . . . 0.0 109.924 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.48 -31.54 65.47 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.583 -0.698 . . . . 0.0 109.949 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.743 HD23 ' HA ' ' B' ' 183' ' ' ILE . 6.5 tp -75.06 -37.25 61.71 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.711 -0.618 . . . . 0.0 109.812 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -72.26 -30.42 64.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.601 -0.687 . . . . 0.0 109.563 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -69.18 -29.2 67.14 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.208 -0.597 . . . . 0.0 109.795 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.44 -45.13 76.94 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.549 -0.719 . . . . 0.0 109.826 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.4 tttm -62.92 -29.49 70.82 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.495 -0.753 . . . . 0.0 109.563 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -62.57 -32.87 73.92 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.675 -0.641 . . . . 0.0 109.784 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -65.88 -30.8 71.46 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.682 -0.636 . . . . 0.0 109.722 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.2 OUTLIER -67.62 -33.09 74.29 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.607 -0.683 . . . . 0.0 109.65 179.695 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -61.81 -35.69 78.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.541 -0.724 . . . . 0.0 109.89 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.7 mp -74.0 -30.29 62.4 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.735 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -85.04 -21.89 29.23 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.741 -0.599 . . . . 0.0 110.414 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.653 ' HA ' HD23 ' B' ' 172' ' ' LEU . 56.2 tp . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.574 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.33 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.937 HD21 HD13 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -141.32 -83.5 0.21 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.572 -0.958 . . . . 0.0 110.654 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.2 m -128.79 19.62 6.08 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.148 -0.97 . . . . 0.0 110.994 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.3 tptt 50.71 25.81 2.25 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.228 -0.92 . . . . 0.0 110.539 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -147.95 -46.38 0.16 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.714 -0.616 . . . . 0.0 109.394 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.575 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.0 mm-40 -68.69 -32.93 73.1 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 119.9 -0.72 . . . . 0.0 109.276 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.937 HD13 HD21 ' B' ' 167' ' ' LEU . 13.8 tp -77.5 -29.17 52.41 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 49.3 mm -65.92 -31.6 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.669 -0.644 . . . . 0.0 109.322 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -71.28 -29.65 65.31 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.753 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.793 ' O ' HG23 ' B' ' 179' ' ' VAL . 13.3 m120 -72.07 -42.35 66.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.636 -0.665 . . . . 0.0 109.772 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.57 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -65.82 -33.99 77.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.684 -0.635 . . . . 0.0 109.651 179.736 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.34 -30.22 57.55 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.643 -0.661 . . . . 0.0 109.807 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -77.19 -30.0 54.59 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.668 -0.645 . . . . 0.0 109.865 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.793 HG23 ' O ' ' B' ' 175' ' ' ASN . 72.2 t -75.83 -30.03 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.587 -0.696 . . . . 0.0 109.592 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -74.08 -29.7 61.99 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.681 -0.637 . . . . 0.0 109.966 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -73.55 -29.43 62.44 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.65 -0.656 . . . . 0.0 109.957 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -73.28 -38.06 66.05 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.568 -0.708 . . . . 0.0 109.949 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.743 ' HA ' HD23 ' A' ' 79' ' ' LEU . 90.2 mt -67.39 -30.0 47.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.633 -0.667 . . . . 0.0 109.634 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.3 m -66.07 -35.69 81.19 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.597 -0.689 . . . . 0.0 109.743 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -50.34 58.24 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.648 -0.658 . . . . 0.0 109.643 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.6 t -63.85 -31.9 54.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.601 -0.687 . . . . 0.0 109.314 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -65.52 -34.85 79.24 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.7 -0.625 . . . . 0.0 109.947 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -63.89 -29.98 71.11 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.642 -0.661 . . . . 0.0 109.824 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.15 -27.68 61.8 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.669 -0.644 . . . . 0.0 109.969 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.713 HD13 HD22 ' A' ' 72' ' ' LEU . 45.0 mm -75.72 -41.99 40.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.606 -0.684 . . . . 0.0 109.525 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 51.8 m -68.66 -29.19 67.61 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.704 -0.622 . . . . 0.0 109.699 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 54.0 mmtt -74.27 -42.81 59.0 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.615 -0.678 . . . . 0.0 109.807 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.863 HD23 HG12 ' A' ' 69' ' ' ILE . 0.0 OUTLIER -72.15 -31.09 65.65 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.471 -0.768 . . . . 0.0 109.283 179.351 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -70.26 -37.76 74.98 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.662 -0.649 . . . . 0.0 109.392 179.237 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.3 mmtt -70.08 -31.52 69.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.592 -0.692 . . . . 0.0 109.319 179.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -65.01 -34.24 77.97 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -64.41 -30.25 71.3 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.661 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.83 -43.16 99.41 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.703 -0.623 . . . . 0.0 109.804 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -62.59 -40.15 95.98 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.75 -0.594 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.55 HD23 ' HG ' ' A' ' 62' ' ' LEU . 5.4 tp -73.23 -32.39 64.72 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.69 -0.631 . . . . 0.0 109.687 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.555 -0.716 . . . . 0.0 109.836 179.601 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.565 HD22 ' CD2' ' B' ' 200' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 CA-C-O 121.025 0.441 . . . . 0.0 110.065 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -72.7 -34.67 67.3 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.586 -0.696 . . . . 0.0 110.232 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -75.04 -33.37 61.73 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.671 -0.643 . . . . 0.0 109.9 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.8 m -75.31 -30.37 60.33 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.633 -0.667 . . . . 0.0 109.631 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -73.04 -26.58 61.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.686 -0.634 . . . . 0.0 110.057 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -72.8 -32.48 65.58 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.528 -0.732 . . . . 0.0 110.179 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -76.05 -36.38 59.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.659 -0.65 . . . . 0.0 109.691 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.9 mt -70.67 -27.66 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.682 -0.636 . . . . 0.0 109.63 179.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.1 tt -68.43 -36.81 79.59 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.513 -0.742 . . . . 0.0 109.821 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -69.77 -30.09 67.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.64 -0.663 . . . . 0.0 109.843 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.782 HD22 HG12 ' B' ' 190' ' ' ILE . 9.2 mt -70.0 -28.57 65.62 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.702 -0.624 . . . . 0.0 110.028 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.517 ' O ' HD13 ' A' ' 77' ' ' LEU . 6.6 mt-10 -72.35 -32.1 66.19 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.596 -0.69 . . . . 0.0 110.03 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.43 -30.9 60.17 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.604 -0.685 . . . . 0.0 109.78 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.78 -32.5 62.06 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.71 -0.619 . . . . 0.0 109.785 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.717 HD13 ' O ' ' A' ' 76' ' ' LEU . 0.5 OUTLIER -74.94 -31.01 61.4 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.576 -0.702 . . . . 0.0 109.654 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.517 HD13 ' O ' ' A' ' 73' ' ' GLU . 1.1 mp -74.64 -35.29 62.88 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.625 -0.672 . . . . 0.0 109.812 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.37 -30.61 64.86 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.651 -0.655 . . . . 0.0 109.77 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.641 HD23 ' HA ' ' B' ' 183' ' ' ILE . 5.9 tp -73.66 -37.9 65.12 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.642 -0.661 . . . . 0.0 109.817 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 15.6 tp60 -70.46 -30.95 67.91 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.63 -0.668 . . . . 0.0 109.625 179.47 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.11 -30.13 69.22 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.62 -0.675 . . . . 0.0 109.742 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -66.01 -46.53 77.61 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.664 -0.647 . . . . 0.0 109.698 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.3 tttt -64.0 -28.98 70.17 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.502 -0.749 . . . . 0.0 109.443 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -63.83 -31.38 72.54 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.671 -0.643 . . . . 0.0 109.932 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -65.28 -31.25 72.3 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.508 -0.745 . . . . 0.0 109.704 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' B' ' 176' ' ' MET . 0.6 OUTLIER -68.24 -32.84 73.32 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.674 -0.641 . . . . 0.0 109.588 179.679 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -61.65 -35.18 77.21 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.638 -0.664 . . . . 0.0 109.898 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.3 tp -63.45 -29.63 70.88 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.587 -0.695 . . . . 0.0 109.768 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -94.97 -23.46 17.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.666 -0.646 . . . . 0.0 110.379 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.625 HD11 HD11 ' B' ' 173' ' ' ILE . 56.6 tp . . . . . 0 N--CA 1.502 2.147 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.74 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 166' ' ' GLY . . . . . 0.504 ' HA2' HD12 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.82 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.5 OUTLIER -109.46 -61.98 1.56 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.677 -0.896 . . . . 0.0 109.2 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 52.1 m -153.53 37.09 0.46 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.322 0.582 . . . . 0.0 109.498 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 169' ' ' LYS . . . . . 0.495 ' C ' HD13 ' B' ' 173' ' ' ILE . 28.0 tptt 52.44 26.62 4.31 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.606 -0.684 . . . . 0.0 110.346 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -153.72 -43.7 0.09 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.619 -0.675 . . . . 0.0 110.397 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.685 ' HB3' HD13 ' B' ' 167' ' ' LEU . 1.0 OUTLIER -61.77 -29.59 70.23 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.82 ' HG ' HD11 ' B' ' 167' ' ' LEU . 0.6 OUTLIER -85.53 -28.98 24.56 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.933 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.625 HD11 HD11 ' A' ' 90' ' ' LEU . 2.7 mp -76.83 -30.97 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -66.0 -34.6 78.48 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -78.0 -32.57 51.25 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 178.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.466 ' O ' HG12 ' B' ' 179' ' ' VAL . 0.0 OUTLIER -69.31 -29.98 67.94 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 120.184 -0.606 . . . . 0.0 109.526 179.341 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -74.12 -27.48 60.89 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.598 -0.689 . . . . 0.0 110.006 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.2 -41.07 58.6 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.549 -0.719 . . . . 0.0 109.967 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.466 HG12 ' O ' ' B' ' 176' ' ' MET . 10.5 p -70.33 -26.96 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.606 -0.684 . . . . 0.0 109.999 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -76.04 -29.08 57.93 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.519 -0.738 . . . . 0.0 109.961 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 5.6 mtp-105 -73.42 -29.35 62.52 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.653 -0.654 . . . . 0.0 110.05 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -72.56 -36.97 68.35 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.573 -0.704 . . . . 0.0 109.9 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.641 ' HA ' HD23 ' A' ' 79' ' ' LEU . 88.3 mt -66.38 -28.63 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.652 -0.655 . . . . 0.0 109.664 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.4 m -65.43 -30.95 71.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.598 -0.689 . . . . 0.0 109.677 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -42.97 61.22 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.783 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.5 t -71.78 -31.23 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.645 -0.659 . . . . 0.0 109.46 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.9 -29.06 60.88 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.648 -0.658 . . . . 0.0 109.836 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -72.87 -29.64 63.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.707 -0.62 . . . . 0.0 109.999 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -73.26 -36.45 66.36 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.597 -0.689 . . . . 0.0 109.842 179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.782 HG12 HD22 ' A' ' 72' ' ' LEU . 78.0 mt -71.49 -31.35 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.674 -0.641 . . . . 0.0 109.584 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 44.8 m -69.95 -37.62 75.88 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.682 -0.636 . . . . 0.0 109.65 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -71.59 -37.42 71.0 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.614 -0.679 . . . . 0.0 109.495 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.575 HD13 HD11 ' A' ' 72' ' ' LEU . 0.3 OUTLIER -75.38 -11.85 60.13 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.731 -0.606 . . . . 0.0 110.601 179.53 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.55 -28.56 19.52 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.17 -0.956 . . . . 0.0 109.41 179.264 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -32.19 55.68 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.665 -0.647 . . . . 0.0 109.89 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.481 ' HE3' HD23 ' B' ' 193' ' ' LEU . 0.0 OUTLIER -71.96 -28.25 63.32 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.49 -0.756 . . . . 0.0 109.652 179.483 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 197' ' ' GLN . . . . . 0.506 ' OE1' HD11 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -68.13 -30.54 69.71 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.642 -0.661 . . . . 0.0 109.657 179.525 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -62.65 -44.17 96.95 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.757 -0.589 . . . . 0.0 109.951 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -61.36 -40.63 95.0 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.045 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.565 ' CD2' HD22 ' A' ' 62' ' ' LEU . 29.1 tp -70.38 -40.98 73.65 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.607 -0.683 . . . . 0.0 109.746 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.494 1.768 0 O-C-N 121.653 -0.654 . . . . 0.0 109.637 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.656 HD11 ' CG ' ' B' ' 201' ' ' GLU . 1.2 tt . . . . . 0 N--CA 1.495 1.814 0 CA-C-O 121.078 0.466 . . . . 0.0 110.03 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -70.4 -36.03 73.82 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.608 -0.683 . . . . 0.0 109.981 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.53 -30.67 61.86 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.618 -0.676 . . . . 0.0 109.788 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 83.4 m -73.71 -30.62 62.95 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.655 -0.653 . . . . 0.0 109.587 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -69.81 -28.88 66.09 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.604 -0.685 . . . . 0.0 110.06 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -70.89 -33.22 70.36 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.57 -0.706 . . . . 0.0 110.155 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -72.43 -34.87 68.13 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.674 -0.641 . . . . 0.0 109.941 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.3 mt -68.43 -27.58 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.664 -0.647 . . . . 0.0 109.787 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.471 ' O ' HD23 ' A' ' 70' ' ' LEU . 4.8 tt -69.88 -44.31 70.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.553 -0.717 . . . . 0.0 109.783 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -65.11 -30.9 71.88 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.598 -0.689 . . . . 0.0 109.668 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.842 ' CD1' HD13 ' B' ' 193' ' ' LEU . 1.6 mt -66.54 -29.42 69.49 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.634 -0.666 . . . . 0.0 109.978 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -68.46 -45.8 71.49 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.604 -0.685 . . . . 0.0 110.029 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -63.93 -31.08 72.14 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.662 -0.649 . . . . 0.0 109.593 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.1 tttm -64.37 -35.19 80.07 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.635 -0.665 . . . . 0.0 109.913 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.9 tp -66.18 -33.75 76.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.626 -0.671 . . . . 0.0 109.824 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 mt -73.09 -37.9 66.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.728 -0.607 . . . . 0.0 109.552 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.33 -28.44 68.67 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.701 -0.624 . . . . 0.0 109.884 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.803 HD12 HG12 ' B' ' 183' ' ' ILE . 0.2 OUTLIER -69.07 -43.57 74.31 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.651 -0.655 . . . . 0.0 109.883 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -66.17 -32.81 74.46 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.62 -0.675 . . . . 0.0 109.713 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.9 -28.55 69.03 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.747 -0.596 . . . . 0.0 109.755 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.5 -44.39 94.47 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.664 -0.647 . . . . 0.0 109.735 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -65.81 -29.91 70.46 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.602 -0.686 . . . . 0.0 109.752 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -67.95 -34.17 76.06 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.578 -0.701 . . . . 0.0 109.903 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -68.9 -46.59 67.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.648 -0.658 . . . . 0.0 109.705 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.599 HD22 ' CG ' ' B' ' 176' ' ' MET . 0.2 OUTLIER -62.11 -29.58 70.43 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.658 -0.651 . . . . 0.0 109.832 179.528 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.405 ' HA ' ' HE1' ' B' ' 176' ' ' MET . 0.4 OUTLIER -66.16 -34.15 77.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.62 -0.675 . . . . 0.0 109.822 179.856 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.73 -30.4 71.5 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.6 -0.688 . . . . 0.0 109.858 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -85.26 -17.66 36.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.676 -0.64 . . . . 0.0 110.673 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.698 HD11 HD11 ' B' ' 173' ' ' ILE . 49.4 tp . . . . . 0 N--CA 1.5 2.058 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.743 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.775 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.5 OUTLIER -108.15 -61.71 1.55 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.541 -0.976 . . . . 0.0 109.165 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 88.5 p -154.5 37.3 0.42 Allowed 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 169' ' ' LYS . . . . . 0.477 ' C ' HD13 ' B' ' 173' ' ' ILE . 36.7 tptt 52.15 26.31 3.81 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.548 -0.72 . . . . 0.0 110.363 -179.255 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -152.86 -43.9 0.1 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.616 -0.678 . . . . 0.0 110.291 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.699 ' HB3' HD22 ' B' ' 167' ' ' LEU . 1.2 tt0 -61.85 -29.24 70.05 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 119.753 -0.779 . . . . 0.0 109.666 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.775 ' HG ' HD11 ' B' ' 167' ' ' LEU . 0.6 OUTLIER -85.21 -29.09 24.97 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.603 -0.685 . . . . 0.0 109.168 178.979 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.698 HD11 HD11 ' A' ' 90' ' ' LEU . 2.9 mp -78.38 -31.7 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.307 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -67.58 -33.88 75.91 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.784 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.3 m-20 -78.89 -32.32 45.77 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.599 ' CG ' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -71.78 -30.02 65.1 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.734 -0.604 . . . . 0.0 109.638 179.291 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.27 -33.49 61.27 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.57 -0.707 . . . . 0.0 109.827 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -71.67 -29.03 64.16 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.651 -0.656 . . . . 0.0 109.895 179.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.784 HG23 ' O ' ' B' ' 175' ' ' ASN . 64.6 t -69.51 -32.7 53.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.616 -0.677 . . . . 0.0 109.612 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -63.73 -37.26 86.71 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.666 -0.646 . . . . 0.0 109.81 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 5.7 mtp-105 -69.94 -29.4 66.54 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.748 -0.595 . . . . 0.0 109.722 179.611 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 182' ' ' GLU . . . . . 0.534 ' O ' HG23 ' B' ' 186' ' ' VAL . 5.7 tt0 -69.85 -32.35 70.7 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.676 -0.64 . . . . 0.0 109.869 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.803 HG12 HD12 ' A' ' 79' ' ' LEU . 86.6 mt -72.4 -33.17 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.676 -0.64 . . . . 0.0 109.616 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 58.9 m -71.96 -33.23 68.02 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.692 -0.63 . . . . 0.0 109.649 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.74 -41.46 71.78 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.644 -0.66 . . . . 0.0 109.602 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 186' ' ' VAL . . . . . 0.534 HG23 ' O ' ' B' ' 182' ' ' GLU . 63.2 t -68.28 -37.76 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 119.995 -0.682 . . . . 0.0 109.246 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.4 -33.57 75.83 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.805 -0.559 . . . . 0.0 109.893 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -66.75 -29.91 70.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.648 -0.658 . . . . 0.0 109.858 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -72.91 -21.55 60.88 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.594 -0.691 . . . . 0.0 110.371 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.774 HD13 HD22 ' A' ' 72' ' ' LEU . 35.3 mm -79.55 -39.04 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.413 -0.804 . . . . 0.0 109.603 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.27 -30.2 64.61 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.623 -0.673 . . . . 0.0 109.734 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 13.8 mmtm -75.28 -36.15 61.23 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.692 -0.63 . . . . 0.0 109.85 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.842 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -74.08 -21.47 59.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.579 -0.7 . . . . 0.0 110.242 179.696 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.6 tptt -80.45 -28.59 37.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 109.575 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 14.9 tptt -74.26 -40.05 62.6 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.638 -0.664 . . . . 0.0 109.76 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.529 ' HE3' HD23 ' B' ' 193' ' ' LEU . 2.6 pttp -64.64 -26.11 68.25 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.532 -0.73 . . . . 0.0 109.639 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -69.81 -30.64 68.21 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.513 -0.742 . . . . 0.0 109.569 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -43.59 98.48 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.684 -0.635 . . . . 0.0 109.764 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -61.71 -31.18 71.32 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.777 -0.577 . . . . 0.0 109.66 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.57 HD23 ' HG ' ' A' ' 62' ' ' LEU . 3.9 tp -77.41 -38.16 50.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.69 -0.631 . . . . 0.0 109.534 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.656 ' CG ' HD11 ' A' ' 62' ' ' LEU . 28.6 mt-10 . . . . . 0 N--CA 1.493 1.687 0 O-C-N 121.687 -0.633 . . . . 0.0 109.598 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.587 HD11 ' CG ' ' B' ' 201' ' ' GLU . 5.1 tt . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 121.059 0.456 . . . . 0.0 109.911 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -63.95 -42.77 97.2 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.686 -0.634 . . . . 0.0 109.986 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -72.02 -30.77 65.54 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.72 -0.612 . . . . 0.0 109.636 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 66.7 m -73.59 -28.43 61.83 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.793 -0.567 . . . . 0.0 109.793 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.4 mmtp -72.06 -26.47 62.19 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.489 -0.757 . . . . 0.0 110.382 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -74.94 -31.85 61.6 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.542 -0.724 . . . . 0.0 110.433 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -76.23 -34.4 59.22 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.63 -0.669 . . . . 0.0 109.785 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.768 HG12 HD22 ' B' ' 193' ' ' LEU . 69.3 mt -71.5 -26.13 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.653 -0.655 . . . . 0.0 109.679 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.402 ' O ' HD23 ' A' ' 70' ' ' LEU . 1.6 tt -71.12 -40.77 71.25 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.477 -0.765 . . . . 0.0 109.929 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.5 tppt? -62.62 -31.07 71.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.557 -0.715 . . . . 0.0 109.69 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.8 HD22 HG12 ' B' ' 190' ' ' ILE . 11.3 mt -62.67 -29.6 70.77 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.714 -0.616 . . . . 0.0 109.915 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -66.58 -39.28 88.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.625 -0.672 . . . . 0.0 109.847 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.03 -30.23 63.59 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.654 -0.654 . . . . 0.0 109.53 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -29.72 63.98 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.678 -0.639 . . . . 0.0 109.908 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.454 HD13 HD12 ' B' ' 190' ' ' ILE . 25.9 tp -74.1 -33.67 63.68 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.63 -0.669 . . . . 0.0 109.899 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.8 mt -74.32 -33.1 63.08 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.666 -0.646 . . . . 0.0 109.632 179.58 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.88 -29.21 66.36 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.725 -0.609 . . . . 0.0 109.706 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.64 -42.75 77.56 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.655 -0.653 . . . . 0.0 109.79 179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -65.73 -29.05 69.52 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.468 -0.77 . . . . 0.0 109.876 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.0 tm-20 -68.41 -28.24 66.91 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.646 -0.659 . . . . 0.0 110.044 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -70.23 -45.76 65.86 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.557 -0.714 . . . . 0.0 109.87 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.1 tttm -63.7 -29.56 70.77 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.509 -0.744 . . . . 0.0 109.945 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -67.38 -29.3 68.78 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.59 -0.694 . . . . 0.0 109.943 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -36.15 83.18 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.533 -0.729 . . . . 0.0 109.945 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.485 HD23 HD21 ' B' ' 172' ' ' LEU . 1.4 mt -64.29 -34.36 77.96 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.638 -0.664 . . . . 0.0 109.992 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -65.59 -26.49 67.87 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.619 -0.676 . . . . 0.0 110.332 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.8 -28.24 64.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.575 -0.703 . . . . 0.0 110.267 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -117.29 26.19 9.93 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.557 -0.714 . . . . 0.0 110.467 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.526 HD11 ' CD1' ' B' ' 173' ' ' ILE . 49.8 tp . . . . . 0 N--CA 1.498 1.943 0 CA-C-O 117.957 -1.02 . . . . 0.0 110.171 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.378 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.739 HD12 ' N ' ' B' ' 168' ' ' SER . 2.5 pp -139.85 -46.35 0.44 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.67 -0.9 . . . . 0.0 110.637 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.739 ' N ' HD12 ' B' ' 167' ' ' LEU . 33.9 p -153.46 14.56 0.5 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.31 -0.868 . . . . 0.0 111.499 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 9.5 tptm 49.53 26.37 1.7 Allowed 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.012 -1.055 . . . . 0.0 111.051 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -152.92 -46.83 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.665 -0.647 . . . . 0.0 110.047 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.456 ' CB ' HD11 ' B' ' 167' ' ' LEU . 1.0 OUTLIER -73.58 -36.73 65.59 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 179.427 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.485 HD21 HD23 ' A' ' 86' ' ' LEU . 1.0 OUTLIER -74.09 -28.05 61.19 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.818 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.526 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.3 mm -67.54 -31.04 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.694 -0.629 . . . . 0.0 109.385 179.397 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -72.38 -29.09 63.44 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.681 -0.637 . . . . 0.0 109.916 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -72.55 -32.17 65.85 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.621 -0.674 . . . . 0.0 110.026 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.464 ' CE ' HD13 ' A' ' 90' ' ' LEU . 1.3 mtt -70.37 -30.19 67.05 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.695 -0.628 . . . . 0.0 109.888 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -69.39 -30.87 68.94 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.644 -0.66 . . . . 0.0 109.863 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.13 -45.48 66.76 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.701 -0.625 . . . . 0.0 109.695 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.419 HG21 ' CD1' ' A' ' 86' ' ' LEU . 58.5 t -61.96 -30.45 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.827 -0.545 . . . . 0.0 109.773 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -67.85 -31.73 71.75 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.658 -0.651 . . . . 0.0 109.863 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.19 -30.39 63.5 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.698 -0.626 . . . . 0.0 109.715 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 182' ' ' GLU . . . . . 0.604 ' O ' HG23 ' B' ' 186' ' ' VAL . 13.3 tt0 -70.89 -34.69 71.82 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.664 -0.647 . . . . 0.0 109.815 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.5 mt -73.66 -30.6 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.721 -0.612 . . . . 0.0 109.654 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 53.1 m -73.31 -34.76 65.88 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.674 -0.641 . . . . 0.0 109.626 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 tpp -72.13 -39.18 69.02 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.605 -0.685 . . . . 0.0 109.677 179.601 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 186' ' ' VAL . . . . . 0.604 HG23 ' O ' ' B' ' 182' ' ' GLU . 64.8 t -70.89 -32.07 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.641 -0.662 . . . . 0.0 109.423 179.595 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -70.77 -30.01 66.39 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.684 -0.635 . . . . 0.0 109.894 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -73.71 -30.2 62.72 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.694 -0.629 . . . . 0.0 109.871 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -37.11 68.56 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.688 -0.632 . . . . 0.0 109.8 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.8 HG12 HD22 ' A' ' 72' ' ' LEU . 77.3 mt -72.95 -31.29 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.666 -0.646 . . . . 0.0 109.607 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.57 -34.7 65.26 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.656 -0.653 . . . . 0.0 109.662 179.428 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -73.1 -38.56 66.31 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.655 -0.653 . . . . 0.0 109.536 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.768 HD22 HG12 ' A' ' 69' ' ' ILE . 0.3 OUTLIER -67.34 -32.23 73.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.668 -0.645 . . . . 0.0 109.351 179.316 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -66.76 -47.23 72.86 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.66 -0.65 . . . . 0.0 109.387 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -64.21 -31.09 72.16 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 120.051 -0.66 . . . . 0.0 109.244 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.658 ' HE2' HD23 ' B' ' 193' ' ' LEU . 19.0 ttpt -62.79 -37.22 85.82 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.691 -0.631 . . . . 0.0 109.418 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 197' ' ' GLN . . . . . 0.405 HE22 HD12 ' A' ' 69' ' ' ILE . 5.5 tt0 -63.12 -30.16 71.37 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.722 -0.611 . . . . 0.0 109.66 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -61.04 -40.96 95.61 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.605 -0.685 . . . . 0.0 109.882 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -64.04 -36.43 83.97 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.753 -0.592 . . . . 0.0 109.644 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' B' ' 200' ' ' LEU . 14.0 tp -75.68 -31.02 59.55 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.658 -0.651 . . . . 0.0 109.632 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.587 ' CG ' HD11 ' A' ' 62' ' ' LEU . 14.9 mt-10 . . . . . 0 N--CA 1.493 1.717 0 O-C-N 121.638 -0.664 . . . . 0.0 109.723 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.831 HD12 HD23 ' B' ' 200' ' ' LEU . 4.5 tp . . . . . 0 N--CA 1.496 1.863 0 CA-C-O 121.043 0.449 . . . . 0.0 110.087 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.71 -29.83 69.19 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.583 -0.698 . . . . 0.0 110.119 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -70.5 -46.13 64.3 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.623 -0.673 . . . . 0.0 109.886 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 21.0 m -62.93 -31.12 72.13 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.731 -0.606 . . . . 0.0 109.724 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -65.02 -28.27 69.38 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.628 -0.67 . . . . 0.0 109.93 179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -62.57 -39.75 94.68 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.609 -0.682 . . . . 0.0 110.104 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.4 tp60 -75.41 -30.69 60.15 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.6 -0.687 . . . . 0.0 109.632 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.418 HG12 HD22 ' B' ' 193' ' ' LEU . 73.7 mt -77.37 -27.04 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.785 -0.572 . . . . 0.0 109.712 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.1 mt -75.37 -32.69 60.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.458 -0.776 . . . . 0.0 109.826 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -31.62 70.41 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.567 -0.708 . . . . 0.0 109.822 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.672 HD22 HG12 ' B' ' 190' ' ' ILE . 5.3 mt -69.73 -28.96 66.25 Favored 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.898 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.28 -33.11 73.75 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.6 -0.688 . . . . 0.0 110.003 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -76.48 -33.23 58.68 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.557 -0.715 . . . . 0.0 109.71 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.8 tttt -75.35 -29.93 60.07 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.705 -0.622 . . . . 0.0 109.807 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.638 HD13 HD12 ' B' ' 190' ' ' ILE . 15.7 tp -77.22 -31.03 54.94 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.671 -0.643 . . . . 0.0 109.798 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mp -76.34 -33.57 58.97 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.642 -0.661 . . . . 0.0 109.634 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.92 -29.3 63.02 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.696 -0.627 . . . . 0.0 109.994 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.738 HD23 ' HA ' ' B' ' 183' ' ' ILE . 8.8 tp -75.14 -38.39 61.01 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.592 -0.693 . . . . 0.0 109.922 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.451 ' HG2' HG21 ' B' ' 183' ' ' ILE . 4.3 mm-40 -71.23 -29.69 65.43 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.734 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -69.99 -28.98 65.96 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.688 -0.632 . . . . 0.0 109.861 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -67.61 -43.04 81.42 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.522 -0.736 . . . . 0.0 109.863 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -62.3 -28.46 69.75 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.559 -0.713 . . . . 0.0 109.779 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -62.95 -31.86 73.05 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.619 -0.676 . . . . 0.0 109.875 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -40.04 94.61 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.675 -0.64 . . . . 0.0 109.9 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.702 HD23 HD21 ' B' ' 172' ' ' LEU . 2.9 mt -60.81 -35.5 76.65 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.629 -0.67 . . . . 0.0 110.127 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -61.3 -36.89 81.33 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.517 -0.739 . . . . 0.0 109.968 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mp -77.05 -29.17 55.06 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.703 -0.623 . . . . 0.0 109.684 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -95.18 -0.22 53.45 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.65 -0.656 . . . . 0.0 110.965 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.594 HD11 ' CD1' ' B' ' 173' ' ' ILE . 49.5 tp . . . . . 0 N--CA 1.498 1.964 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.245 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.559 HD12 ' N ' ' B' ' 168' ' ' SER . 1.3 pp -139.03 -48.73 0.5 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.624 -0.927 . . . . 0.0 110.753 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.559 ' N ' HD12 ' B' ' 167' ' ' LEU . 4.0 m -155.22 13.55 0.37 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.261 -0.9 . . . . 0.0 111.752 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 15.1 tptt 49.34 26.28 1.54 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.999 -1.063 . . . . 0.0 111.066 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -151.86 -47.26 0.11 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.684 -0.635 . . . . 0.0 109.829 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.38 -33.5 63.08 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.702 HD21 HD23 ' A' ' 86' ' ' LEU . 1.6 tt -75.56 -26.66 58.15 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.594 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.7 mm -69.4 -30.65 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.561 -0.712 . . . . 0.0 109.523 179.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -73.11 -28.57 62.34 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.714 -0.616 . . . . 0.0 110.15 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.709 ' O ' HG23 ' B' ' 179' ' ' VAL . 86.9 m-20 -74.86 -29.22 60.96 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.6 -0.687 . . . . 0.0 110.079 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -73.4 -29.96 62.95 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.581 -0.699 . . . . 0.0 109.921 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -77.25 -29.98 54.25 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.609 -0.682 . . . . 0.0 109.94 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.49 -31.13 47.63 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.646 -0.659 . . . . 0.0 109.787 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.709 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.0 t -77.96 -31.06 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.633 -0.667 . . . . 0.0 109.521 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -76.31 -29.0 57.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.654 -0.654 . . . . 0.0 109.811 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.38 -29.09 61.4 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.654 -0.654 . . . . 0.0 109.715 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -71.55 -31.4 66.97 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.579 -0.701 . . . . 0.0 110.039 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.738 ' HA ' HD23 ' A' ' 79' ' ' LEU . 83.9 mt -72.62 -29.64 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.628 -0.67 . . . . 0.0 109.706 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.4 -33.13 72.56 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.619 -0.675 . . . . 0.0 109.853 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 49.0 mtp -71.49 -45.76 61.61 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.589 -0.694 . . . . 0.0 109.768 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.1 t -71.57 -31.5 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.648 -0.658 . . . . 0.0 109.383 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 187' ' ' GLU . . . . . 0.457 ' HB2' HD11 ' A' ' 76' ' ' LEU . 10.7 tm-20 -74.51 -28.8 61.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.73 -0.606 . . . . 0.0 109.782 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -72.62 -29.72 63.72 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.558 -0.714 . . . . 0.0 110.044 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -36.43 65.71 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.683 -0.635 . . . . 0.0 109.935 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.672 HG12 HD22 ' A' ' 72' ' ' LEU . 75.6 mt -71.29 -31.05 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.639 -0.663 . . . . 0.0 109.573 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 3.2 m -67.77 -37.59 82.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.704 -0.623 . . . . 0.0 109.541 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -74.94 -32.46 61.76 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.622 -0.674 . . . . 0.0 109.4 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.477 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -71.39 -31.56 67.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.631 -0.668 . . . . 0.0 109.295 179.259 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 11.9 tptm -68.81 -46.3 69.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.629 -0.669 . . . . 0.0 109.407 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.67 -29.67 70.67 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 119.967 -0.693 . . . . 0.0 109.151 179.12 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -62.52 -36.55 82.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.604 -0.685 . . . . 0.0 109.208 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.15 -31.16 72.24 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -58.93 -42.78 90.54 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.684 -0.635 . . . . 0.0 109.986 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.64 -39.46 93.92 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.737 -0.602 . . . . 0.0 109.596 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.831 HD23 HD12 ' A' ' 62' ' ' LEU . 15.1 tp -74.41 -28.54 61.13 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.676 -0.64 . . . . 0.0 109.666 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.544 -0.723 . . . . 0.0 109.906 179.693 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.542 HD12 HD23 ' B' ' 200' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 121.069 0.461 . . . . 0.0 109.999 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -73.86 -33.1 63.95 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.63 -0.669 . . . . 0.0 109.932 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -74.45 -38.82 62.87 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.66 -0.65 . . . . 0.0 109.752 179.648 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 58.5 m -71.85 -32.62 67.7 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.723 -0.611 . . . . 0.0 109.434 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -68.14 -29.45 68.36 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.581 179.406 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -63.0 -36.86 84.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.611 -0.681 . . . . 0.0 109.827 179.668 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -75.48 -34.69 60.91 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.466 179.501 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.432 HG12 HD22 ' B' ' 193' ' ' LEU . 83.1 mt -72.12 -28.57 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.734 -0.604 . . . . 0.0 109.397 179.274 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.8 tp -69.21 -40.45 78.0 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.589 -0.694 . . . . 0.0 109.748 179.583 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.23 -31.89 73.15 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.533 -0.729 . . . . 0.0 109.696 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.794 HD22 HG12 ' B' ' 190' ' ' ILE . 6.4 mt -69.69 -30.37 68.01 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.685 -0.634 . . . . 0.0 109.773 179.575 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -69.49 -34.24 74.05 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.598 -0.689 . . . . 0.0 109.758 179.631 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -75.25 -31.7 60.88 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.695 -0.628 . . . . 0.0 109.508 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.15 -30.53 66.57 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.523 179.546 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -74.05 -31.3 62.82 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.61 -0.681 . . . . 0.0 109.714 179.605 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 tp -73.26 -37.85 66.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.673 -0.642 . . . . 0.0 109.693 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.36 -30.9 70.83 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.602 179.483 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.619 HD12 HG12 ' B' ' 183' ' ' ILE . 0.5 OUTLIER -70.76 -46.31 63.19 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.676 -0.64 . . . . 0.0 109.639 179.529 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -66.18 -29.3 69.56 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.661 -0.649 . . . . 0.0 109.644 179.453 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -68.95 -30.27 68.68 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.661 -0.649 . . . . 0.0 109.788 179.662 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -69.93 -47.05 63.93 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.668 -0.645 . . . . 0.0 109.808 179.692 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.4 tttt -62.28 -29.87 70.73 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.522 -0.736 . . . . 0.0 109.603 179.441 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -62.98 -31.83 73.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.662 -0.649 . . . . 0.0 109.743 179.561 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -67.2 -32.09 72.92 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.661 -0.649 . . . . 0.0 109.744 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.543 HD23 ' CD2' ' B' ' 172' ' ' LEU . 0.5 OUTLIER -67.57 -31.62 71.82 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.6 -0.687 . . . . 0.0 109.755 179.687 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -62.36 -35.45 79.18 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.615 -0.678 . . . . 0.0 109.88 179.659 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.44 -30.5 64.65 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.671 -0.643 . . . . 0.0 109.696 179.569 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.471 ' O ' HD13 ' B' ' 172' ' ' LEU . 18.8 mt-30 -88.72 -18.51 27.69 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.647 -0.658 . . . . 0.0 110.519 179.649 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.603 HD11 HD11 ' B' ' 173' ' ' ILE . 32.8 tp . . . . . 0 N--CA 1.501 2.097 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.646 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 166' ' ' GLY . . . . . 0.557 ' HA2' HD12 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.34 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' B' ' 171' ' ' GLU . 0.4 OUTLIER -109.96 -62.51 1.5 Allowed 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.63 -0.923 . . . . 0.0 109.088 179.975 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 6.2 t -154.41 35.99 0.42 Allowed 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.315 0.579 . . . . 0.0 109.528 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 5.9 tptm 51.87 26.07 3.39 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.524 -0.735 . . . . 0.0 110.118 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -147.61 -45.39 0.17 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.707 -0.621 . . . . 0.0 109.962 -179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.696 ' HB3' HD22 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -64.68 -30.27 71.28 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 119.618 -0.833 . . . . 0.0 109.2 179.39 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.557 HD12 ' HA2' ' B' ' 166' ' ' GLY . 0.3 OUTLIER -81.65 -27.53 34.06 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.63 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.603 HD11 HD11 ' A' ' 90' ' ' LEU . 49.9 mm -69.93 -30.82 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.753 -0.592 . . . . 0.0 109.498 179.428 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.95 -30.31 66.56 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.636 -0.665 . . . . 0.0 109.946 179.77 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.77 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.6 m-20 -76.83 -29.25 55.84 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.623 -0.673 . . . . 0.0 109.871 179.59 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.449 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -75.63 -28.31 58.76 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.653 -0.654 . . . . 0.0 110.056 179.761 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.75 -32.22 57.61 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.583 -0.698 . . . . 0.0 110.057 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -75.22 -29.99 60.46 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.611 -0.681 . . . . 0.0 109.889 179.711 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.77 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.9 t -73.75 -29.43 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.646 -0.659 . . . . 0.0 109.717 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.42 -29.21 65.76 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.558 -0.714 . . . . 0.0 110.029 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 -74.36 -28.9 61.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.602 -0.686 . . . . 0.0 110.118 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 182' ' ' GLU . . . . . 0.436 ' O ' HG23 ' B' ' 186' ' ' VAL . 9.0 tt0 -75.73 -34.34 60.32 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.533 -0.73 . . . . 0.0 110.155 179.954 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.619 HG12 HD12 ' A' ' 79' ' ' LEU . 83.4 mt -74.0 -29.07 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.628 -0.67 . . . . 0.0 109.768 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.6 m -73.92 -33.92 64.15 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.613 -0.68 . . . . 0.0 109.714 179.549 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.28 -39.2 78.52 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.664 -0.648 . . . . 0.0 109.77 179.662 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 186' ' ' VAL . . . . . 0.436 HG23 ' O ' ' B' ' 182' ' ' GLU . 57.6 t -70.66 -29.89 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.673 -0.642 . . . . 0.0 109.598 179.612 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -71.17 -28.63 64.38 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.603 -0.685 . . . . 0.0 110.07 179.724 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -69.72 -33.96 73.22 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.562 -0.711 . . . . 0.0 109.995 179.908 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -37.93 62.17 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.64 -0.663 . . . . 0.0 109.702 179.74 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.794 HG12 HD22 ' A' ' 72' ' ' LEU . 78.7 mt -73.29 -28.91 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.659 -0.651 . . . . 0.0 109.683 179.629 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 23.5 p -73.39 -34.76 65.7 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.571 -0.706 . . . . 0.0 109.759 179.504 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -77.36 -33.02 55.38 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.611 -0.681 . . . . 0.0 109.473 179.399 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.584 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -74.4 -30.42 61.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.712 -0.617 . . . . 0.0 109.387 179.353 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.0 tptm -68.42 -36.57 79.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.595 -0.691 . . . . 0.0 109.528 179.483 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 8.5 tptp -68.49 -30.25 69.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.663 -0.648 . . . . 0.0 109.547 179.414 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -35.63 81.24 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.612 -0.68 . . . . 0.0 109.484 179.525 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -63.4 -30.74 71.82 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.747 -0.596 . . . . 0.0 109.8 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.97 -41.73 98.34 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.71 -0.619 . . . . 0.0 109.91 179.71 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -61.99 -45.76 92.2 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.741 -0.599 . . . . 0.0 109.969 179.756 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.542 HD23 HD12 ' A' ' 62' ' ' LEU . 4.4 tp -70.32 -32.84 70.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.621 -0.674 . . . . 0.0 109.716 179.586 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 . . . . . 0 N--CA 1.494 1.726 0 O-C-N 121.678 -0.639 . . . . 0.0 109.895 179.619 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.541 HD11 ' HA ' ' B' ' 201' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.07 0.462 . . . . 0.0 110.113 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -72.94 -33.15 65.75 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.578 -0.701 . . . . 0.0 110.1 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -75.84 -30.03 58.8 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.653 -0.654 . . . . 0.0 109.908 179.762 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.487 HG23 ' NZ ' ' B' ' 196' ' ' LYS . 88.2 m -75.84 -29.59 58.67 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.654 -0.654 . . . . 0.0 109.875 179.621 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -73.83 -26.7 60.73 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.575 -0.703 . . . . 0.0 110.162 179.68 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.86 -33.28 62.08 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.597 -0.689 . . . . 0.0 110.133 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -76.38 -37.29 57.41 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.661 -0.649 . . . . 0.0 109.698 179.727 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.694 HG12 HD23 ' B' ' 193' ' ' LEU . 84.3 mt -72.6 -26.82 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.719 -0.613 . . . . 0.0 109.62 179.399 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.5 mt -72.91 -36.51 67.29 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.541 -0.724 . . . . 0.0 109.734 179.587 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -71.18 -31.06 67.2 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.611 -0.68 . . . . 0.0 109.718 179.605 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.41 HD22 HG12 ' B' ' 190' ' ' ILE . 5.0 mt -69.37 -30.57 68.59 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.774 -0.579 . . . . 0.0 109.831 179.667 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -69.21 -31.32 69.84 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.602 -0.686 . . . . 0.0 109.847 179.843 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.52 -32.73 54.26 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.603 -0.686 . . . . 0.0 109.626 179.583 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -76.06 -33.19 59.58 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.695 -0.628 . . . . 0.0 109.58 179.581 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.487 HD21 ' HG3' ' B' ' 187' ' ' GLU . 14.7 tp -74.96 -30.16 61.13 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.676 -0.64 . . . . 0.0 109.734 179.549 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.46 HD23 ' O ' ' A' ' 77' ' ' LEU . 2.8 tt -75.43 -36.2 60.82 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.667 -0.646 . . . . 0.0 109.71 179.562 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.72 -30.72 67.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.677 -0.639 . . . . 0.0 109.735 179.558 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.776 HD23 ' HA ' ' B' ' 183' ' ' ILE . 7.2 tp -69.32 -37.27 77.66 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.696 -0.628 . . . . 0.0 109.709 179.619 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -71.65 -30.09 65.35 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.598 -0.689 . . . . 0.0 109.639 179.359 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.52 -29.91 67.63 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.578 -0.701 . . . . 0.0 109.855 179.555 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.62 -42.8 81.76 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.634 -0.666 . . . . 0.0 109.885 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.53 ' HD3' HD12 ' B' ' 183' ' ' ILE . 3.3 ttpp -62.03 -29.61 70.4 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.555 -0.716 . . . . 0.0 109.769 179.596 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -62.48 -32.17 73.02 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.737 -0.602 . . . . 0.0 109.874 179.713 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -68.75 -37.7 79.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.639 -0.663 . . . . 0.0 109.714 179.68 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.701 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.3 OUTLIER -64.08 -30.08 71.17 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.678 -0.639 . . . . 0.0 109.711 179.668 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -62.47 -36.1 81.41 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.626 -0.671 . . . . 0.0 109.824 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.72 -28.86 69.72 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.638 -0.664 . . . . 0.0 110.007 179.703 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -87.68 -23.98 24.03 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.542 -0.723 . . . . 0.0 110.418 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.574 HD13 ' HE3' ' B' ' 176' ' ' MET . 29.4 tp . . . . . 0 N--CA 1.5 2.034 0 CA-C-O 118.018 -0.991 . . . . 0.0 110.575 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.8 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.4 OUTLIER -109.07 -61.98 1.54 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.561 -0.964 . . . . 0.0 109.01 179.897 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 93.7 p -155.27 35.41 0.38 Allowed 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 121.381 0.61 . . . . 0.0 109.451 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 4.8 tptm 51.88 26.16 3.46 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.526 -0.734 . . . . 0.0 110.146 -178.978 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -148.4 -44.84 0.15 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.679 -0.638 . . . . 0.0 109.916 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.691 ' HB3' HD22 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -63.89 -30.4 71.49 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 119.612 -0.835 . . . . 0.0 109.27 179.514 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.8 ' HG ' HD11 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -83.48 -28.88 28.43 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 178.567 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.553 HD11 HD11 ' A' ' 90' ' ' LEU . 51.0 mm -68.07 -30.96 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.058 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -70.3 -29.96 66.84 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.675 -0.641 . . . . 0.0 109.903 179.617 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.666 ' O ' HG23 ' B' ' 179' ' ' VAL . 56.4 m-20 -77.45 -32.96 54.83 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.618 -0.676 . . . . 0.0 109.771 179.683 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.701 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -75.68 -30.25 59.31 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.675 -0.641 . . . . 0.0 109.746 179.595 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -76.57 -30.53 57.07 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.634 -0.666 . . . . 0.0 109.859 179.767 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -77.43 -33.85 54.79 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.628 -0.67 . . . . 0.0 109.799 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.666 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.5 t -76.84 -30.65 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.632 -0.668 . . . . 0.0 109.476 179.497 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -75.41 -29.25 59.7 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.656 -0.653 . . . . 0.0 109.865 179.503 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -29.64 62.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.609 -0.682 . . . . 0.0 109.992 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -75.06 -33.18 61.68 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.601 -0.687 . . . . 0.0 109.984 179.74 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.776 ' HA ' HD23 ' A' ' 79' ' ' LEU . 89.2 mt -72.25 -30.05 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.66 -0.65 . . . . 0.0 109.739 179.698 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.63 -35.13 72.76 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.669 -0.644 . . . . 0.0 109.789 179.556 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.5 ttt -67.55 -41.84 83.6 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.567 -0.708 . . . . 0.0 109.802 179.618 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.5 t -70.79 -30.41 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.674 -0.641 . . . . 0.0 109.638 179.629 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 187' ' ' GLU . . . . . 0.487 ' HG3' HD21 ' A' ' 76' ' ' LEU . 4.0 tt0 -74.0 -29.9 62.2 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.584 -0.698 . . . . 0.0 109.964 179.697 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -72.36 -29.68 64.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.52 -0.738 . . . . 0.0 109.918 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -38.69 65.31 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.677 -0.64 . . . . 0.0 109.843 179.774 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.421 HD12 HD22 ' A' ' 76' ' ' LEU . 76.0 mt -70.82 -30.5 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.745 -0.597 . . . . 0.0 109.616 179.722 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.6 m -71.09 -36.72 72.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.649 -0.657 . . . . 0.0 109.603 179.557 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 16.5 mmtm -74.88 -31.95 61.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.642 -0.661 . . . . 0.0 109.584 179.478 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.694 HD23 HG12 ' A' ' 69' ' ' ILE . 0.3 OUTLIER -78.62 -14.42 59.33 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.694 -0.629 . . . . 0.0 110.438 179.358 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.7 tptp -87.65 -28.27 21.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.236 -0.915 . . . . 0.0 109.404 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.16 -34.92 56.39 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.583 -0.698 . . . . 0.0 109.753 179.523 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.487 ' NZ ' HG23 ' A' ' 65' ' ' THR . 0.0 OUTLIER -69.67 -27.62 65.18 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 119.785 -0.766 . . . . 0.0 109.538 179.454 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -69.29 -29.77 67.71 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.54 -0.725 . . . . 0.0 109.458 179.174 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -61.19 -43.58 98.65 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.705 -0.622 . . . . 0.0 109.707 179.52 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -61.58 -34.05 74.94 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.746 -0.596 . . . . 0.0 109.616 179.369 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 23.5 tp -78.12 -31.97 50.19 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.541 ' HA ' HD11 ' A' ' 62' ' ' LEU . 4.1 mm-40 . . . . . 0 N--CA 1.493 1.689 0 O-C-N 121.715 -0.615 . . . . 0.0 109.581 179.447 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.604 HD11 ' HG2' ' B' ' 201' ' ' GLU . 2.3 tt . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 121.104 0.478 . . . . 0.0 109.89 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -64.52 -35.69 81.79 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.573 -0.705 . . . . 0.0 109.9 179.888 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -73.7 -35.43 65.15 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.582 -0.699 . . . . 0.0 109.794 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.437 HG21 ' NZ ' ' B' ' 196' ' ' LYS . 86.6 m -71.72 -31.32 66.58 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.741 -0.6 . . . . 0.0 109.604 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -68.07 -28.34 67.28 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.725 -0.609 . . . . 0.0 109.89 179.625 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -65.99 -34.73 78.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.59 -0.694 . . . . 0.0 110.006 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.6 tp60 -77.64 -31.71 52.87 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.679 -0.638 . . . . 0.0 109.64 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.596 HG12 HD22 ' B' ' 193' ' ' LEU . 82.0 mt -77.01 -28.8 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.732 -0.605 . . . . 0.0 109.562 179.496 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 25.4 tp -74.35 -33.89 63.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.598 -0.689 . . . . 0.0 109.632 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -29.94 70.0 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.574 -0.704 . . . . 0.0 109.745 179.626 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.594 HD11 HD13 ' B' ' 193' ' ' LEU . 14.2 mt -65.02 -30.98 72.0 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.642 -0.661 . . . . 0.0 110.046 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.98 -38.87 92.66 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.565 -0.709 . . . . 0.0 110.004 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -73.9 -31.76 63.26 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.548 179.574 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -76.07 -34.96 59.57 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.706 -0.621 . . . . 0.0 109.663 179.58 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.702 ' O ' HD13 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -74.57 -30.65 61.8 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.58 -0.7 . . . . 0.0 109.607 179.464 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.55 HD23 ' O ' ' A' ' 77' ' ' LEU . 5.9 tt -74.39 -34.69 63.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.634 -0.666 . . . . 0.0 109.726 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.37 69.56 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.676 -0.64 . . . . 0.0 109.723 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 79' ' ' LEU . 1.8 mm? -72.16 -43.17 65.02 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.617 -0.677 . . . . 0.0 109.756 179.709 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -67.62 -29.05 68.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.684 -0.635 . . . . 0.0 109.872 179.486 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -70.1 -30.01 67.11 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.583 -0.698 . . . . 0.0 109.847 179.671 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -69.63 -45.65 68.0 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.599 -0.688 . . . . 0.0 109.711 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -61.87 -27.63 68.93 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.531 -0.731 . . . . 0.0 109.606 179.204 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -62.57 -30.01 71.01 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.592 -0.693 . . . . 0.0 109.771 179.561 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -61.34 -43.93 98.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.535 -0.728 . . . . 0.0 109.856 179.685 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.606 HD23 HD21 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -63.74 -33.65 76.13 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.703 -0.623 . . . . 0.0 109.394 179.436 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -62.03 -35.14 77.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.685 -0.634 . . . . 0.0 109.872 179.817 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.68 -27.17 69.05 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.981 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -106.33 12.73 29.55 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.62 -0.675 . . . . 0.0 110.803 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 58.8 tp . . . . . 0 N--CA 1.499 1.983 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.12 -179.866 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.738 HD12 ' N ' ' B' ' 168' ' ' SER . 2.5 pp -140.43 -46.05 0.42 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.616 -0.932 . . . . 0.0 110.501 -179.808 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.738 ' N ' HD12 ' B' ' 167' ' ' LEU . 38.6 m -153.93 13.99 0.46 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.285 -0.884 . . . . 0.0 111.466 179.925 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 24.3 tptp 49.31 26.6 1.62 Allowed 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.085 -1.01 . . . . 0.0 111.02 -179.825 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -151.4 -47.43 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.735 -0.603 . . . . 0.0 109.738 179.858 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.453 ' CB ' HD11 ' B' ' 167' ' ' LEU . 2.5 mm-40 -74.01 -35.28 64.39 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.27 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.606 HD21 HD23 ' A' ' 86' ' ' LEU . 0.9 OUTLIER -77.12 -29.72 54.89 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.774 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.0 mm -69.51 -29.98 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.393 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -74.1 -31.46 62.81 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.651 -0.656 . . . . 0.0 109.852 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -74.57 -32.76 62.5 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.658 -0.651 . . . . 0.0 109.837 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -29.4 64.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.729 -0.607 . . . . 0.0 109.772 179.523 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.18 -29.76 66.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.557 -0.715 . . . . 0.0 110.054 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 8.0 mtm180 -73.28 -37.08 66.39 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.679 -0.638 . . . . 0.0 109.936 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 59.2 t -73.57 -31.46 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.654 -0.654 . . . . 0.0 109.479 179.594 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -72.2 -29.19 63.74 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.712 -0.617 . . . . 0.0 109.919 179.592 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.52 -31.98 70.53 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.592 -0.692 . . . . 0.0 109.947 179.768 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.06 -35.06 66.63 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.666 -0.646 . . . . 0.0 109.926 179.779 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 86.0 mt -69.51 -30.24 44.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.545 179.6 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.91 -30.98 71.66 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.636 -0.665 . . . . 0.0 109.808 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.6 mtt -68.5 -50.24 53.72 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.685 -0.634 . . . . 0.0 109.843 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -68.21 -30.89 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.578 -0.701 . . . . 0.0 109.564 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -75.23 -28.4 59.88 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.655 -0.653 . . . . 0.0 109.94 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -74.15 -28.89 61.53 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.564 -0.71 . . . . 0.0 110.036 179.729 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.03 -36.6 64.43 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.545 -0.722 . . . . 0.0 109.97 179.801 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.59 HG12 HD22 ' A' ' 72' ' ' LEU . 84.0 mt -68.99 -30.48 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.669 -0.644 . . . . 0.0 109.668 179.698 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.7 m -68.37 -40.94 81.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.63 -0.669 . . . . 0.0 109.559 179.513 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt -73.31 -33.44 65.17 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.682 -0.636 . . . . 0.0 109.4 179.426 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.596 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -72.37 -30.44 64.7 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.701 -0.625 . . . . 0.0 109.398 179.322 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.4 tppt? -69.75 -42.42 73.9 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.644 -0.66 . . . . 0.0 109.727 179.587 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.41 -31.83 73.19 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.561 -0.712 . . . . 0.0 109.383 179.493 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.437 ' NZ ' HG21 ' A' ' 65' ' ' THR . 2.0 ttpp -63.75 -37.12 86.16 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.697 -0.627 . . . . 0.0 109.452 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -62.28 -29.9 70.75 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.763 -0.586 . . . . 0.0 109.767 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -61.97 -44.97 95.62 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.707 -0.62 . . . . 0.0 109.886 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -63.1 -37.9 89.06 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.698 -0.626 . . . . 0.0 109.82 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.4 tp -73.22 -36.22 66.44 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.612 -0.68 . . . . 0.0 109.719 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.604 ' HG2' HD11 ' A' ' 62' ' ' LEU . 6.1 mt-10 . . . . . 0 N--CA 1.493 1.706 0 O-C-N 121.599 -0.688 . . . . 0.0 109.76 179.639 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.808 HD11 ' HG2' ' B' ' 201' ' ' GLU . 7.6 tt . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.072 0.463 . . . . 0.0 110.019 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -66.45 -39.33 88.79 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.6 -0.688 . . . . 0.0 109.93 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -71.95 -29.88 64.73 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.729 -0.607 . . . . 0.0 109.811 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 74.9 m -73.06 -29.77 63.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.625 -0.672 . . . . 0.0 109.884 179.658 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.79 -27.47 63.93 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.568 -0.707 . . . . 0.0 110.1 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -76.11 -28.1 57.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.508 -0.745 . . . . 0.0 110.235 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 72.8 tp60 -77.7 -33.24 53.24 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.566 -0.709 . . . . 0.0 109.852 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.62 HG12 HD22 ' B' ' 193' ' ' LEU . 68.1 mt -74.12 -28.42 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.718 -0.613 . . . . 0.0 109.577 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.24 -37.22 66.44 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.547 -0.72 . . . . 0.0 109.647 179.537 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.9 tptt -62.8 -29.58 70.82 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.535 -0.728 . . . . 0.0 109.633 179.443 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.629 HD22 HG12 ' B' ' 190' ' ' ILE . 10.9 mt -61.47 -29.6 70.07 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.684 -0.635 . . . . 0.0 109.903 179.593 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.2 -38.55 89.57 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.6 -0.688 . . . . 0.0 109.719 179.603 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.04 -31.68 58.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.636 -0.665 . . . . 0.0 109.268 179.259 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -75.38 -31.97 60.65 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.763 -0.585 . . . . 0.0 109.702 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.439 HD13 HD12 ' B' ' 190' ' ' ILE . 22.3 tp -76.36 -31.41 58.05 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.606 -0.684 . . . . 0.0 109.647 179.469 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 tp -74.81 -33.95 62.29 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 120.263 -0.575 . . . . 0.0 109.61 179.485 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.4 -31.42 69.77 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.721 -0.612 . . . . 0.0 109.735 179.581 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.405 ' HA ' HD13 ' A' ' 79' ' ' LEU . 1.2 mm? -70.34 -44.01 69.04 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.678 -0.639 . . . . 0.0 109.668 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.441 ' NE2' HG21 ' B' ' 183' ' ' ILE . 32.7 mm-40 -66.42 -30.5 70.87 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.715 179.505 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -67.77 -31.7 71.77 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.682 -0.636 . . . . 0.0 109.779 179.709 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.07 -44.72 88.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.614 -0.679 . . . . 0.0 109.636 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.3 tttm -64.05 -28.82 70.05 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 120.044 -0.662 . . . . 0.0 109.543 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -65.78 -28.69 69.2 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.689 -0.632 . . . . 0.0 110.118 179.749 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -37.51 78.62 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.526 -0.734 . . . . 0.0 109.748 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.561 HD23 ' CD1' ' B' ' 172' ' ' LEU . 2.6 mt -62.87 -29.06 70.46 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.663 -0.648 . . . . 0.0 109.845 179.635 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -62.14 -42.32 99.13 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.5 -0.75 . . . . 0.0 109.508 179.64 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.86 -30.58 69.12 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-O 121.382 0.61 . . . . 0.0 109.515 179.152 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -85.9 -19.54 30.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.675 -0.641 . . . . 0.0 110.53 179.565 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.823 HD11 HD11 ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.03 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.712 -179.815 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.872 HD13 ' CB ' ' B' ' 171' ' ' GLU . 0.1 OUTLIER -131.19 -63.17 0.86 Allowed 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.616 -0.932 . . . . 0.0 109.158 179.95 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 4.2 m -144.56 37.08 1.2 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 121.343 0.592 . . . . 0.0 109.559 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 17.0 tptt 51.92 25.74 3.25 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.483 -0.761 . . . . 0.0 110.17 -179.009 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -146.7 -45.11 0.18 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.661 -0.649 . . . . 0.0 109.953 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.872 ' CB ' HD13 ' B' ' 167' ' ' LEU . 5.3 mm-40 -64.62 -32.43 74.08 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.554 -0.859 . . . . 0.0 109.148 179.399 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.654 HD23 HD11 ' B' ' 167' ' ' LEU . 0.1 OUTLIER -80.35 -28.35 38.09 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.583 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.823 HD11 HD11 ' A' ' 90' ' ' LEU . 47.2 mm -73.9 -30.7 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.641 -0.662 . . . . 0.0 109.623 179.698 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -73.69 -29.26 62.18 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.619 -0.676 . . . . 0.0 110.13 179.897 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.5 ' O ' HG23 ' B' ' 179' ' ' VAL . 42.6 m-20 -73.35 -27.54 61.55 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.603 -0.685 . . . . 0.0 110.204 179.875 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.799 ' HE3' HD23 ' A' ' 90' ' ' LEU . 1.2 mtt -74.51 -28.94 61.21 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.553 -0.717 . . . . 0.0 110.276 179.95 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.77 -28.42 55.67 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.577 -0.702 . . . . 0.0 110.163 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 8.4 ttp180 -77.93 -34.45 51.24 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.595 -0.69 . . . . 0.0 109.918 179.861 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 175' ' ' ASN . 84.2 t -73.58 -29.17 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.671 -0.643 . . . . 0.0 109.479 179.445 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -68.82 -29.56 67.93 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.69 -0.631 . . . . 0.0 109.919 179.592 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 30.8 mtp180 -75.39 -27.78 59.21 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.59 -0.694 . . . . 0.0 109.969 179.681 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -75.49 -34.27 60.85 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.557 -0.715 . . . . 0.0 110.064 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.441 HG21 ' NE2' ' A' ' 80' ' ' GLN . 88.1 mt -71.49 -28.76 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.824 179.675 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -33.53 71.94 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.584 -0.697 . . . . 0.0 109.771 179.555 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 5.0 ttm -69.53 -45.49 68.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.651 -0.656 . . . . 0.0 109.856 179.794 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 61.6 t -70.18 -31.03 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.609 -0.682 . . . . 0.0 109.611 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -74.91 -28.98 60.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.672 -0.643 . . . . 0.0 109.876 179.598 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -73.3 -28.94 62.38 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.607 -0.683 . . . . 0.0 110.001 179.747 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -35.55 65.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.662 -0.649 . . . . 0.0 110.013 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.629 HG12 HD22 ' A' ' 72' ' ' LEU . 77.2 mt -70.57 -29.76 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.628 -0.67 . . . . 0.0 109.834 179.931 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.12 -39.66 68.67 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.672 -0.643 . . . . 0.0 109.791 179.664 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -73.92 -30.81 62.77 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.598 -0.689 . . . . 0.0 109.487 179.481 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.626 HD13 HD11 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -72.11 -31.03 65.66 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.614 -0.679 . . . . 0.0 109.38 179.282 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -46.63 66.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.602 -0.686 . . . . 0.0 109.456 179.411 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -68.03 -31.54 71.28 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.597 -0.689 . . . . 0.0 109.203 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.41 ' HE2' HD23 ' B' ' 193' ' ' LEU . 15.3 ttpt -65.7 -33.34 75.66 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.703 -0.623 . . . . 0.0 109.436 179.267 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -65.16 -29.98 70.86 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.751 -0.593 . . . . 0.0 109.707 179.544 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -62.83 -42.5 99.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.65 -0.656 . . . . 0.0 109.916 179.743 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -61.13 -45.46 94.57 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.67 -0.644 . . . . 0.0 109.927 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 13.4 tp -72.2 -30.14 64.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.581 -0.7 . . . . 0.0 109.673 179.638 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.808 ' HG2' HD11 ' A' ' 62' ' ' LEU . 6.0 mt-10 . . . . . 0 N--CA 1.494 1.73 0 O-C-N 121.622 -0.674 . . . . 0.0 109.725 179.587 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.598 HD11 ' OE1' ' B' ' 197' ' ' GLN . 4.1 tp . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 121.076 0.465 . . . . 0.0 109.973 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.29 -38.79 88.58 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.552 -0.717 . . . . 0.0 110.035 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -73.44 -36.41 65.92 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.725 -0.609 . . . . 0.0 109.704 179.575 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.629 HG21 ' NZ ' ' B' ' 196' ' ' LYS . 90.8 m -74.06 -31.03 62.69 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.697 -0.627 . . . . 0.0 109.517 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -70.88 -26.67 63.35 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.677 -0.639 . . . . 0.0 109.965 179.51 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -69.11 -35.61 76.61 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.554 -0.716 . . . . 0.0 110.206 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -75.95 -37.06 59.05 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.551 -0.718 . . . . 0.0 109.681 179.665 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.443 HG12 HD22 ' B' ' 193' ' ' LEU . 90.1 mt -71.96 -26.61 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.692 -0.63 . . . . 0.0 109.603 179.256 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.4 tt -70.73 -37.21 73.47 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.493 -0.755 . . . . 0.0 109.884 179.591 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -67.85 -38.04 82.64 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.613 -0.679 . . . . 0.0 109.688 179.649 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.632 HD22 ' CG1' ' B' ' 190' ' ' ILE . 5.4 mt -63.95 -29.6 70.75 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.733 -0.604 . . . . 0.0 109.898 179.714 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.454 ' O ' HD23 ' A' ' 77' ' ' LEU . 2.9 mt-10 -65.22 -38.34 90.12 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.645 -0.659 . . . . 0.0 109.798 179.767 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -73.36 -32.87 64.76 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.383 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.9 tttt -69.76 -36.37 75.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.68 -0.638 . . . . 0.0 109.593 179.529 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.401 HD13 HD12 ' B' ' 190' ' ' ILE . 32.1 tp -70.39 -30.01 66.79 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.626 -0.671 . . . . 0.0 109.731 179.421 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 73' ' ' GLU . 1.9 mm? -73.29 -37.76 66.13 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.716 -0.615 . . . . 0.0 109.727 179.625 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.16 -30.26 70.19 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.716 -0.615 . . . . 0.0 109.826 179.675 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.767 HD23 ' HA ' ' B' ' 183' ' ' ILE . 3.3 mp -70.99 -43.79 67.27 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.687 -0.633 . . . . 0.0 109.829 179.863 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -66.2 -29.59 69.88 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.618 -0.676 . . . . 0.0 109.785 179.755 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -68.78 -30.5 69.1 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.572 -0.705 . . . . 0.0 109.77 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -48.72 56.81 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.635 -0.666 . . . . 0.0 109.777 179.729 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -63.69 -30.34 71.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.556 -0.715 . . . . 0.0 109.591 179.462 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -65.59 -34.6 78.62 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.676 -0.64 . . . . 0.0 109.817 179.613 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.444 ' HA ' HD12 ' A' ' 88' ' ' LEU . 29.8 tp60 -67.25 -37.76 84.05 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.725 -0.609 . . . . 0.0 109.713 179.61 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.635 HD23 HD21 ' B' ' 172' ' ' LEU . 1.3 mt -62.3 -38.45 89.44 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.646 -0.659 . . . . 0.0 109.762 179.66 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -60.9 -42.58 98.29 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.544 -0.722 . . . . 0.0 109.963 179.917 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 85' ' ' GLN . 15.8 mt -67.47 -30.08 69.7 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.742 -0.599 . . . . 0.0 109.676 179.465 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.53 -15.7 34.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.689 -0.632 . . . . 0.0 110.692 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.653 HD13 ' HE3' ' B' ' 176' ' ' MET . 30.5 tp . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.521 -179.859 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.593 HD12 ' N ' ' B' ' 168' ' ' SER . 1.6 pp -50.32 -46.37 55.51 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.793 -0.827 . . . . 0.0 111.607 179.868 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.593 ' N ' HD12 ' B' ' 167' ' ' LEU . 34.8 t -151.74 16.36 0.68 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.258 -0.902 . . . . 0.0 111.115 -179.987 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 169' ' ' LYS . . . . . 0.473 ' C ' HD13 ' B' ' 173' ' ' ILE . 26.0 tptt 49.94 26.36 1.97 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.131 -0.981 . . . . 0.0 111.021 -179.96 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -153.37 -46.4 0.09 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.648 -0.657 . . . . 0.0 110.03 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.587 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -74.64 -30.29 61.58 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.904 -0.718 . . . . 0.0 109.294 179.59 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.635 HD21 HD23 ' A' ' 86' ' ' LEU . 1.3 tt -79.13 -28.88 42.93 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.711 -0.618 . . . . 0.0 109.672 179.117 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.648 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.3 mp -76.82 -35.25 24.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -64.44 -31.39 72.58 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.905 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.807 ' O ' HG23 ' B' ' 179' ' ' VAL . 77.2 m-20 -75.83 -34.58 60.11 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.109 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.653 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -68.48 -31.76 71.28 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.645 179.524 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -76.93 -30.65 56.19 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.545 -0.722 . . . . 0.0 109.851 179.588 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 -74.8 -30.11 61.31 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.661 -0.65 . . . . 0.0 109.781 179.579 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.807 HG23 ' O ' ' B' ' 175' ' ' ASN . 66.5 t -72.12 -29.47 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.691 -0.63 . . . . 0.0 109.831 179.843 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.94 -31.38 67.95 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.543 -0.723 . . . . 0.0 109.985 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -30.03 63.61 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.739 -0.601 . . . . 0.0 109.828 179.746 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 47.6 tt0 -74.04 -41.17 62.19 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.639 -0.663 . . . . 0.0 109.901 179.716 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.767 ' HA ' HD23 ' A' ' 79' ' ' LEU . 84.0 mt -67.89 -28.37 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.674 -0.641 . . . . 0.0 109.505 179.482 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 35.2 m -66.74 -32.13 73.23 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.55 -0.719 . . . . 0.0 109.691 179.475 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.4 mtt -67.28 -50.28 60.97 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.716 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.9 t -65.13 -30.25 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.653 -0.655 . . . . 0.0 109.565 179.568 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -71.12 -29.61 65.46 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.672 -0.643 . . . . 0.0 109.932 179.734 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -30.5 69.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.618 -0.676 . . . . 0.0 109.861 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -37.42 56.75 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.604 -0.685 . . . . 0.0 109.612 179.689 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.632 ' CG1' HD22 ' A' ' 72' ' ' LEU . 70.9 mt -73.38 -28.98 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.651 -0.656 . . . . 0.0 109.593 179.673 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.2 m -73.18 -34.29 65.92 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.544 -0.722 . . . . 0.0 109.548 179.508 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -37.38 62.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.677 -0.639 . . . . 0.0 109.491 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.443 HD22 HG12 ' A' ' 69' ' ' ILE . 0.5 OUTLIER -69.54 -30.69 68.56 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.58 -0.7 . . . . 0.0 109.403 179.238 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -67.49 -42.93 82.1 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.633 -0.667 . . . . 0.0 109.663 179.54 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -68.74 -33.54 74.09 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.577 -0.702 . . . . 0.0 109.338 179.397 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.629 ' NZ ' HG21 ' A' ' 65' ' ' THR . 0.9 OUTLIER -64.42 -32.62 74.31 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.032 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 197' ' ' GLN . . . . . 0.598 ' OE1' HD11 ' A' ' 62' ' ' LEU . 6.8 mm-40 -65.49 -30.24 70.98 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.477 179.288 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -60.48 -42.47 96.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.684 -0.635 . . . . 0.0 109.868 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -45.42 93.6 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.679 -0.638 . . . . 0.0 109.689 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.429 HD23 HD12 ' A' ' 62' ' ' LEU . 5.0 tp -72.95 -30.9 64.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.707 -0.621 . . . . 0.0 109.422 179.231 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.69 -0.631 . . . . 0.0 109.928 179.511 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.923 HD12 HD23 ' B' ' 200' ' ' LEU . 18.6 tp . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 121.093 0.473 . . . . 0.0 110.046 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.82 -32.61 69.72 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.555 -0.716 . . . . 0.0 110.02 179.964 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -75.16 -34.19 61.57 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.638 -0.664 . . . . 0.0 109.816 179.669 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.414 HG21 ' OE1' ' B' ' 197' ' ' GLN . 35.9 m -73.53 -30.41 63.06 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.703 -0.623 . . . . 0.0 109.677 179.608 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -71.59 -27.76 63.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.611 -0.68 . . . . 0.0 110.05 179.611 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -70.0 -30.19 67.45 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.571 -0.706 . . . . 0.0 110.156 179.886 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.41 -37.14 60.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.578 -0.701 . . . . 0.0 109.914 179.797 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.447 HD12 HE21 ' B' ' 197' ' ' GLN . 84.9 mt -70.26 -27.77 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.671 -0.643 . . . . 0.0 109.697 179.611 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 21.4 tp -69.75 -35.06 74.64 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.563 -0.711 . . . . 0.0 109.895 179.679 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -67.98 -28.78 67.73 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.526 -0.734 . . . . 0.0 109.911 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.728 HD22 HG12 ' B' ' 190' ' ' ILE . 11.7 mt -68.57 -31.4 70.58 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.599 -0.688 . . . . 0.0 110.108 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -66.42 -37.31 84.92 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.583 -0.698 . . . . 0.0 110.039 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -74.9 -28.53 60.67 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.608 -0.682 . . . . 0.0 109.916 179.662 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -77.53 -29.8 52.52 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.64 -0.662 . . . . 0.0 109.899 179.78 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.1 tp -77.05 -30.71 55.73 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.602 -0.686 . . . . 0.0 109.97 179.837 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.4 mt -79.3 -31.03 43.16 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.625 -0.672 . . . . 0.0 109.74 179.666 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -77.08 -28.4 54.57 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.699 -0.625 . . . . 0.0 109.827 179.487 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.764 HD23 ' HA ' ' B' ' 183' ' ' ILE . 6.8 tp -76.06 -33.75 59.59 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.62 -0.675 . . . . 0.0 109.918 179.704 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -72.45 -31.16 65.22 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.578 -0.701 . . . . 0.0 109.586 179.372 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -67.89 -29.04 68.05 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.719 -0.613 . . . . 0.0 109.787 179.416 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.17 -44.98 82.48 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.544 -0.722 . . . . 0.0 109.864 179.772 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -62.89 -29.48 70.8 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.568 -0.707 . . . . 0.0 109.799 179.686 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -65.69 -38.59 89.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.616 -0.678 . . . . 0.0 109.844 179.721 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -64.99 -46.64 80.6 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.656 -0.653 . . . . 0.0 109.67 179.596 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.817 HD11 ' HB3' ' B' ' 175' ' ' ASN . 0.4 OUTLIER -61.52 -29.28 69.89 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.645 -0.659 . . . . 0.0 109.776 179.493 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.38 -35.58 81.36 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.59 -0.694 . . . . 0.0 109.537 179.619 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.93 -30.59 64.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.724 -0.61 . . . . 0.0 109.409 179.294 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.411 ' HB3' HD11 ' B' ' 172' ' ' LEU . 2.6 tt0 -75.44 -18.51 59.86 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.711 -0.618 . . . . 0.0 110.494 179.55 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.553 HD11 ' CD1' ' B' ' 173' ' ' ILE . 28.0 tp . . . . . 0 N--CA 1.5 2.068 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.643 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.881 HD13 ' CB ' ' B' ' 171' ' ' GLU . 0.2 OUTLIER -126.96 -62.91 1.09 Allowed 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.537 -0.978 . . . . 0.0 109.132 179.901 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 9.0 t -144.36 37.2 1.23 Allowed 'General case' 0 N--CA 1.489 1.484 0 CA-C-O 121.238 0.542 . . . . 0.0 109.576 179.747 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 10.1 tptt 51.76 26.14 3.32 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.569 -0.707 . . . . 0.0 110.138 -178.976 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -147.19 -44.99 0.17 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.691 -0.63 . . . . 0.0 109.834 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.881 ' CB ' HD13 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -65.12 -32.32 73.97 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.383 179.599 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.595 HD23 HD11 ' B' ' 167' ' ' LEU . 0.1 OUTLIER -79.45 -27.34 41.64 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.438 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.553 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.6 mm -70.07 -30.37 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.629 -0.67 . . . . 0.0 109.605 179.501 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -74.93 -27.82 60.36 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.566 -0.709 . . . . 0.0 110.225 179.97 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.817 ' HB3' HD11 ' A' ' 86' ' ' LEU . 55.3 m-20 -77.37 -29.42 53.26 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.543 -0.723 . . . . 0.0 110.14 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.522 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -76.99 -29.64 55.58 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.627 -0.671 . . . . 0.0 109.93 179.771 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.08 -29.37 54.94 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.66 -0.65 . . . . 0.0 110.026 179.914 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.11 -29.05 54.62 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.547 -0.72 . . . . 0.0 109.971 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.723 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.3 t -76.04 -29.32 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.582 -0.699 . . . . 0.0 109.792 179.701 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -74.69 -28.64 60.91 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.608 -0.682 . . . . 0.0 110.176 179.89 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -29.2 60.82 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.609 -0.682 . . . . 0.0 110.026 179.925 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 182' ' ' GLU . . . . . 0.54 ' O ' HG23 ' B' ' 186' ' ' VAL . 8.1 tt0 -76.6 -36.18 57.66 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.61 -0.681 . . . . 0.0 110.058 179.833 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.764 ' HA ' HD23 ' A' ' 79' ' ' LEU . 87.6 mt -73.77 -27.88 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.715 -0.616 . . . . 0.0 109.762 179.604 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 29.5 m -73.98 -33.02 63.69 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.502 -0.748 . . . . 0.0 109.769 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 2.9 tpt -76.6 -36.75 57.31 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.626 -0.671 . . . . 0.0 109.585 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 186' ' ' VAL . . . . . 0.54 HG23 ' O ' ' B' ' 182' ' ' GLU . 73.1 t -75.15 -31.17 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.689 -0.632 . . . . 0.0 109.455 179.343 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -74.74 -29.17 61.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.644 -0.66 . . . . 0.0 109.847 179.678 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -73.72 -29.55 62.32 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.621 -0.674 . . . . 0.0 109.937 179.726 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -71.53 -35.43 70.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.706 -0.621 . . . . 0.0 109.819 179.798 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.728 HG12 HD22 ' A' ' 72' ' ' LEU . 79.0 mt -68.74 -37.89 78.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.576 -0.703 . . . . 0.0 109.849 179.832 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 56.1 p -66.9 -35.07 79.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.629 -0.67 . . . . 0.0 109.446 179.442 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 6.2 mmmm -75.86 -36.05 59.71 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.316 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.66 HD23 ' HE2' ' B' ' 196' ' ' LYS . 0.3 OUTLIER -75.81 -14.61 60.3 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.682 -0.636 . . . . 0.0 110.458 179.358 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.9 tppt? -87.08 -29.25 22.03 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.238 -0.914 . . . . 0.0 109.355 179.334 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -76.53 -35.15 58.46 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 120.192 -0.603 . . . . 0.0 109.88 179.475 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.66 ' HE2' HD23 ' B' ' 193' ' ' LEU . 0.0 OUTLIER -69.77 -28.04 65.42 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 119.769 -0.773 . . . . 0.0 109.555 179.41 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 197' ' ' GLN . . . . . 0.447 HE21 HD12 ' A' ' 69' ' ' ILE . 4.9 tp60 -72.04 -30.28 65.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.597 -0.689 . . . . 0.0 109.223 179.032 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -35.79 80.55 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.73 -0.606 . . . . 0.0 109.786 179.637 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.06 -44.24 94.85 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.523 -0.736 . . . . 0.0 109.045 179.096 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.923 HD23 HD12 ' A' ' 62' ' ' LEU . 18.0 tp -68.02 -29.06 67.97 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.355 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.72 -0.613 . . . . 0.0 109.872 179.505 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.531 HD21 ' HG2' ' B' ' 201' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 121.152 0.501 . . . . 0.0 109.95 . . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -76.05 -31.98 59.08 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.655 -0.653 . . . . 0.0 109.933 179.82 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.28 -34.71 59.1 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.716 -0.615 . . . . 0.0 109.675 179.565 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.1 m -74.82 -34.17 62.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.651 -0.656 . . . . 0.0 109.454 179.4 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.529 ' HA ' HD12 ' A' ' 69' ' ' ILE . 26.4 mttt -69.68 -27.78 65.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.686 -0.634 . . . . 0.0 109.746 179.405 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -67.19 -34.55 77.75 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.513 -0.742 . . . . 0.0 109.912 179.726 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -76.24 -32.44 58.88 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.661 -0.649 . . . . 0.0 109.557 179.544 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.778 HG12 HD22 ' B' ' 193' ' ' LEU . 75.1 mt -72.66 -28.3 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.719 -0.613 . . . . 0.0 109.557 179.335 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 tt -69.27 -38.4 78.37 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.621 -0.674 . . . . 0.0 109.846 179.659 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.2 tmtm? -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.592 -0.693 . . . . 0.0 109.846 179.728 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.641 HD12 ' CG1' ' B' ' 190' ' ' ILE . 1.7 mm? -64.55 -32.84 74.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.711 -0.618 . . . . 0.0 109.912 179.79 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -38.89 91.71 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.594 -0.691 . . . . 0.0 109.83 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.34 -32.07 64.34 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.642 -0.662 . . . . 0.0 109.518 179.455 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.3 tptm -73.19 -33.63 65.52 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.717 -0.614 . . . . 0.0 109.659 179.577 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 20.8 tp -76.02 -32.09 59.2 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.671 -0.643 . . . . 0.0 109.587 179.491 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -76.73 -34.48 58.11 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.747 -0.596 . . . . 0.0 109.558 179.396 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.42 -29.14 62.38 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.708 -0.62 . . . . 0.0 109.79 179.472 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.738 HD23 ' HA ' ' B' ' 183' ' ' ILE . 8.1 tp -75.8 -36.6 59.69 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.662 -0.649 . . . . 0.0 109.817 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.403 ' HA ' ' HG2' ' A' ' 83' ' ' LYS . 20.1 tt0 -76.2 -23.09 54.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.68 -0.637 . . . . 0.0 110.138 179.439 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -81.32 -26.75 35.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.455 -0.778 . . . . 0.0 109.573 179.187 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -76.43 -41.46 47.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.577 -0.702 . . . . 0.0 110.003 179.632 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.403 ' HG2' ' HA ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -68.28 -24.84 64.92 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.627 179.339 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -66.29 -31.04 71.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.552 -0.717 . . . . 0.0 109.446 179.184 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.01 -31.46 72.6 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.616 -0.677 . . . . 0.0 109.595 179.465 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.437 HD21 HD23 ' B' ' 172' ' ' LEU . 0.3 OUTLIER -68.07 -34.96 77.41 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.672 -0.643 . . . . 0.0 109.755 179.548 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -61.87 -36.36 81.02 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.596 -0.69 . . . . 0.0 109.975 179.684 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 tp -64.16 -29.86 70.95 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.677 -0.64 . . . . 0.0 109.95 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -82.41 -13.1 57.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.652 -0.655 . . . . 0.0 110.799 179.822 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.847 HD13 ' HE3' ' B' ' 176' ' ' MET . 38.5 tp . . . . . 0 N--CA 1.501 2.098 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.598 -179.946 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 166' ' ' GLY . . . . . 0.552 ' HA2' HD12 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.784 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.1 OUTLIER -118.98 -63.13 1.44 Allowed 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.583 -0.951 . . . . 0.0 108.946 -179.957 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.6 t -152.83 33.55 0.49 Allowed 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.277 0.56 . . . . 0.0 109.543 179.684 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 9.6 tptm 51.34 26.73 3.22 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.515 -0.741 . . . . 0.0 110.072 -179.065 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -149.03 -43.21 0.14 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.633 -0.667 . . . . 0.0 110.339 -179.785 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.706 ' HB3' HD22 ' B' ' 167' ' ' LEU . 0.2 OUTLIER -62.0 -40.83 96.98 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.667 179.77 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.784 ' HG ' HD11 ' B' ' 167' ' ' LEU . 1.4 mt -76.18 -28.53 57.33 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.464 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.8 mm -67.5 -31.06 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.328 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -75.53 -32.73 60.58 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.714 179.766 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -73.78 -35.0 64.89 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.67 -0.644 . . . . 0.0 109.566 179.45 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.847 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.8 OUTLIER -67.44 -29.54 69.04 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.729 -0.607 . . . . 0.0 109.966 179.628 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -77.17 -25.34 51.8 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.625 -0.672 . . . . 0.0 110.132 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -77.86 -31.5 51.45 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.562 -0.711 . . . . 0.0 110.194 179.961 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.535 HG22 ' O ' ' B' ' 176' ' ' MET . 34.5 m -77.21 -24.53 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.573 -0.705 . . . . 0.0 110.294 179.966 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -82.44 -29.71 30.5 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.405 -0.809 . . . . 0.0 109.836 179.653 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -77.49 -27.93 52.03 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.696 -0.627 . . . . 0.0 109.842 179.576 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -77.54 -34.54 53.86 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.537 -0.727 . . . . 0.0 110.021 179.705 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.738 ' HA ' HD23 ' A' ' 79' ' ' LEU . 76.9 mt -74.26 -27.0 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.551 -0.718 . . . . 0.0 109.692 179.574 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 28.1 m -71.61 -31.43 66.89 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.525 -0.735 . . . . 0.0 109.552 179.256 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.26 -44.37 53.17 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.61 -0.681 . . . . 0.0 109.497 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 70.5 t -71.45 -31.83 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.679 -0.638 . . . . 0.0 109.289 179.331 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -72.99 -29.06 62.75 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.704 -0.623 . . . . 0.0 109.797 179.565 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -72.43 -32.17 66.09 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.677 -0.639 . . . . 0.0 109.918 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.46 -29.85 67.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.715 -0.616 . . . . 0.0 109.983 179.803 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.641 ' CG1' HD12 ' A' ' 72' ' ' LEU . 79.7 mt -73.95 -30.27 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.602 -0.686 . . . . 0.0 109.762 179.775 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 97.7 p -71.73 -40.28 69.53 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.627 -0.671 . . . . 0.0 109.519 179.315 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 9.8 mtpp -71.35 -30.19 65.87 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.589 -0.695 . . . . 0.0 109.455 179.341 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.778 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -71.19 -37.65 72.13 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.668 -0.645 . . . . 0.0 109.341 179.366 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.93 -42.37 97.39 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.625 -0.672 . . . . 0.0 109.486 179.453 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.04 -30.64 71.2 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.46 179.337 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.574 ' HE2' HD23 ' B' ' 193' ' ' LEU . 28.5 ttpt -64.35 -34.31 77.85 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.686 -0.634 . . . . 0.0 109.33 179.296 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 197' ' ' GLN . . . . . 0.478 ' HG2' HD11 ' A' ' 69' ' ' ILE . 4.0 mm-40 -64.49 -31.35 72.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.77 -0.581 . . . . 0.0 109.465 179.38 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -60.22 -40.47 90.27 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.655 -0.653 . . . . 0.0 109.894 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -62.03 -39.64 93.0 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 120.286 -0.566 . . . . 0.0 109.793 179.605 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.78 -31.88 65.2 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.689 -0.632 . . . . 0.0 109.59 179.575 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.531 ' HG2' HD21 ' A' ' 62' ' ' LEU . 4.8 mm-40 . . . . . 0 N--CA 1.493 1.69 0 O-C-N 121.623 -0.673 . . . . 0.0 109.753 179.645 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tp . . . . . 0 N--CA 1.496 1.831 0 CA-C-O 121.005 0.431 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.1 tp10 -70.46 -30.16 66.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.563 -0.711 . . . . 0.0 110.111 179.985 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -73.55 -43.1 60.72 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.637 -0.664 . . . . 0.0 109.84 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.488 HG22 HD11 ' A' ' 69' ' ' ILE . 73.8 m -67.45 -30.55 70.3 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.701 -0.625 . . . . 0.0 109.596 179.503 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -67.6 -27.9 67.29 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.628 -0.67 . . . . 0.0 109.909 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.84 -40.6 91.92 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.507 -0.745 . . . . 0.0 110.119 179.872 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -73.75 -36.99 65.2 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.609 -0.682 . . . . 0.0 109.579 179.64 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.552 HG12 HD22 ' B' ' 193' ' ' LEU . 75.7 mt -73.02 -27.98 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.707 -0.62 . . . . 0.0 109.399 179.261 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.58 -34.91 72.7 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.61 -0.681 . . . . 0.0 109.764 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -62.96 -36.13 82.43 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.557 -0.714 . . . . 0.0 109.753 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.581 HD22 HG12 ' B' ' 190' ' ' ILE . 15.5 mt -63.05 -28.61 70.21 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.61 -0.681 . . . . 0.0 109.919 179.696 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.02 -41.16 99.47 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.575 -0.703 . . . . 0.0 110.002 179.822 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.46 -32.19 66.06 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.683 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -77.17 -33.97 56.4 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.728 -0.607 . . . . 0.0 109.631 179.635 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.4 tp -75.72 -29.67 59.0 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.651 -0.656 . . . . 0.0 109.706 179.454 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tt -76.27 -34.77 59.14 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.716 -0.615 . . . . 0.0 109.649 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.31 -29.69 65.32 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.634 -0.666 . . . . 0.0 109.792 179.49 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.588 HD12 ' CG1' ' B' ' 183' ' ' ILE . 0.4 OUTLIER -71.83 -40.19 69.26 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.63 -0.669 . . . . 0.0 109.725 179.736 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.45 -30.39 68.29 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.579 -0.7 . . . . 0.0 109.696 179.605 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -69.02 -29.5 67.67 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.738 -0.601 . . . . 0.0 109.769 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -65.75 -41.62 91.91 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.642 -0.661 . . . . 0.0 109.826 179.879 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -67.9 -29.69 68.84 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.59 -0.694 . . . . 0.0 109.791 179.623 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -68.29 -31.42 70.85 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.687 -0.633 . . . . 0.0 109.861 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 51.6 tp60 -68.15 -35.83 78.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.594 -0.691 . . . . 0.0 109.731 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.601 HD13 ' HA ' ' B' ' 176' ' ' MET . 2.8 mt -63.43 -32.2 73.58 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.661 -0.649 . . . . 0.0 109.851 179.702 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -61.5 -38.85 88.81 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.555 -0.716 . . . . 0.0 109.789 179.73 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 44.4 mt -73.73 -30.66 62.96 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.709 -0.619 . . . . 0.0 109.663 179.492 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -86.9 -16.99 34.32 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.59 -0.694 . . . . 0.0 110.688 179.65 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.465 HD11 ' CD1' ' B' ' 173' ' ' ILE . 53.4 tp . . . . . 0 N--CA 1.5 2.061 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.646 179.996 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.737 HD12 ' N ' ' B' ' 168' ' ' SER . 2.9 pp -139.54 -44.59 0.45 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.617 -0.931 . . . . 0.0 110.54 -179.911 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.737 ' N ' HD12 ' B' ' 167' ' ' LEU . 20.5 t -153.85 15.16 0.49 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.407 -0.808 . . . . 0.0 111.299 -179.99 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.9 tptm 49.51 26.44 1.7 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.095 -1.003 . . . . 0.0 111.059 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.63 -46.77 0.1 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.695 -0.628 . . . . 0.0 110.064 179.991 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.563 ' CB ' HD11 ' B' ' 167' ' ' LEU . 2.6 mm-40 -73.49 -37.29 65.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.575 -0.703 . . . . 0.0 109.119 179.483 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.466 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.3 tt -74.39 -27.59 60.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.746 -0.597 . . . . 0.0 109.408 178.821 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.465 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.3 mm -69.53 -33.68 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.591 -0.693 . . . . 0.0 109.277 179.388 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -70.7 -30.56 67.15 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.711 -0.618 . . . . 0.0 109.722 179.538 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -70.03 -41.37 74.37 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.68 -0.637 . . . . 0.0 109.86 179.594 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.601 ' HA ' HD13 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -62.35 -32.63 73.44 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.704 -0.623 . . . . 0.0 109.888 179.669 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -73.07 -29.41 62.93 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.71 -0.619 . . . . 0.0 109.969 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -73.03 -33.13 65.53 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.627 -0.671 . . . . 0.0 109.966 179.863 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.568 HG21 ' CD1' ' A' ' 86' ' ' LEU . 61.3 t -71.23 -30.68 41.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.622 -0.674 . . . . 0.0 109.668 179.788 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.26 -30.45 68.57 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 120.123 -0.631 . . . . 0.0 109.891 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -76.16 -28.35 57.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.678 -0.639 . . . . 0.0 109.941 179.585 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -76.35 -34.16 58.96 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.564 -0.71 . . . . 0.0 110.016 179.771 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.588 ' CG1' HD12 ' A' ' 79' ' ' LEU . 85.1 mt -74.34 -29.97 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.673 -0.642 . . . . 0.0 109.653 179.676 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 26.3 m -72.52 -30.75 64.75 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.549 -0.72 . . . . 0.0 109.778 179.479 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.4 mtp -73.64 -44.64 56.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.625 -0.672 . . . . 0.0 109.688 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -72.08 -30.84 37.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.585 -0.697 . . . . 0.0 109.399 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -74.4 -29.33 61.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.625 -0.672 . . . . 0.0 109.747 179.358 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.23 -30.95 68.15 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.695 -0.628 . . . . 0.0 109.81 179.609 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -36.04 68.9 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.632 -0.667 . . . . 0.0 109.824 179.638 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.581 HG12 HD22 ' A' ' 72' ' ' LEU . 75.7 mt -71.57 -31.05 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.687 -0.633 . . . . 0.0 109.439 179.704 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 11.5 m -68.41 -37.89 80.75 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.633 -0.667 . . . . 0.0 109.474 179.519 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 39.2 mttm -74.85 -36.25 62.35 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 120.098 -0.641 . . . . 0.0 109.37 179.349 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.552 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -72.18 -31.32 65.81 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.167 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? -67.56 -39.75 84.92 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.664 -0.648 . . . . 0.0 109.489 179.407 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -31.74 73.0 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.689 -0.632 . . . . 0.0 109.317 179.284 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -63.48 -37.03 85.75 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.71 -0.619 . . . . 0.0 109.411 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -62.05 -29.8 70.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.775 -0.578 . . . . 0.0 109.66 179.458 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -61.69 -46.28 90.39 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.683 -0.635 . . . . 0.0 109.906 179.662 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -63.87 -40.8 97.4 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.752 -0.592 . . . . 0.0 109.863 179.751 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 21.9 tp -71.71 -32.68 68.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.632 -0.668 . . . . 0.0 109.814 179.692 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 . . . . . 0 N--CA 1.493 1.681 0 O-C-N 121.569 -0.707 . . . . 0.0 109.814 179.718 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.734 HD12 HD23 ' B' ' 200' ' ' LEU . 1.7 tp . . . . . 0 N--CA 1.495 1.811 0 CA-C-O 121.052 0.453 . . . . 0.0 109.965 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -63.62 -32.19 73.59 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.653 -0.654 . . . . 0.0 110.081 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -67.8 -52.0 42.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.61 -0.681 . . . . 0.0 109.946 179.667 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.2 m -62.95 -31.92 73.12 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.701 -0.624 . . . . 0.0 109.484 179.504 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -65.46 -28.38 69.17 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.647 -0.658 . . . . 0.0 109.773 179.415 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -62.21 -42.41 99.27 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.572 -0.705 . . . . 0.0 109.935 179.814 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -75.5 -33.26 60.75 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.584 -0.698 . . . . 0.0 109.403 179.417 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -75.63 -26.52 18.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.212 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.8 tp -72.2 -34.04 68.08 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.576 -0.703 . . . . 0.0 109.825 179.657 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -66.21 -37.48 85.65 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.525 -0.735 . . . . 0.0 109.808 179.696 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.65 HD22 HG12 ' B' ' 190' ' ' ILE . 8.0 mt -64.88 -29.19 70.13 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.695 -0.628 . . . . 0.0 109.92 179.737 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.435 ' O ' HD13 ' A' ' 77' ' ' LEU . 14.3 mt-10 -66.52 -34.37 77.76 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.58 -0.7 . . . . 0.0 109.897 179.837 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -76.61 -31.83 57.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.707 -0.621 . . . . 0.0 109.558 179.589 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -76.2 -30.32 57.95 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.811 -0.555 . . . . 0.0 109.716 179.712 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.928 HD13 HD12 ' B' ' 190' ' ' ILE . 6.1 tp -77.11 -31.99 56.21 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.628 -0.67 . . . . 0.0 109.661 179.581 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.435 HD13 ' O ' ' A' ' 73' ' ' GLU . 0.7 OUTLIER -74.98 -34.6 62.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.622 -0.674 . . . . 0.0 109.558 179.502 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.85 -29.99 67.36 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.784 179.452 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.767 HD12 HG12 ' B' ' 183' ' ' ILE . 0.3 OUTLIER -71.03 -44.27 66.19 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.636 -0.665 . . . . 0.0 109.609 179.575 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -66.81 -30.85 71.14 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.588 -0.695 . . . . 0.0 109.664 179.445 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.8 -30.2 69.57 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.772 -0.58 . . . . 0.0 109.802 179.593 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.68 -44.26 86.79 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.643 -0.661 . . . . 0.0 109.805 179.765 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -62.83 -33.06 74.44 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.574 -0.704 . . . . 0.0 109.619 179.556 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -62.66 -31.26 72.1 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.703 -0.623 . . . . 0.0 109.962 179.772 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -70.9 -35.95 72.51 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.712 -0.617 . . . . 0.0 109.785 179.689 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.648 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.2 OUTLIER -64.89 -30.52 71.52 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.684 -0.635 . . . . 0.0 109.671 179.611 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -62.43 -36.46 82.47 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.661 -0.649 . . . . 0.0 109.8 179.726 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.437 HD12 ' N ' ' A' ' 88' ' ' LEU . 8.6 mp -73.07 -29.51 63.01 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.756 -0.59 . . . . 0.0 109.965 179.656 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -85.86 -23.86 26.93 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.67 -0.644 . . . . 0.0 110.345 179.829 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.522 HD22 ' CE ' ' B' ' 176' ' ' MET . 53.2 tp . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.471 -179.977 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 166' ' ' GLY . . . . . 0.441 ' HA2' HD13 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.734 HD12 ' N ' ' B' ' 168' ' ' SER . 3.0 pp -140.76 -43.65 0.39 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.607 -0.937 . . . . 0.0 110.597 -179.77 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.734 ' N ' HD12 ' B' ' 167' ' ' LEU . 33.3 t -153.21 16.55 0.55 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.344 -0.848 . . . . 0.0 111.141 179.851 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 169' ' ' LYS . . . . . 0.462 ' C ' HD13 ' B' ' 173' ' ' ILE . 10.6 tptm 49.84 26.37 1.9 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.133 -0.979 . . . . 0.0 111.12 179.982 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -154.58 -45.86 0.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.628 -0.67 . . . . 0.0 110.331 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.632 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.6 OUTLIER -74.21 -31.04 62.47 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.436 179.8 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.562 HD12 HD23 ' B' ' 167' ' ' LEU . 1.5 tt -79.69 -29.77 40.88 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.671 -0.643 . . . . 0.0 109.606 179.182 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.638 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.3 mp -75.83 -34.33 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 179.322 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -65.09 -32.73 74.58 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.858 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.748 ' O ' HG23 ' B' ' 179' ' ' VAL . 76.8 m-20 -75.56 -33.43 60.64 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.03 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.648 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -70.14 -35.89 74.39 Favored 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.54 179.549 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -72.86 -30.5 64.04 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.651 -0.656 . . . . 0.0 109.81 179.708 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -29.63 64.47 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.641 -0.662 . . . . 0.0 109.888 179.7 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.748 HG23 ' O ' ' B' ' 175' ' ' ASN . 65.5 t -69.76 -29.91 42.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.589 -0.694 . . . . 0.0 109.805 179.728 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -68.72 -30.4 69.03 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.61 -0.681 . . . . 0.0 109.841 179.819 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.04 -29.49 61.93 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.643 -0.661 . . . . 0.0 109.897 179.783 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -74.81 -37.45 62.32 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.685 -0.634 . . . . 0.0 109.949 179.699 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.767 HG12 HD12 ' A' ' 79' ' ' LEU . 85.9 mt -72.08 -29.25 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.698 -0.626 . . . . 0.0 109.674 179.606 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 25.2 m -72.49 -31.76 65.64 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.56 -0.713 . . . . 0.0 109.847 179.555 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -42.52 65.74 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.592 -0.693 . . . . 0.0 109.796 179.631 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.69 -31.44 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.695 -0.628 . . . . 0.0 109.457 179.584 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -72.13 -29.75 64.37 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.63 -0.669 . . . . 0.0 109.818 179.579 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -68.78 -30.86 69.54 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.569 -0.707 . . . . 0.0 109.803 179.739 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -75.59 -35.16 60.63 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.666 -0.646 . . . . 0.0 109.766 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.928 HD12 HD13 ' A' ' 76' ' ' LEU . 79.1 mt -73.39 -31.55 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.58 -0.7 . . . . 0.0 109.43 179.616 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.9 m -70.02 -35.94 74.7 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.7 -0.625 . . . . 0.0 109.327 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -75.2 -37.22 61.24 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.594 -0.691 . . . . 0.0 109.283 179.299 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.75 -30.96 66.16 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.677 -0.639 . . . . 0.0 109.436 179.196 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -68.83 -36.93 78.79 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.697 -0.627 . . . . 0.0 109.753 179.587 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -62.8 -30.28 71.35 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.584 -0.698 . . . . 0.0 109.628 179.571 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -39.33 94.45 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.692 -0.63 . . . . 0.0 109.621 179.443 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -62.69 -29.19 70.47 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.716 -0.615 . . . . 0.0 109.704 179.494 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -61.75 -38.12 86.8 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.665 -0.647 . . . . 0.0 109.771 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -68.01 -39.68 83.13 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.707 -0.62 . . . . 0.0 109.727 179.635 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.734 HD23 HD12 ' A' ' 62' ' ' LEU . 11.0 tp -74.07 -30.75 62.53 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.632 -0.667 . . . . 0.0 109.685 179.552 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.613 ' HG2' HD11 ' A' ' 62' ' ' LEU . 3.8 mm-40 . . . . . 0 N--CA 1.494 1.732 0 O-C-N 121.604 -0.685 . . . . 0.0 109.852 179.544 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.491 ' HG ' HD23 ' B' ' 200' ' ' LEU . 1.5 tt . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 121.168 0.508 . . . . 0.0 109.953 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -61.78 -33.25 73.77 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.546 -0.721 . . . . 0.0 110.063 179.911 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.29 -48.84 63.9 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.615 -0.678 . . . . 0.0 109.796 179.782 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.4 m -63.04 -33.53 75.63 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 120.266 -0.573 . . . . 0.0 109.599 179.523 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.89 -28.74 69.75 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.66 -0.65 . . . . 0.0 109.819 179.651 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -63.21 -36.78 84.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.601 -0.687 . . . . 0.0 110.056 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -75.0 -35.85 62.0 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.66 -0.65 . . . . 0.0 109.65 179.656 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.57 ' CD1' HD22 ' B' ' 193' ' ' LEU . 50.8 mm -72.82 -28.46 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.679 -0.638 . . . . 0.0 109.545 179.434 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.5 tp -73.18 -40.16 65.02 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.555 -0.716 . . . . 0.0 109.875 179.516 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.6 ttpp -69.36 -32.57 71.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.622 -0.674 . . . . 0.0 109.597 179.54 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.78 HD12 HG12 ' B' ' 190' ' ' ILE . 1.5 mm? -69.42 -36.28 76.55 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.721 -0.612 . . . . 0.0 109.719 179.55 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -64.54 -33.46 75.96 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.629 -0.67 . . . . 0.0 109.727 179.712 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -74.38 -31.74 62.48 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.673 -0.642 . . . . 0.0 109.448 179.505 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -68.62 -30.47 69.2 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.768 -0.582 . . . . 0.0 109.747 179.599 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.501 HD13 HD12 ' B' ' 190' ' ' ILE . 14.2 tp -73.0 -34.36 66.35 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.56 -0.713 . . . . 0.0 109.696 179.664 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.82 -36.71 64.99 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.253 -0.579 . . . . 0.0 109.611 179.51 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.54 -29.98 67.7 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.708 -0.62 . . . . 0.0 109.723 179.565 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.568 HD12 HG12 ' B' ' 183' ' ' ILE . 0.3 OUTLIER -73.64 -44.01 58.02 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.67 -0.644 . . . . 0.0 109.624 179.607 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -68.68 -30.79 69.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.619 -0.675 . . . . 0.0 109.538 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.56 -29.56 68.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.602 -0.686 . . . . 0.0 109.703 179.527 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -67.42 -45.91 74.74 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.693 -0.629 . . . . 0.0 109.88 179.703 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.2 tttm -62.86 -29.98 71.16 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.529 -0.732 . . . . 0.0 109.682 179.466 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -64.18 -29.41 70.52 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.669 -0.644 . . . . 0.0 109.863 179.595 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.97 -39.22 79.58 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.521 -0.737 . . . . 0.0 109.797 179.74 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.478 HD23 HD21 ' B' ' 172' ' ' LEU . 2.6 mt -61.86 -31.06 71.3 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.544 -0.722 . . . . 0.0 109.873 179.727 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -61.84 -40.41 95.2 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.535 -0.728 . . . . 0.0 109.78 179.748 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.4 mt -72.5 -31.38 65.31 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.684 -0.635 . . . . 0.0 109.486 179.392 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -86.15 -14.76 43.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.756 -0.59 . . . . 0.0 110.634 179.533 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.425 HD11 HD11 ' B' ' 173' ' ' ILE . 50.7 tp . . . . . 0 N--CA 1.5 2.062 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.572 -179.895 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.353 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.75 HD12 ' N ' ' B' ' 168' ' ' SER . 2.6 pp -139.83 -45.98 0.44 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.614 -0.933 . . . . 0.0 110.458 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.75 ' N ' HD12 ' B' ' 167' ' ' LEU . 37.4 t -156.82 12.38 0.25 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.343 -0.848 . . . . 0.0 111.931 -179.945 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 39.5 tptt 49.24 26.48 1.53 Allowed 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.085 -1.01 . . . . 0.0 111.197 -179.826 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -152.23 -47.77 0.1 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.761 -0.587 . . . . 0.0 109.647 179.995 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.406 ' HB2' ' CD1' ' B' ' 167' ' ' LEU . 3.5 mm-40 -74.29 -34.0 63.41 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.374 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.565 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.7 tt -75.18 -27.91 59.85 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.798 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.425 HD11 HD11 ' A' ' 90' ' ' LEU . 50.6 mm -68.54 -31.5 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.6 -0.688 . . . . 0.0 109.374 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -68.52 -30.11 68.84 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.746 -0.596 . . . . 0.0 109.789 179.657 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -74.94 -29.26 60.89 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.63 -0.669 . . . . 0.0 109.924 179.808 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.03 -24.34 55.19 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.641 -0.662 . . . . 0.0 110.243 179.889 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.75 -27.05 31.33 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.451 -0.781 . . . . 0.0 109.691 179.464 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -37.82 37.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.564 -0.71 . . . . 0.0 109.868 179.729 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 11.3 p -73.92 -25.62 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 C-N-CA 119.88 -0.728 . . . . 0.0 109.831 179.508 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -73.97 -30.5 62.55 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.564 -0.71 . . . . 0.0 109.688 179.462 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 12.3 mtp180 -72.73 -29.91 63.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.618 -0.676 . . . . 0.0 109.784 179.62 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 182' ' ' GLU . . . . . 0.464 ' O ' HG23 ' B' ' 186' ' ' VAL . 0.6 OUTLIER -69.09 -31.0 69.42 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.598 -0.689 . . . . 0.0 109.872 179.705 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.568 HG12 HD12 ' A' ' 79' ' ' LEU . 82.9 mt -70.39 -31.39 46.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.696 -0.628 . . . . 0.0 109.629 179.695 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.33 -38.09 71.69 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.678 -0.639 . . . . 0.0 109.708 179.582 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 7.2 ttm -67.66 -39.34 84.54 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.612 -0.68 . . . . 0.0 109.746 179.621 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 186' ' ' VAL . . . . . 0.464 HG23 ' O ' ' B' ' 182' ' ' GLU . 70.1 t -72.34 -30.86 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.604 -0.685 . . . . 0.0 109.543 179.622 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -73.13 -28.44 62.25 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.654 -0.654 . . . . 0.0 109.977 179.664 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -72.66 -32.29 65.74 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.638 -0.664 . . . . 0.0 109.998 179.855 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -73.88 -38.88 64.26 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.715 -0.615 . . . . 0.0 109.823 179.807 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.78 HG12 HD12 ' A' ' 72' ' ' LEU . 79.4 mt -71.52 -31.52 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.468 179.577 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.0 m -67.91 -35.36 78.32 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.662 -0.649 . . . . 0.0 109.256 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.3 mmtp -77.92 -33.0 52.0 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 179.181 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.57 HD22 ' CD1' ' A' ' 69' ' ' ILE . 0.9 OUTLIER -74.85 -31.5 61.67 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.135 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 194' ' ' LYS . . . . . 0.427 ' HE3' HG21 ' A' ' 69' ' ' ILE . 0.0 OUTLIER -69.54 -40.94 76.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.692 -0.63 . . . . 0.0 109.425 179.4 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -31.0 71.47 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.248 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.417 ' HE2' HD23 ' B' ' 193' ' ' LEU . 24.8 ttpt -63.68 -36.5 84.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.666 -0.646 . . . . 0.0 109.375 179.245 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 31.8 tp60 -62.82 -30.45 71.49 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.793 -0.567 . . . . 0.0 109.692 179.504 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -61.28 -42.75 99.17 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.711 -0.618 . . . . 0.0 109.898 179.685 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -62.3 -43.02 99.8 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.707 -0.621 . . . . 0.0 109.84 179.719 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.491 HD23 ' HG ' ' A' ' 62' ' ' LEU . 14.0 tp -72.66 -30.27 64.13 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.659 -0.651 . . . . 0.0 109.656 179.46 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.608 -0.683 . . . . 0.0 109.889 179.548 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.555 ' HG ' HD23 ' B' ' 200' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 121.08 0.466 . . . . 0.0 110.223 . . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -75.42 -36.72 60.76 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.573 -0.705 . . . . 0.0 110.113 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -74.49 -30.54 61.86 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.691 -0.63 . . . . 0.0 109.922 179.735 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 70.4 m -74.81 -29.26 61.03 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.617 -0.677 . . . . 0.0 109.832 179.505 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.0 mmtt -72.47 -26.9 61.98 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.612 -0.68 . . . . 0.0 110.219 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.27 -31.89 64.34 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.521 -0.737 . . . . 0.0 110.305 179.986 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.9 tp60 -75.91 -33.36 59.9 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.525 -0.734 . . . . 0.0 109.877 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.659 HG12 HD23 ' B' ' 193' ' ' LEU . 88.3 mt -74.16 -26.87 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.663 -0.648 . . . . 0.0 109.8 179.706 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.573 ' O ' HD23 ' A' ' 70' ' ' LEU . 6.6 tt -74.93 -37.42 62.04 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.487 -0.758 . . . . 0.0 109.499 179.331 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -62.6 -29.91 70.95 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.646 -0.659 . . . . 0.0 109.521 179.202 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.615 HD22 HG12 ' B' ' 190' ' ' ILE . 12.5 mt -60.72 -30.01 69.71 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.616 -0.678 . . . . 0.0 109.935 179.654 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -61.99 -38.17 87.58 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.647 -0.658 . . . . 0.0 109.776 179.763 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.96 -31.85 56.87 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.217 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.482 ' O ' HD23 ' A' ' 79' ' ' LEU . 4.8 tttm -75.43 -31.56 60.39 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.82 -0.55 . . . . 0.0 109.781 179.561 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 46.9 tp -76.03 -33.36 59.64 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.592 -0.692 . . . . 0.0 109.709 179.633 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.2 tt -75.35 -35.37 61.15 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.728 -0.607 . . . . 0.0 109.473 179.314 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.51 68.19 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 120.228 -0.589 . . . . 0.0 109.656 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.482 HD23 ' O ' ' A' ' 75' ' ' LYS . 1.0 OUTLIER -68.75 -43.92 74.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.616 -0.678 . . . . 0.0 109.828 179.73 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -66.86 -31.12 71.52 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.586 -0.697 . . . . 0.0 109.623 179.586 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -68.05 -28.4 67.35 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.671 -0.643 . . . . 0.0 109.819 179.546 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.5 -43.27 85.76 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.57 -0.706 . . . . 0.0 109.954 179.858 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.51 ' HA ' HG11 ' B' ' 179' ' ' VAL . 8.8 ttpp -62.62 -30.13 71.12 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.593 -0.692 . . . . 0.0 109.822 179.818 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -64.48 -38.6 91.58 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.564 -0.71 . . . . 0.0 109.75 179.799 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -64.7 -29.43 70.42 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.707 -0.621 . . . . 0.0 109.708 179.59 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.442 HD12 ' HG3' ' B' ' 176' ' ' MET . 0.3 OUTLIER -65.1 -31.74 73.1 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.68 -0.637 . . . . 0.0 109.793 179.822 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -66.48 -45.68 78.85 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.663 -0.648 . . . . 0.0 110.143 179.998 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.8 mp -62.21 -32.71 73.4 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.69 -0.631 . . . . 0.0 109.899 179.777 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.416 ' O ' HD13 ' B' ' 172' ' ' LEU . 6.8 mt-30 -86.71 -22.04 26.28 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.732 -0.605 . . . . 0.0 110.372 179.714 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.789 HD11 ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.957 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.634 -179.907 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.734 HD12 ' N ' ' B' ' 168' ' ' SER . 2.8 pp -140.16 -44.92 0.42 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.59 -0.947 . . . . 0.0 110.582 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.734 ' N ' HD12 ' B' ' 167' ' ' LEU . 10.5 t -153.81 15.12 0.49 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.354 -0.841 . . . . 0.0 111.35 -179.99 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.0 tptt 49.64 26.41 1.78 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.091 -1.006 . . . . 0.0 111.048 -179.835 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -152.5 -46.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.697 -0.627 . . . . 0.0 110.052 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.549 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.7 OUTLIER -74.44 -34.62 63.24 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.215 179.45 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.563 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.5 tt -75.92 -27.32 57.57 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.864 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.789 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.8 mm -68.76 -32.02 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.627 -0.671 . . . . 0.0 109.336 179.331 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -72.98 -28.51 62.44 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.725 -0.609 . . . . 0.0 109.891 179.542 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.805 ' O ' HG23 ' B' ' 179' ' ' VAL . 78.7 m-20 -71.48 -29.52 64.92 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.682 -0.636 . . . . 0.0 109.994 179.818 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.637 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -69.28 -30.73 68.88 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.583 -0.698 . . . . 0.0 109.871 179.923 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -77.03 -31.41 56.27 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.707 -0.621 . . . . 0.0 109.718 179.67 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 5.2 tpm_? -74.51 -30.26 61.73 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.675 -0.641 . . . . 0.0 109.784 179.57 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.805 HG23 ' O ' ' B' ' 175' ' ' ASN . 65.4 t -71.79 -29.78 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.685 -0.635 . . . . 0.0 109.735 179.66 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -78.26 -23.46 47.27 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.614 -0.679 . . . . 0.0 110.306 179.751 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.48 -28.41 37.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.437 -0.789 . . . . 0.0 109.087 179.448 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -72.0 -29.4 64.17 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.49 -0.756 . . . . 0.0 109.952 179.613 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 84.8 mt -73.83 -29.66 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.647 -0.658 . . . . 0.0 109.826 179.808 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 12.9 m -72.86 -30.14 63.74 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.622 -0.674 . . . . 0.0 109.96 179.787 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.7 mtt -73.99 -40.71 62.77 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.673 -0.642 . . . . 0.0 109.906 179.767 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.4 t -71.48 -30.37 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.621 -0.674 . . . . 0.0 109.577 179.718 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -73.34 -28.81 62.27 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.616 -0.677 . . . . 0.0 109.991 179.638 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -72.39 -28.51 63.04 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.575 -0.703 . . . . 0.0 110.085 179.806 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -30.66 58.54 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.565 -0.71 . . . . 0.0 110.082 179.969 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.615 HG12 HD22 ' A' ' 72' ' ' LEU . 76.4 mt -76.79 -31.13 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.583 -0.698 . . . . 0.0 109.789 179.834 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 14.7 m -73.78 -31.27 63.22 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.744 -0.597 . . . . 0.0 109.609 179.37 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 26.1 mmtm -76.63 -34.73 58.31 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.416 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.659 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -70.17 -34.63 73.23 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.307 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -63.96 -45.15 90.42 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.331 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -71.31 -31.11 67.05 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.023 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -69.98 -35.03 74.11 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.222 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.11 -30.1 71.19 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.678 -0.639 . . . . 0.0 109.602 179.464 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -61.41 -43.05 99.53 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.742 -0.598 . . . . 0.0 109.92 179.695 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -61.97 -38.62 89.23 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.673 -0.642 . . . . 0.0 109.908 179.836 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.555 HD23 ' HG ' ' A' ' 62' ' ' LEU . 0.4 OUTLIER -75.08 -29.79 60.75 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.607 -0.683 . . . . 0.0 109.766 179.554 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.414 ' HA ' HD11 ' A' ' 62' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.73 0 O-C-N 121.634 -0.666 . . . . 0.0 109.802 179.676 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.703 HD11 ' CG ' ' B' ' 201' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 121.13 0.49 . . . . 0.0 110.025 . . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -72.57 -34.62 67.59 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.552 -0.718 . . . . 0.0 109.917 179.798 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -76.46 -33.54 58.73 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.675 -0.641 . . . . 0.0 109.562 179.521 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.9 m -74.2 -30.8 62.37 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.732 -0.605 . . . . 0.0 109.428 179.351 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -69.76 -27.9 65.32 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.705 -0.622 . . . . 0.0 109.987 179.663 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.94 -37.69 75.93 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.473 -0.767 . . . . 0.0 110.15 179.982 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.13 -40.79 64.64 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.593 -0.692 . . . . 0.0 109.634 179.644 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.699 HG12 HD23 ' B' ' 193' ' ' LEU . 94.7 mt -68.29 -26.92 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.746 -0.596 . . . . 0.0 109.433 179.367 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.4 mt -67.09 -38.55 85.9 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.455 -0.778 . . . . 0.0 109.635 179.433 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -31.15 65.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.532 -0.73 . . . . 0.0 109.614 179.386 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.46 HD12 HD22 ' B' ' 193' ' ' LEU . 8.6 mt -71.69 -34.24 69.47 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.684 -0.635 . . . . 0.0 109.725 179.516 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -67.89 -30.83 70.27 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.587 -0.696 . . . . 0.0 109.746 179.652 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.31 -30.16 57.62 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.678 -0.639 . . . . 0.0 109.674 179.556 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -72.47 -29.15 63.39 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.712 -0.617 . . . . 0.0 109.884 179.667 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.1 tp -70.88 -35.56 72.41 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.515 -0.741 . . . . 0.0 109.838 179.817 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 87.9 mt -75.3 -32.73 61.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.696 -0.628 . . . . 0.0 109.664 179.606 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.83 -30.0 62.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.722 -0.611 . . . . 0.0 109.642 179.444 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.406 ' HA ' HD13 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -71.89 -39.7 69.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.677 -0.64 . . . . 0.0 109.694 179.65 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -71.82 -32.17 67.3 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.559 -0.713 . . . . 0.0 109.452 179.404 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -68.15 -29.77 68.74 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.79 -0.569 . . . . 0.0 109.544 179.348 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -62.84 -43.03 99.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.685 -0.635 . . . . 0.0 109.707 179.639 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -66.29 -32.27 73.57 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.554 -0.716 . . . . 0.0 109.484 179.48 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -63.74 -31.61 72.84 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.695 -0.628 . . . . 0.0 109.754 179.459 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -71.08 -35.11 71.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.642 -0.661 . . . . 0.0 109.619 179.566 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.716 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.2 OUTLIER -64.84 -30.18 71.17 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.568 -0.707 . . . . 0.0 109.637 179.559 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -61.93 -40.16 94.56 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.69 -0.631 . . . . 0.0 109.766 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.81 -30.71 71.68 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.704 -0.623 . . . . 0.0 109.738 179.64 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -84.14 -17.41 40.16 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.634 -0.666 . . . . 0.0 110.572 179.696 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.685 HD13 ' HE3' ' B' ' 176' ' ' MET . 53.1 tp . . . . . 0 N--CA 1.501 2.097 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.531 -179.939 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 166' ' ' GLY . . . . . 0.503 ' HA2' HD13 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.727 HD12 ' N ' ' B' ' 168' ' ' SER . 2.9 pp -139.54 -44.2 0.45 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.647 -0.913 . . . . 0.0 110.534 -179.917 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.727 ' N ' HD12 ' B' ' 167' ' ' LEU . 69.4 m -153.66 15.82 0.51 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.35 -0.843 . . . . 0.0 111.248 179.834 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 8.3 tptt 49.34 26.48 1.6 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.104 -0.998 . . . . 0.0 110.984 -179.789 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -151.65 -46.44 0.11 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.658 -0.651 . . . . 0.0 110.151 -179.926 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.611 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -73.58 -36.55 65.59 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.177 179.609 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.581 HD21 HD23 ' A' ' 86' ' ' LEU . 1.9 tt -74.22 -28.17 61.13 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.894 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.432 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.0 mm -66.89 -34.58 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.264 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -72.57 -29.07 63.21 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.611 179.257 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -70.63 -40.38 73.12 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.685 -0.634 . . . . 0.0 109.958 179.634 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.716 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -62.94 -30.77 71.82 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.655 -0.653 . . . . 0.0 109.749 179.87 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -75.45 -28.73 59.42 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.606 -0.684 . . . . 0.0 109.87 179.535 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -73.52 -31.31 63.62 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.563 -0.71 . . . . 0.0 110.139 179.893 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.557 HG21 ' CD1' ' A' ' 86' ' ' LEU . 57.6 t -72.26 -29.58 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.621 -0.674 . . . . 0.0 109.807 179.784 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 180' ' ' ASP . . . . . 0.45 ' HA ' HD12 ' B' ' 183' ' ' ILE . 4.0 t70 -72.55 -30.25 64.28 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.55 -0.719 . . . . 0.0 109.928 179.713 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 1.3 tpt85 -74.68 -28.99 61.06 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.757 -0.589 . . . . 0.0 109.913 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -73.96 -33.01 63.73 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.612 -0.68 . . . . 0.0 110.018 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.45 HD12 ' HA ' ' B' ' 180' ' ' ASP . 67.5 mt -71.17 -29.23 35.5 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 O-C-N 121.644 -0.66 . . . . 0.0 109.727 179.742 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -34.58 75.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.621 -0.674 . . . . 0.0 109.783 179.651 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.0 ttt -67.99 -46.28 71.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.68 -0.638 . . . . 0.0 109.815 179.674 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 61.3 t -68.54 -30.27 46.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.552 -0.717 . . . . 0.0 109.573 179.66 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -73.7 -29.44 62.28 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.669 -0.644 . . . . 0.0 109.916 179.659 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -72.04 -30.58 65.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.638 -0.664 . . . . 0.0 109.987 179.819 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -40.25 61.99 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.652 -0.655 . . . . 0.0 109.694 179.662 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.455 HG12 HD22 ' A' ' 72' ' ' LEU . 79.7 mt -70.5 -29.78 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.677 -0.639 . . . . 0.0 109.656 179.572 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -34.59 73.79 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.619 -0.675 . . . . 0.0 109.553 179.515 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 55.7 mmtt -75.86 -35.86 59.78 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.677 -0.64 . . . . 0.0 109.654 179.666 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.699 HD23 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -77.14 -19.72 56.52 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.694 -0.628 . . . . 0.0 110.257 179.466 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 22.3 mmtt -84.73 -28.43 26.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.279 -0.888 . . . . 0.0 109.455 179.316 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.4 mmtm -78.61 -36.25 44.42 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.733 -0.604 . . . . 0.0 109.734 179.48 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' B' ' 193' ' ' LEU . 0.0 OUTLIER -71.74 -28.06 63.41 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.494 179.41 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -68.64 -29.22 67.66 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.613 -0.679 . . . . 0.0 109.466 179.253 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.86 -46.69 88.36 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.68 -0.638 . . . . 0.0 109.599 179.525 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -61.38 -35.89 78.75 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.738 -0.601 . . . . 0.0 109.881 179.669 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.675 HD23 HD12 ' A' ' 62' ' ' LEU . 6.8 tp -77.65 -31.86 52.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.574 -0.704 . . . . 0.0 109.601 179.412 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.703 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.3 mt-10 . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.717 -0.615 . . . . 0.0 109.681 179.447 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.8 tt . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 121.085 0.469 . . . . 0.0 110.026 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -67.58 -39.46 84.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.568 -0.708 . . . . 0.0 110.022 179.959 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -73.41 -30.82 63.5 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.675 -0.641 . . . . 0.0 109.753 179.624 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.2 m -74.44 -29.59 61.54 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.632 -0.667 . . . . 0.0 109.714 179.551 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -71.32 -28.12 63.87 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.655 -0.653 . . . . 0.0 110.047 179.711 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -70.21 -33.63 71.91 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.636 -0.665 . . . . 0.0 110.145 179.911 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -76.46 -34.36 58.7 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.651 -0.655 . . . . 0.0 109.857 179.669 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.739 HG12 HD22 ' B' ' 193' ' ' LEU . 74.5 mt -74.85 -27.87 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.667 -0.645 . . . . 0.0 109.683 179.498 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.467 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.3 tt -74.12 -29.72 61.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.587 -0.696 . . . . 0.0 109.982 179.666 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -74.74 -38.89 62.13 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.517 -0.739 . . . . 0.0 109.931 179.748 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.728 HD22 ' CD1' ' B' ' 193' ' ' LEU . 2.7 tp -70.9 -27.42 63.78 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.603 -0.686 . . . . 0.0 109.922 179.573 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -71.76 -33.25 68.49 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.541 -0.724 . . . . 0.0 109.553 179.371 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -74.31 -30.34 62.01 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.787 -0.571 . . . . 0.0 109.577 179.496 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.8 tttt -72.15 -37.7 69.33 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.586 -0.696 . . . . 0.0 109.824 179.685 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.579 HD13 ' HA ' ' B' ' 187' ' ' GLU . 24.1 tp -66.91 -31.16 71.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.56 -0.712 . . . . 0.0 109.967 179.703 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 tp -76.61 -34.14 58.39 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.683 -0.636 . . . . 0.0 109.849 179.75 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.65 -28.17 60.75 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 120.254 -0.578 . . . . 0.0 109.932 179.558 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.418 HD12 ' CG1' ' B' ' 183' ' ' ILE . 0.3 OUTLIER -76.07 -36.12 59.11 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.581 -0.699 . . . . 0.0 109.81 179.751 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -72.78 -29.06 62.98 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.576 -0.702 . . . . 0.0 109.886 179.618 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -72.36 -28.25 62.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.658 -0.651 . . . . 0.0 109.965 179.564 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.24 -41.21 70.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.673 -0.642 . . . . 0.0 110.033 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 tttm -65.19 -29.52 70.34 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.511 -0.743 . . . . 0.0 109.753 179.742 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -64.79 -33.4 75.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.599 -0.688 . . . . 0.0 109.83 179.662 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -69.27 -29.87 67.85 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.649 -0.657 . . . . 0.0 109.784 179.687 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.608 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.3 OUTLIER -67.15 -37.04 83.09 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.695 -0.628 . . . . 0.0 109.893 179.738 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -61.52 -33.49 73.91 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.585 -0.697 . . . . 0.0 109.97 179.921 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.3 mp -77.99 -29.37 49.6 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.602 -0.686 . . . . 0.0 109.804 179.686 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -88.7 -21.01 24.11 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.655 -0.653 . . . . 0.0 110.545 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.497 ' HA ' HD22 ' B' ' 172' ' ' LEU . 54.1 tp . . . . . 0 N--CA 1.5 2.049 0 CA-C-O 118.014 -0.994 . . . . 0.0 110.545 -179.931 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 166' ' ' GLY . . . . . 0.637 ' HA3' HD13 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.76 HD11 ' CB ' ' B' ' 171' ' ' GLU . 3.2 pp -143.08 -42.24 0.3 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.687 -0.89 . . . . 0.0 110.761 -179.527 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.734 ' N ' HD12 ' B' ' 167' ' ' LEU . 53.1 m -153.07 17.85 0.57 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.32 -0.863 . . . . 0.0 111.039 179.999 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 169' ' ' LYS . . . . . 0.461 ' C ' HD13 ' B' ' 173' ' ' ILE . 4.8 tptm 49.73 26.63 1.92 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.244 -0.91 . . . . 0.0 110.884 -179.729 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -151.79 -46.77 0.11 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.7 -0.625 . . . . 0.0 110.133 -179.996 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.76 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -74.48 -30.79 61.98 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.798 -0.761 . . . . 0.0 109.294 179.512 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.637 HD13 ' HA3' ' B' ' 166' ' ' GLY . 2.9 tt -78.31 -30.43 48.27 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.727 -0.608 . . . . 0.0 109.583 179.176 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.616 ' N ' HD12 ' B' ' 173' ' ' ILE . 1.9 mp -73.03 -33.97 44.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.409 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.23 -32.55 72.82 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.955 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.763 ' O ' HG23 ' B' ' 179' ' ' VAL . 84.7 m-20 -73.02 -38.57 66.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.715 -0.615 . . . . 0.0 109.427 179.222 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.608 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -64.79 -30.63 71.65 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.696 -0.628 . . . . 0.0 109.645 179.637 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -78.89 -30.95 45.2 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.655 -0.653 . . . . 0.0 109.831 179.738 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.37 -29.89 47.68 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.744 -0.597 . . . . 0.0 109.684 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.763 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.4 t -76.3 -29.73 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.72 -0.613 . . . . 0.0 109.58 179.57 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -73.43 -30.59 63.32 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.523 -0.735 . . . . 0.0 109.915 179.833 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.21 -29.3 60.27 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.674 -0.642 . . . . 0.0 109.942 179.714 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 182' ' ' GLU . . . . . 0.664 ' O ' HG23 ' B' ' 186' ' ' VAL . 6.5 tt0 -75.93 -36.7 59.27 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.634 -0.666 . . . . 0.0 109.914 179.831 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.418 ' CG1' HD12 ' A' ' 79' ' ' LEU . 72.8 mt -71.28 -29.92 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.705 -0.622 . . . . 0.0 109.511 179.663 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 86.0 m -72.21 -39.32 68.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.61 -0.681 . . . . 0.0 109.743 179.594 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 mtp -72.53 -37.7 68.26 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.635 -0.665 . . . . 0.0 109.495 179.525 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 186' ' ' VAL . . . . . 0.664 HG23 ' O ' ' B' ' 182' ' ' GLU . 66.5 t -72.56 -34.79 49.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 179.283 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 187' ' ' GLU . . . . . 0.579 ' HA ' HD13 ' A' ' 76' ' ' LEU . 21.3 tt0 -64.87 -33.27 75.61 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.748 -0.595 . . . . 0.0 109.526 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -67.39 -26.1 66.28 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.677 -0.639 . . . . 0.0 109.933 179.562 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -76.31 -25.34 54.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.52 -0.737 . . . . 0.0 110.361 179.871 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.606 HD13 HD23 ' A' ' 72' ' ' LEU . 25.6 mm -80.38 -35.95 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.484 -0.76 . . . . 0.0 109.398 -179.945 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 14.9 m -76.01 -29.38 58.12 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.755 -0.591 . . . . 0.0 109.839 179.595 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 7.3 mmmt -77.51 -31.58 53.56 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.624 -0.672 . . . . 0.0 109.786 179.708 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.739 HD22 HG12 ' A' ' 69' ' ' ILE . 0.4 OUTLIER -75.68 -29.71 59.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.546 -0.721 . . . . 0.0 109.49 179.491 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -34.52 71.07 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.63 -0.669 . . . . 0.0 109.762 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -71.78 -31.23 66.39 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.676 -0.64 . . . . 0.0 109.71 179.561 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -68.4 -31.51 70.91 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.674 -0.641 . . . . 0.0 109.576 179.509 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -66.7 -30.43 70.67 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.69 -0.631 . . . . 0.0 109.734 179.533 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -62.65 -40.79 98.13 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.651 -0.656 . . . . 0.0 109.794 179.706 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -62.25 -39.73 93.83 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.779 179.681 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 8.7 tp -73.59 -33.21 64.51 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.563 -0.71 . . . . 0.0 109.71 179.473 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.74 0 O-C-N 121.72 -0.612 . . . . 0.0 109.753 179.553 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.677 HD11 ' HG2' ' B' ' 201' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 121.128 0.489 . . . . 0.0 109.813 . . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.92 -32.65 74.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.594 -0.691 . . . . 0.0 109.934 179.81 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -75.48 -36.98 60.52 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.598 -0.689 . . . . 0.0 109.771 179.68 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.47 HG23 ' NZ ' ' B' ' 196' ' ' LYS . 32.3 m -72.91 -30.57 64.02 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.694 -0.628 . . . . 0.0 109.557 179.438 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.488 ' O ' HD23 ' A' ' 70' ' ' LEU . 0.6 OUTLIER -70.04 -28.2 65.28 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.689 -0.632 . . . . 0.0 109.803 179.514 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -66.65 -37.92 85.8 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.585 -0.697 . . . . 0.0 110.081 179.926 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.46 -40.33 67.07 Favored 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.64 179.605 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.835 HG12 HD23 ' B' ' 193' ' ' LEU . 49.1 mt -68.41 -26.84 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.793 -0.567 . . . . 0.0 109.502 179.457 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.488 HD23 ' O ' ' A' ' 66' ' ' LYS . 0.7 OUTLIER -68.67 -37.42 79.6 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.533 -0.729 . . . . 0.0 109.796 179.563 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -68.39 -31.6 71.07 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.588 -0.695 . . . . 0.0 109.846 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.573 HD22 HG12 ' B' ' 190' ' ' ILE . 8.9 mt -68.65 -29.37 67.84 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.655 -0.653 . . . . 0.0 110.039 179.84 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -70.88 -31.16 67.74 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.595 -0.691 . . . . 0.0 109.958 179.824 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -78.12 -31.35 49.89 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.554 -0.716 . . . . 0.0 109.712 179.572 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -74.72 -29.45 61.19 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.707 -0.621 . . . . 0.0 109.771 179.506 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.549 HD13 HD12 ' B' ' 190' ' ' ILE . 14.8 tp -72.29 -34.77 68.41 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.626 -0.671 . . . . 0.0 109.883 179.756 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.8 mt -75.18 -36.45 61.47 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.643 -0.66 . . . . 0.0 109.426 179.513 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.12 -28.45 67.33 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.082 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' B' ' 183' ' ' ILE . 6.1 tp -67.9 -48.16 66.79 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.72 -0.613 . . . . 0.0 110.054 179.698 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -63.06 -25.91 68.6 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.612 -0.68 . . . . 0.0 110.366 179.868 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.57 -29.96 63.99 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.426 -0.796 . . . . 0.0 110.148 179.88 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -76.76 -46.9 23.41 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.591 -0.693 . . . . 0.0 109.603 179.555 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.667 ' HG3' HD11 ' B' ' 183' ' ' ILE . 11.3 mmtt -65.67 -24.34 66.99 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.647 -0.821 . . . . 0.0 108.815 178.686 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -60.82 -26.57 67.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.428 -0.795 . . . . 0.0 109.266 178.403 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.3 tp60 -59.15 -38.92 80.84 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.512 -0.743 . . . . 0.0 109.733 179.191 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.561 HD21 ' HB3' ' B' ' 175' ' ' ASN . 0.2 OUTLIER -67.69 -34.33 76.69 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 179.137 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -61.84 -29.82 70.43 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.741 -0.599 . . . . 0.0 109.818 179.524 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.07 -28.08 65.14 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.657 -0.652 . . . . 0.0 109.993 179.673 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -95.02 -7.24 40.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.623 -0.673 . . . . 0.0 111.063 179.946 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.017 HD23 ' HE3' ' B' ' 176' ' ' MET . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.034 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.418 -179.969 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.541 HD11 ' CB ' ' B' ' 171' ' ' GLU . 1.3 pp -50.92 -47.14 61.01 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.848 -0.795 . . . . 0.0 111.594 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.518 ' N ' HD12 ' B' ' 167' ' ' LEU . 7.6 t -152.96 15.99 0.56 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.228 -0.92 . . . . 0.0 111.278 179.982 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 6.9 tptm 49.7 26.33 1.8 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.179 -0.951 . . . . 0.0 110.985 -179.893 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -151.71 -46.83 0.11 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.659 -0.65 . . . . 0.0 109.974 -179.944 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.541 ' CB ' HD11 ' B' ' 167' ' ' LEU . 1.9 mt-10 -75.08 -32.21 61.41 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 119.881 -0.728 . . . . 0.0 109.182 179.407 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.569 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.5 tt -78.45 -28.23 46.54 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 178.886 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.723 HD13 HD21 ' A' ' 90' ' ' LEU . 49.6 mm -71.69 -32.28 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.655 -0.653 . . . . 0.0 109.433 179.52 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 65.5 mm-40 -68.2 -32.79 73.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.655 -0.653 . . . . 0.0 109.671 179.541 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.676 ' O ' HG23 ' B' ' 179' ' ' VAL . 43.0 m-20 -63.52 -46.04 87.9 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.482 179.384 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 176' ' ' MET . . . . . 1.017 ' HE3' HD23 ' A' ' 90' ' ' LEU . 8.2 mtt -52.85 -31.86 41.56 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.665 -0.647 . . . . 0.0 110.73 179.765 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -68.8 -52.95 24.67 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.683 -0.635 . . . . 0.0 109.75 179.839 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -28.19 67.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.736 -0.603 . . . . 0.0 109.78 179.48 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.676 HG23 ' O ' ' B' ' 175' ' ' ASN . 94.3 t -77.88 -32.08 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.636 -0.665 . . . . 0.0 109.752 179.703 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -74.92 -31.38 61.52 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.562 -0.711 . . . . 0.0 109.64 179.553 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -25.27 64.18 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.724 -0.61 . . . . 0.0 109.86 179.345 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -68.62 -42.25 78.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.534 -0.729 . . . . 0.0 110.419 179.994 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.667 HD11 ' HG3' ' A' ' 83' ' ' LYS . 69.7 mt -66.94 -28.91 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.429 179.697 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 24.5 m -63.55 -32.05 73.39 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.608 -0.682 . . . . 0.0 109.623 179.43 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 1.2 ttt -68.52 -51.02 47.71 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.59 -0.694 . . . . 0.0 109.783 179.62 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.8 t -68.73 -31.61 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.546 -0.721 . . . . 0.0 109.425 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -75.3 -28.34 59.66 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.735 -0.603 . . . . 0.0 109.895 179.584 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -74.6 -27.87 60.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.605 -0.685 . . . . 0.0 110.085 179.76 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -74.23 -33.28 63.31 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.597 -0.689 . . . . 0.0 109.967 179.852 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.573 HG12 HD22 ' A' ' 72' ' ' LEU . 72.1 mt -73.26 -31.08 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.647 -0.658 . . . . 0.0 109.495 179.769 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.23 -31.81 71.57 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.716 -0.615 . . . . 0.0 109.48 179.377 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 23.7 mmtt -77.25 -34.1 55.87 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.678 -0.639 . . . . 0.0 109.511 179.381 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.835 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -72.72 -31.49 65.01 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.294 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.9 tptp -66.5 -40.83 89.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.623 -0.673 . . . . 0.0 109.372 179.323 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.92 -30.41 70.55 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.224 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 196' ' ' LYS . . . . . 0.47 ' NZ ' HG23 ' A' ' 65' ' ' THR . 24.8 ttpt -63.35 -36.93 85.34 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.319 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -63.24 -30.64 71.75 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.692 -0.63 . . . . 0.0 109.519 179.464 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -61.32 -38.52 87.18 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.725 -0.609 . . . . 0.0 109.785 179.684 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.85 -39.83 93.21 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.719 -0.613 . . . . 0.0 109.862 179.772 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.8 tp -72.76 -30.7 64.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.658 -0.651 . . . . 0.0 109.831 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 201' ' ' GLU . . . . . 0.677 ' HG2' HD11 ' A' ' 62' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.495 1.79 0 O-C-N 121.61 -0.682 . . . . 0.0 109.782 179.639 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.906 HD12 HD23 ' B' ' 200' ' ' LEU . 7.4 tp . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 121.063 0.459 . . . . 0.0 110.066 . . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -66.27 -29.49 69.73 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.575 -0.703 . . . . 0.0 110.162 179.997 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -72.72 -44.61 61.48 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.589 -0.694 . . . . 0.0 109.886 179.786 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.499 HG22 HD11 ' A' ' 69' ' ' ILE . 51.6 m -65.27 -30.27 71.12 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.646 -0.659 . . . . 0.0 109.648 179.51 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -66.4 -28.22 68.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.704 -0.623 . . . . 0.0 109.945 179.608 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.15 -44.01 89.98 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.614 -0.679 . . . . 0.0 110.101 179.938 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -39.05 72.7 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.651 -0.656 . . . . 0.0 109.642 179.739 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.546 HG12 HD22 ' B' ' 193' ' ' LEU . 81.5 mt -71.03 -25.89 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.719 -0.613 . . . . 0.0 109.634 179.42 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.454 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.2 tt -72.32 -34.42 68.06 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.534 -0.728 . . . . 0.0 110.001 179.755 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp -67.3 -36.63 81.9 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.491 -0.755 . . . . 0.0 109.91 179.806 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.667 HD22 ' CG1' ' B' ' 190' ' ' ILE . 7.3 mt -64.74 -28.29 69.49 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.669 -0.645 . . . . 0.0 109.944 179.748 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -66.08 -38.3 87.95 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.593 -0.692 . . . . 0.0 110.13 179.962 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.96 -31.08 61.39 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.611 -0.681 . . . . 0.0 109.743 179.654 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -77.9 -30.41 50.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.618 -0.676 . . . . 0.0 109.635 179.691 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -78.78 -30.87 45.82 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.62 -0.675 . . . . 0.0 109.725 179.604 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.5 mt -77.28 -30.54 54.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.642 -0.661 . . . . 0.0 109.753 179.584 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.01 -28.4 60.51 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.667 -0.646 . . . . 0.0 110.032 179.638 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.584 HD12 HG12 ' B' ' 183' ' ' ILE . 0.5 OUTLIER -76.65 -36.06 57.61 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.596 -0.69 . . . . 0.0 109.875 179.796 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -74.72 -27.38 60.35 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.616 -0.677 . . . . 0.0 109.993 179.731 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -76.53 -27.7 56.05 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.565 -0.709 . . . . 0.0 109.782 179.597 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.71 -41.95 59.24 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.663 -0.648 . . . . 0.0 109.886 179.63 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.41 ' HB3' HG11 ' B' ' 179' ' ' VAL . 11.4 ptmt -65.65 -26.31 67.74 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.758 -0.777 . . . . 0.0 109.672 179.362 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -63.8 -29.42 70.63 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.572 -0.705 . . . . 0.0 109.621 179.258 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -63.97 -35.43 80.67 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.6 -0.687 . . . . 0.0 109.877 179.717 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.55 HD22 ' HG2' ' B' ' 176' ' ' MET . 0.5 OUTLIER -66.01 -33.11 75.05 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.6 -0.688 . . . . 0.0 109.605 179.723 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.44 ' HA ' ' HE2' ' B' ' 176' ' ' MET . 6.7 m-85 -62.77 -29.27 70.57 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.609 -0.682 . . . . 0.0 110.049 179.782 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.35 -29.09 59.83 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.589 -0.695 . . . . 0.0 110.14 179.834 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -87.57 -26.66 23.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.653 -0.654 . . . . 0.0 110.371 179.894 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.494 HD22 ' HE3' ' B' ' 176' ' ' MET . 45.4 tp . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.21 -179.978 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' B' B ' 167' ' ' LEU . . . . . 0.718 HD12 ' N ' ' B' ' 168' ' ' SER . 3.0 pp -141.46 -42.94 0.36 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.567 -0.961 . . . . 0.0 110.724 -179.735 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 168' ' ' SER . . . . . 0.718 ' N ' HD12 ' B' ' 167' ' ' LEU . 48.1 t -153.34 16.97 0.54 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.317 -0.864 . . . . 0.0 111.234 179.934 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 169' ' ' LYS . . . . . 0.469 ' C ' HD13 ' B' ' 173' ' ' ILE . 34.3 tptt 50.03 26.26 1.99 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.099 -1.001 . . . . 0.0 111.084 -179.954 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -154.3 -45.52 0.09 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.6 -0.687 . . . . 0.0 110.409 179.982 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.673 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -74.48 -30.75 61.97 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.899 -0.72 . . . . 0.0 109.434 179.691 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' B' B ' 172' ' ' LEU . . . . . 0.495 HD21 HD23 ' A' ' 86' ' ' LEU . 3.3 tt -79.29 -29.56 42.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.733 -0.605 . . . . 0.0 109.601 179.18 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 173' ' ' ILE . . . . . 0.643 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.5 mp -77.56 -34.55 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.405 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -65.27 -33.61 76.39 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.832 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 175' ' ' ASN . . . . . 0.749 ' O ' HG23 ' B' ' 179' ' ' VAL . 81.4 m-20 -75.58 -36.21 60.4 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.976 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 176' ' ' MET . . . . . 0.55 ' HG2' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -68.05 -30.71 69.99 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.678 -0.638 . . . . 0.0 109.804 179.437 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -75.34 -34.51 61.2 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.644 -0.66 . . . . 0.0 109.677 179.655 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -30.05 67.99 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.689 -0.632 . . . . 0.0 109.63 179.488 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 179' ' ' VAL . . . . . 0.749 HG23 ' O ' ' B' ' 175' ' ' ASN . 82.4 t -66.28 -32.14 56.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.695 -0.628 . . . . 0.0 109.699 179.711 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.56 -43.18 90.63 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.7 -0.625 . . . . 0.0 109.93 179.882 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -34.07 75.59 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.733 -0.605 . . . . 0.0 109.97 179.8 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -71.16 -45.91 62.51 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.521 -0.737 . . . . 0.0 109.855 179.842 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 183' ' ' ILE . . . . . 0.584 HG12 HD12 ' A' ' 79' ' ' LEU . 78.0 mt -69.73 -29.45 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.649 -0.657 . . . . 0.0 109.38 179.513 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 87.7 m -70.22 -32.49 70.4 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.633 -0.667 . . . . 0.0 109.43 179.343 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.4 ttm -70.22 -48.33 57.49 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.623 -0.673 . . . . 0.0 109.754 179.511 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.8 t -69.84 -31.32 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.551 -0.718 . . . . 0.0 109.376 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -73.99 -29.79 62.14 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.705 -0.622 . . . . 0.0 109.757 179.522 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.24 -30.7 67.83 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.625 -0.672 . . . . 0.0 109.827 179.54 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -37.65 67.64 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.673 -0.642 . . . . 0.0 109.621 179.652 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 190' ' ' ILE . . . . . 0.667 ' CG1' HD22 ' A' ' 72' ' ' LEU . 82.1 mt -69.26 -31.43 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.623 -0.673 . . . . 0.0 109.495 179.542 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.13 -41.59 85.88 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.659 -0.651 . . . . 0.0 109.617 179.55 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -70.69 -35.87 72.99 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.635 -0.665 . . . . 0.0 109.583 179.528 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 193' ' ' LEU . . . . . 0.546 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -70.71 -31.32 68.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.673 -0.642 . . . . 0.0 109.501 179.399 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.4 tptp -69.14 -41.13 77.72 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.637 -0.664 . . . . 0.0 109.699 179.482 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -62.79 -31.69 72.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.665 -0.647 . . . . 0.0 109.508 179.518 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -37.16 86.17 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.696 -0.628 . . . . 0.0 109.382 179.256 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -62.72 -29.6 70.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.734 -0.604 . . . . 0.0 109.642 179.496 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.76 -43.61 98.52 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.632 -0.667 . . . . 0.0 109.741 179.695 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -63.09 -44.71 94.96 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.712 -0.618 . . . . 0.0 109.853 179.796 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 200' ' ' LEU . . . . . 0.906 HD23 HD12 ' A' ' 62' ' ' LEU . 18.4 tp -71.6 -31.28 66.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.589 -0.694 . . . . 0.0 109.809 179.59 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 . . . . . 0 N--CA 1.493 1.696 0 O-C-N 121.622 -0.674 . . . . 0.0 109.834 179.595 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.1 0.476 . . . . 0.0 110.18 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.4 mttm -112.57 -172.76 2.11 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.57 -0.706 . . . . 0.0 110.196 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 52.7 34.74 16.7 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.402 -0.811 . . . . 0.0 110.77 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 15.3 ttm -109.87 -26.51 9.75 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.601 -0.687 . . . . 0.0 110.453 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -60.13 -31.72 70.33 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.502 -0.748 . . . . 0.0 110.235 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -73.81 -29.79 62.35 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.648 -0.658 . . . . 0.0 109.84 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -71.61 -27.86 63.4 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.689 -0.632 . . . . 0.0 110.011 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 mmt -70.38 -33.58 71.58 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.552 -0.717 . . . . 0.0 110.165 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.6 m -72.88 -30.72 64.18 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.602 -0.686 . . . . 0.0 109.905 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.722 HD11 ' HG2' ' B' ' 201' ' ' GLU . 6.3 tt -70.75 -28.67 64.87 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.679 -0.638 . . . . 0.0 109.882 179.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -67.47 -29.93 69.5 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.544 -0.722 . . . . 0.0 109.955 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -74.94 -35.59 62.15 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.651 -0.656 . . . . 0.0 109.943 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 88.3 m -71.29 -30.81 66.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.763 -0.586 . . . . 0.0 109.682 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -68.74 -28.71 67.06 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.618 -0.676 . . . . 0.0 109.899 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -66.86 -32.36 73.58 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.585 -0.697 . . . . 0.0 110.022 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -78.18 -31.34 49.53 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.644 -0.66 . . . . 0.0 109.695 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.672 HG12 HD22 ' B' ' 193' ' ' LEU . 85.4 mt -77.28 -29.67 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.663 -0.648 . . . . 0.0 109.539 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.97 -33.35 63.82 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.639 -0.663 . . . . 0.0 109.651 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.9 tptt -66.31 -30.7 71.16 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.655 -0.653 . . . . 0.0 109.563 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.65 HD11 HD13 ' B' ' 193' ' ' LEU . 10.4 mt -62.38 -31.24 71.87 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.669 -0.644 . . . . 0.0 109.856 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -63.01 -36.59 84.06 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.57 -0.707 . . . . 0.0 109.787 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -76.36 -31.52 58.11 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.694 -0.629 . . . . 0.0 109.576 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -77.07 -30.49 55.52 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.702 -0.624 . . . . 0.0 109.671 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 41.5 tp -77.91 -32.8 51.94 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.614 -0.679 . . . . 0.0 109.633 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.3 mt -75.18 -31.63 61.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.706 -0.621 . . . . 0.0 109.565 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.66 -30.41 67.01 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.645 -0.66 . . . . 0.0 109.731 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.484 HD12 HG12 ' B' ' 183' ' ' ILE . 0.6 OUTLIER -68.16 -41.81 80.98 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.72 -0.613 . . . . 0.0 109.641 179.649 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -68.15 -31.14 70.49 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.609 -0.682 . . . . 0.0 109.674 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.91 -30.53 69.88 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.657 -0.652 . . . . 0.0 109.62 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.07 -45.84 83.62 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.672 -0.642 . . . . 0.0 109.749 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.3 tttm -64.34 -32.2 73.71 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.568 -0.707 . . . . 0.0 109.45 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 39.1 t-80 -64.78 -30.13 71.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.722 -0.611 . . . . 0.0 109.844 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.7 tm0? -65.99 -33.58 76.13 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.601 -0.687 . . . . 0.0 109.736 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.8 mt -65.76 -32.32 73.79 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.631 -0.668 . . . . 0.0 109.661 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -61.28 -35.83 78.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.654 -0.654 . . . . 0.0 109.83 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' A' ' 88' ' ' LEU . 1.1 mm? -61.73 -29.94 70.45 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.74 -0.6 . . . . 0.0 109.832 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -101.71 -19.6 15.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.676 -0.64 . . . . 0.0 110.553 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.789 HD11 ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.047 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.552 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.755 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.1 OUTLIER -144.88 -67.47 0.32 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.61 -0.935 . . . . 0.0 110.751 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 11.0 t -145.39 16.68 1.5 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.145 -0.972 . . . . 0.0 110.919 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.3 tptt 50.68 25.76 2.21 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.171 -0.955 . . . . 0.0 110.684 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -148.93 -46.77 0.14 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.655 -0.653 . . . . 0.0 109.472 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.574 ' HB2' HD12 ' B' ' 167' ' ' LEU . 2.1 mm-40 -68.9 -33.17 73.32 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 119.95 -0.7 . . . . 0.0 109.262 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.755 ' N ' HD11 ' B' ' 167' ' ' LEU . 1.5 tt -77.87 -27.75 49.81 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.789 ' CD1' HD11 ' A' ' 90' ' ' LEU . 49.1 mm -71.14 -31.08 43.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.632 -0.667 . . . . 0.0 109.399 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -70.35 -29.49 66.18 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.689 -0.632 . . . . 0.0 109.984 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.564 ' O ' HG23 ' B' ' 179' ' ' VAL . 82.0 m-20 -69.29 -29.08 66.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.605 -0.684 . . . . 0.0 110.081 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.787 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -71.46 -29.34 64.73 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.527 -0.733 . . . . 0.0 110.045 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -75.6 -29.96 59.44 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.603 -0.686 . . . . 0.0 110.168 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.4 ttp180 -76.11 -32.21 59.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.619 -0.675 . . . . 0.0 109.95 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.564 HG23 ' O ' ' B' ' 175' ' ' ASN . 72.1 t -74.08 -29.86 26.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.684 -0.635 . . . . 0.0 109.652 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -71.76 -28.59 63.75 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.667 -0.645 . . . . 0.0 110.022 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 19.4 mtp180 -74.15 -28.39 61.29 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.568 -0.708 . . . . 0.0 110.077 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -73.82 -29.12 61.97 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.588 -0.695 . . . . 0.0 110.128 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.484 HG12 HD12 ' A' ' 79' ' ' LEU . 85.0 mt -72.53 -27.81 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.587 -0.696 . . . . 0.0 109.894 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.2 m -71.2 -31.01 67.09 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.56 -0.712 . . . . 0.0 109.937 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.3 ttp -71.7 -44.08 64.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.637 -0.664 . . . . 0.0 109.934 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.0 t -71.28 -31.24 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.615 -0.678 . . . . 0.0 109.554 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -75.21 -29.11 60.21 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.717 -0.614 . . . . 0.0 109.779 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 188' ' ' GLN . . . . . 0.4 ' O ' ' OG ' ' B' ' 191' ' ' SER . 11.5 tp-100 -73.27 -28.5 62.16 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.654 -0.654 . . . . 0.0 110.068 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -32.49 64.13 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.572 -0.705 . . . . 0.0 109.962 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.638 HG12 HD22 ' A' ' 72' ' ' LEU . 77.0 mt -73.41 -31.67 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.677 -0.64 . . . . 0.0 109.776 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 191' ' ' SER . . . . . 0.4 ' OG ' ' O ' ' B' ' 188' ' ' GLN . 19.0 p -69.9 -35.61 74.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.649 -0.657 . . . . 0.0 109.636 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -76.91 -32.28 57.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.659 -0.651 . . . . 0.0 109.431 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.672 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -73.89 -30.8 62.81 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.685 -0.634 . . . . 0.0 109.374 179.277 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -67.76 -40.32 84.09 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.647 -0.658 . . . . 0.0 109.514 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -68.48 -33.11 73.58 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.634 -0.666 . . . . 0.0 109.344 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 1.5 ttpp -63.91 -34.54 78.2 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -29.87 71.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.753 -0.592 . . . . 0.0 109.469 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -47.65 85.36 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.652 -0.655 . . . . 0.0 109.74 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -62.41 -41.49 98.73 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.198 -0.601 . . . . 0.0 109.925 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.58 -36.31 68.15 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.619 -0.676 . . . . 0.0 109.733 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.722 ' HG2' HD11 ' A' ' 62' ' ' LEU . 55.9 mt-10 -76.58 -29.64 56.68 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.642 -0.661 . . . . 0.0 109.826 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -79.88 -29.4 39.93 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.665 -0.647 . . . . 0.0 109.768 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -79.74 -28.59 40.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.625 -0.672 . . . . 0.0 109.843 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -79.42 -25.07 42.11 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.562 -0.711 . . . . 0.0 110.242 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.87 -26.16 27.53 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.435 -0.791 . . . . 0.0 110.21 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.13 148.64 77.7 Favored Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.543 -0.723 . . . . 0.0 110.233 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.318 -1.074 0 O-C-N 123.367 1.193 . . . . 0.0 110.445 -179.979 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.007 0.432 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -121.45 168.71 11.38 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.568 -0.708 . . . . 0.0 110.29 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -93.27 -29.32 15.74 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.53 -0.731 . . . . 0.0 110.172 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.2 mtt -76.22 -28.0 57.03 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.643 -0.661 . . . . 0.0 110.266 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -60.74 -27.22 67.78 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.621 -0.675 . . . . 0.0 110.352 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -71.14 -32.47 69.0 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.52 -0.738 . . . . 0.0 110.129 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 35.0 ttm105 -75.44 -30.29 59.96 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.655 -0.653 . . . . 0.0 109.905 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 32.6 mtt -74.15 -30.01 62.07 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.636 -0.665 . . . . 0.0 109.806 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.2 m -70.14 -28.66 65.53 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.653 -0.654 . . . . 0.0 109.903 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.4 HD11 ' OE2' ' B' ' 201' ' ' GLU . 4.8 tp -68.11 -29.52 68.46 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.652 -0.655 . . . . 0.0 109.987 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -76.64 -32.69 58.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.605 -0.684 . . . . 0.0 110.089 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -76.83 -30.7 56.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.598 -0.689 . . . . 0.0 109.771 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.3 m -74.53 -29.98 61.59 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.727 -0.608 . . . . 0.0 109.704 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -70.41 -27.04 63.98 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.611 -0.681 . . . . 0.0 109.997 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -69.37 -33.22 72.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.581 -0.7 . . . . 0.0 110.189 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -76.11 -36.05 59.05 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.581 -0.699 . . . . 0.0 109.711 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.42 HD12 ' OE1' ' B' ' 197' ' ' GLN . 82.5 mt -71.79 -27.19 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.737 -0.602 . . . . 0.0 109.533 179.368 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.4 -37.37 77.46 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.599 -0.688 . . . . 0.0 109.717 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -71.06 -30.38 66.51 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.594 -0.691 . . . . 0.0 109.781 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.937 HD13 HD13 ' B' ' 193' ' ' LEU . 0.4 OUTLIER -72.32 -27.08 62.2 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.639 -0.663 . . . . 0.0 110.067 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -74.16 -32.82 63.27 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.493 -0.754 . . . . 0.0 109.622 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.91 -31.69 63.22 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.733 -0.604 . . . . 0.0 109.392 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -67.82 -30.8 70.29 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.734 -0.604 . . . . 0.0 109.666 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.1 tp -74.38 -30.02 61.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.633 -0.667 . . . . 0.0 109.851 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.89 -33.41 62.05 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.625 -0.672 . . . . 0.0 109.739 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.4 -29.43 66.06 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.709 -0.619 . . . . 0.0 109.858 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.476 HD12 HG12 ' B' ' 183' ' ' ILE . 0.3 OUTLIER -71.78 -42.41 67.17 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.715 -0.616 . . . . 0.0 109.761 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -66.88 -30.52 70.71 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.567 -0.708 . . . . 0.0 109.696 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -67.17 -29.42 69.1 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.706 -0.621 . . . . 0.0 109.803 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -47.64 71.05 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.598 -0.688 . . . . 0.0 109.614 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -62.78 -28.92 70.32 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.558 -0.714 . . . . 0.0 109.67 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -65.14 -29.54 70.39 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.654 -0.654 . . . . 0.0 109.996 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -65.36 -41.46 93.8 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.612 -0.68 . . . . 0.0 109.693 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.513 HD23 HD21 ' B' ' 172' ' ' LEU . 3.5 mt -61.77 -29.22 69.99 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.609 -0.682 . . . . 0.0 109.868 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.22 -35.72 79.78 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.594 -0.691 . . . . 0.0 109.636 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.4 mt -77.46 -29.59 52.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.739 -0.601 . . . . 0.0 109.789 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.574 ' HG2' HD11 ' B' ' 172' ' ' LEU . 10.8 tt0 -90.04 -14.52 33.7 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.671 -0.643 . . . . 0.0 110.807 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.461 HD11 HD11 ' B' ' 173' ' ' ILE . 52.0 tp . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.515 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.929 HD21 HD12 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -145.75 -75.52 0.21 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.621 -0.929 . . . . 0.0 110.492 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 3.9 t -138.0 19.51 2.82 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.124 -0.985 . . . . 0.0 110.924 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 169' ' ' LYS . . . . . 0.459 ' C ' HD13 ' B' ' 173' ' ' ILE . 18.5 tptm 50.82 25.91 2.36 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.134 -0.979 . . . . 0.0 110.67 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -150.73 -45.84 0.12 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.715 -0.615 . . . . 0.0 109.661 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.629 ' HB2' HD12 ' B' ' 167' ' ' LEU . 1.4 mp0 -68.23 -30.26 69.28 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.671 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.929 HD12 HD21 ' B' ' 167' ' ' LEU . 2.0 tt -81.51 -30.46 33.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.648 -0.657 . . . . 0.0 109.483 179.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.617 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.1 mp -74.13 -30.88 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -63.97 -32.73 74.37 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.488 ' O ' HG23 ' B' ' 179' ' ' VAL . 80.6 m-20 -76.18 -31.3 58.44 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.447 ' HE2' ' C ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -69.11 -29.01 67.0 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.664 -0.647 . . . . 0.0 109.83 179.547 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -75.04 -29.65 60.84 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.568 -0.708 . . . . 0.0 110.243 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -75.25 -29.73 60.28 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.59 -0.694 . . . . 0.0 110.043 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.488 HG23 ' O ' ' B' ' 175' ' ' ASN . 60.7 t -76.19 -28.63 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.629 -0.669 . . . . 0.0 109.837 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 180' ' ' ASP . . . . . 0.404 ' HA ' HD12 ' B' ' 183' ' ' ILE . 37.5 t70 -75.77 -28.63 58.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.631 -0.668 . . . . 0.0 110.07 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -28.49 59.89 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.588 -0.695 . . . . 0.0 110.117 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.7 -30.66 61.62 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.618 -0.676 . . . . 0.0 110.138 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.476 HG12 HD12 ' A' ' 79' ' ' LEU . 75.7 mt -73.42 -30.11 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.633 -0.667 . . . . 0.0 109.749 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.9 -32.45 69.41 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.669 -0.645 . . . . 0.0 109.713 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 5.5 mtp -71.99 -46.09 58.58 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.617 -0.677 . . . . 0.0 109.693 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -66.97 -31.31 52.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 119.989 -0.685 . . . . 0.0 109.286 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -66.24 -33.99 77.0 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.756 -0.59 . . . . 0.0 110.027 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 65.8 mm-40 -66.58 -27.53 67.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.582 -0.699 . . . . 0.0 110.0 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -23.32 57.7 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.586 -0.696 . . . . 0.0 110.408 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.624 HD13 HD22 ' A' ' 72' ' ' LEU . 33.8 mm -79.79 -36.8 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.369 -0.832 . . . . 0.0 109.55 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -30.53 63.95 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.735 -0.603 . . . . 0.0 109.736 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -75.33 -38.75 60.05 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.649 -0.657 . . . . 0.0 109.783 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.937 HD13 HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -72.0 -30.23 65.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.578 -0.701 . . . . 0.0 109.348 179.351 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -67.03 -37.69 84.56 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.351 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 24.4 tptt -66.43 -30.96 71.44 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.63 -0.669 . . . . 0.0 109.361 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -62.96 -37.57 87.61 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.702 -0.624 . . . . 0.0 109.464 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 197' ' ' GLN . . . . . 0.42 ' OE1' HD12 ' A' ' 69' ' ' ILE . 9.5 tp60 -62.49 -30.65 71.42 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.78 -0.575 . . . . 0.0 109.609 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -61.3 -41.31 96.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.705 -0.622 . . . . 0.0 110.016 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -63.28 -39.93 95.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.735 -0.603 . . . . 0.0 109.891 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.3 tp -72.83 -30.76 64.28 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.639 -0.663 . . . . 0.0 109.833 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.4 ' OE2' HD11 ' A' ' 62' ' ' LEU . 7.7 mm-40 -77.08 -30.65 55.54 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.586 -0.696 . . . . 0.0 109.879 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -77.59 -29.45 51.99 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.656 -0.652 . . . . 0.0 109.885 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -78.02 -28.93 49.24 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.605 -0.685 . . . . 0.0 110.008 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.58 -25.44 45.28 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.607 -0.683 . . . . 0.0 110.201 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.19 -23.56 30.5 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.501 -0.749 . . . . 0.0 110.438 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 1.6 mttp -57.85 153.77 30.95 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 121.364 -0.835 . . . . 0.0 110.415 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo . . . . . 0 C--N 1.317 -1.103 0 O-C-N 123.464 1.244 . . . . 0.0 110.386 179.947 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.3 mtmm . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.146 0.498 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.2 ttmt -87.29 -162.57 0.81 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.524 -0.735 . . . . 0.0 110.113 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 52.56 24.71 3.21 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.38 -0.825 . . . . 0.0 110.867 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.9 mtt -133.54 22.1 3.98 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.563 -0.711 . . . . 0.0 110.388 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -85.0 -29.16 25.24 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.396 -0.815 . . . . 0.0 110.069 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -66.63 -32.25 73.46 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.684 -0.635 . . . . 0.0 109.931 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 -73.72 -36.4 65.21 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.595 -0.691 . . . . 0.0 109.846 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.4 mtt -69.55 -30.5 68.32 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.715 -0.616 . . . . 0.0 109.6 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.6 m -65.88 -30.31 70.89 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.718 -0.614 . . . . 0.0 109.723 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.751 HD12 HD23 ' B' ' 200' ' ' LEU . 30.1 tp -62.4 -29.45 70.5 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.667 -0.645 . . . . 0.0 110.015 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.24 -29.56 64.04 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.602 -0.686 . . . . 0.0 110.049 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -75.4 -33.27 60.96 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.592 -0.693 . . . . 0.0 109.892 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.7 m -71.18 -30.49 66.49 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.649 -0.657 . . . . 0.0 109.713 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -68.2 -29.14 67.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.607 -0.683 . . . . 0.0 109.978 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -66.58 -32.55 73.96 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.541 -0.725 . . . . 0.0 110.05 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -76.7 -32.82 58.12 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.643 -0.66 . . . . 0.0 109.853 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.69 HG12 HD22 ' B' ' 193' ' ' LEU . 83.9 mt -75.66 -28.96 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.719 -0.613 . . . . 0.0 109.597 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.7 tp -74.4 -33.6 63.06 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.662 -0.649 . . . . 0.0 109.845 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.63 -35.76 70.53 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.639 -0.663 . . . . 0.0 109.808 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.895 HD23 HD13 ' B' ' 190' ' ' ILE . 2.0 tp -68.67 -27.87 66.36 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.608 -0.683 . . . . 0.0 109.849 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -67.4 -35.51 79.45 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.544 -0.722 . . . . 0.0 109.493 179.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.19 -31.44 60.95 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -71.06 -30.79 67.04 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.753 -0.592 . . . . 0.0 109.712 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' B' ' 187' ' ' GLU . 13.1 tp -72.08 -31.31 65.96 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.592 -0.693 . . . . 0.0 109.689 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.09 -32.8 56.9 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.655 -0.653 . . . . 0.0 109.677 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.41 -31.24 63.74 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 120.121 -0.631 . . . . 0.0 109.376 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.709 HD23 ' HA ' ' B' ' 183' ' ' ILE . 3.3 tp -65.06 -33.85 77.03 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.663 -0.648 . . . . 0.0 109.425 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.27 -31.32 65.66 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.697 -0.627 . . . . 0.0 109.49 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -67.98 -30.09 69.28 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.691 -0.63 . . . . 0.0 109.735 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -66.27 -44.96 82.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.646 -0.659 . . . . 0.0 109.914 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -66.91 -30.15 70.23 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.597 -0.69 . . . . 0.0 109.863 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.1 t-80 -70.32 -29.27 65.94 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.713 -0.617 . . . . 0.0 109.894 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -67.4 -32.21 72.95 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.629 -0.67 . . . . 0.0 109.866 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.71 -30.55 69.22 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.593 -0.692 . . . . 0.0 109.969 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -68.54 -27.89 66.5 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.597 -0.689 . . . . 0.0 110.187 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.5 -28.66 64.07 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.524 -0.735 . . . . 0.0 110.025 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -117.82 25.6 10.26 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.627 -0.67 . . . . 0.0 110.532 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.1 HD23 ' HE3' ' B' ' 176' ' ' MET . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.061 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.928 HD21 HD13 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -139.78 -82.75 0.26 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.554 -0.968 . . . . 0.0 110.536 -179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 88.6 p -130.49 20.81 5.17 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.246 -0.909 . . . . 0.0 110.94 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.1 tptt 50.92 25.62 2.29 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.234 -0.916 . . . . 0.0 110.729 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -150.64 -46.09 0.12 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.724 -0.61 . . . . 0.0 109.643 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.626 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.4 OUTLIER -66.38 -29.88 70.14 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.982 -0.687 . . . . 0.0 109.447 179.418 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.928 HD13 HD21 ' B' ' 167' ' ' LEU . 14.8 tp -81.49 -33.2 32.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.704 -0.622 . . . . 0.0 109.386 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.62 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.1 mp -74.76 -31.37 26.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -64.06 -32.14 73.59 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.82 ' O ' HG23 ' B' ' 179' ' ' VAL . 78.4 m-20 -75.38 -32.72 60.89 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 176' ' ' MET . . . . . 1.1 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -66.45 -33.13 75.02 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.172 -0.611 . . . . 0.0 109.555 179.47 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -76.33 -31.59 58.21 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.639 -0.663 . . . . 0.0 109.751 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -74.31 -29.58 61.68 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.701 -0.624 . . . . 0.0 109.864 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.82 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.8 t -73.43 -29.57 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.658 -0.651 . . . . 0.0 109.763 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -75.37 -32.83 60.96 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.568 -0.707 . . . . 0.0 110.04 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -73.02 -29.43 63.0 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.71 -0.619 . . . . 0.0 109.864 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -73.42 -39.66 64.86 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.616 -0.677 . . . . 0.0 109.925 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.709 ' HA ' HD23 ' A' ' 79' ' ' LEU . 96.3 mt -66.81 -28.49 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.67 -0.644 . . . . 0.0 109.723 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 79.0 m -67.95 -37.07 81.14 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.609 -0.682 . . . . 0.0 109.672 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 19.9 tpp -70.73 -44.4 66.91 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.64 -0.662 . . . . 0.0 109.485 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 68.3 t -66.85 -35.79 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 187' ' ' GLU . . . . . 0.417 ' HA ' HD13 ' A' ' 76' ' ' LEU . 12.2 tt0 -63.7 -34.23 77.4 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.726 -0.609 . . . . 0.0 109.815 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.88 -24.88 62.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.681 -0.637 . . . . 0.0 110.033 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -24.83 57.33 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.547 -0.72 . . . . 0.0 110.458 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.895 HD13 HD23 ' A' ' 72' ' ' LEU . 32.8 mm -79.16 -34.86 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.354 -0.842 . . . . 0.0 109.601 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.1 m -75.55 -30.8 59.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.729 -0.607 . . . . 0.0 109.684 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 39.0 mmtt -74.68 -32.59 62.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.689 -0.632 . . . . 0.0 109.678 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.69 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -71.61 -35.83 70.6 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.566 -0.709 . . . . 0.0 109.424 179.459 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.2 -40.8 94.68 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.64 -0.663 . . . . 0.0 109.407 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -70.83 -32.05 68.96 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.687 -0.633 . . . . 0.0 109.378 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.451 ' HE2' HD23 ' B' ' 193' ' ' LEU . 16.8 ttpt -67.64 -31.88 72.19 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -65.46 -30.67 71.48 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.726 -0.608 . . . . 0.0 109.676 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -62.2 -43.47 98.76 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.713 -0.617 . . . . 0.0 109.829 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -61.54 -40.73 95.74 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.777 -0.577 . . . . 0.0 109.842 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.751 HD23 HD12 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -73.93 -32.53 63.55 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.533 -0.729 . . . . 0.0 109.558 179.502 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.499 ' HG2' HD21 ' A' ' 62' ' ' LEU . 4.8 mt-10 -77.61 -30.72 52.49 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.791 -0.568 . . . . 0.0 109.747 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -76.58 -29.02 56.43 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.801 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -75.48 -29.78 59.69 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.652 -0.655 . . . . 0.0 109.862 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -72.36 -29.36 63.72 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.592 -0.692 . . . . 0.0 109.982 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -118.22 27.91 8.69 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.583 -0.698 . . . . 0.0 110.204 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.26 142.11 96.56 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.5 -0.75 . . . . 0.0 110.074 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.317 -1.114 0 O-C-N 123.304 1.16 . . . . 0.0 110.392 -179.964 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.4 tptt . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.137 0.494 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.7 mttm -121.21 179.99 4.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.544 -0.722 . . . . 0.0 110.191 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 52.78 26.19 4.35 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.431 -0.793 . . . . 0.0 110.838 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.31 -34.66 8.7 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.451 -0.781 . . . . 0.0 110.182 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -73.58 -28.79 62.02 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.615 -0.678 . . . . 0.0 110.007 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -75.44 -28.48 59.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.632 -0.667 . . . . 0.0 110.04 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -75.11 -30.64 60.93 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.552 -0.718 . . . . 0.0 109.963 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 24.5 mtp -72.34 -30.44 64.75 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.652 -0.655 . . . . 0.0 109.879 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 21.5 m -68.04 -28.99 67.87 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.655 -0.653 . . . . 0.0 109.901 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' B' ' 201' ' ' GLU . 0.9 OUTLIER -65.19 -31.47 72.67 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.566 -0.709 . . . . 0.0 110.021 179.809 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -75.22 -37.46 61.09 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.61 -0.681 . . . . 0.0 109.91 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -74.01 -30.55 62.51 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.733 -0.604 . . . . 0.0 109.672 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.506 HG21 ' NZ ' ' B' ' 196' ' ' LYS . 79.0 m -72.71 -29.94 63.79 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.677 -0.639 . . . . 0.0 109.71 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -68.94 -27.74 66.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.647 -0.658 . . . . 0.0 110.051 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -68.24 -33.21 73.96 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.45 -0.781 . . . . 0.0 110.14 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -75.65 -33.86 60.47 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.678 -0.639 . . . . 0.0 109.722 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.7 mt -71.82 -28.25 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.768 -0.583 . . . . 0.0 109.617 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.23 -38.27 78.43 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.558 -0.714 . . . . 0.0 109.796 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.3 tptp -68.74 -29.89 68.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.584 -0.697 . . . . 0.0 109.766 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.805 HD22 HG12 ' B' ' 190' ' ' ILE . 8.4 mt -68.58 -32.17 71.88 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.69 -0.631 . . . . 0.0 110.023 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -68.29 -33.46 74.39 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.64 -0.663 . . . . 0.0 109.829 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -75.34 -30.07 60.14 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.655 -0.653 . . . . 0.0 109.814 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -74.61 -30.12 61.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.698 -0.626 . . . . 0.0 109.905 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.407 HD13 HD12 ' B' ' 190' ' ' ILE . 28.8 tp -74.94 -34.01 62.04 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.661 -0.649 . . . . 0.0 109.901 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 22.0 mt -74.97 -32.31 61.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.674 -0.641 . . . . 0.0 109.743 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.68 -29.75 62.48 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.71 -0.618 . . . . 0.0 109.767 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.45 -41.13 56.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.712 -0.617 . . . . 0.0 109.614 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -71.05 -29.19 65.02 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.65 -0.656 . . . . 0.0 109.743 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -71.11 -29.65 65.53 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.593 -0.692 . . . . 0.0 109.716 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -68.03 -42.23 80.94 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.678 -0.639 . . . . 0.0 109.867 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -66.91 -28.96 68.73 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.546 -0.721 . . . . 0.0 109.864 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -68.76 -30.94 69.65 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.644 -0.66 . . . . 0.0 109.95 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -65.04 -38.07 89.65 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.606 -0.684 . . . . 0.0 109.784 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.426 ' C ' ' HE2' ' B' ' 176' ' ' MET . 2.0 mt -61.25 -33.84 74.18 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.707 -0.621 . . . . 0.0 109.98 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -63.35 -46.06 88.33 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.511 -0.743 . . . . 0.0 109.905 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 42.4 mt -69.31 -28.63 66.43 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.734 -0.604 . . . . 0.0 109.862 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -100.52 7.95 43.79 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.673 -0.642 . . . . 0.0 110.997 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.786 HD12 HD22 ' B' ' 172' ' ' LEU . 53.0 tp . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.304 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.938 HD21 HD12 ' B' ' 172' ' ' LEU . 0.1 OUTLIER -141.86 -84.08 0.19 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.51 -0.994 . . . . 0.0 110.454 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 66.7 m -127.84 19.35 6.62 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.064 -1.022 . . . . 0.0 110.819 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 16.7 tptt 50.71 25.92 2.29 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.237 -0.915 . . . . 0.0 110.652 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -148.96 -46.74 0.14 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.643 -0.661 . . . . 0.0 109.453 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.586 ' HB2' HD12 ' B' ' 167' ' ' LEU . 1.1 mt-10 -66.3 -34.75 78.7 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.248 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.938 HD12 HD21 ' B' ' 167' ' ' LEU . 5.5 tt -77.63 -29.35 51.75 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.492 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.5 mm -68.56 -31.07 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.702 -0.624 . . . . 0.0 109.358 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -76.29 -30.31 57.73 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.672 -0.643 . . . . 0.0 109.835 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.784 ' O ' HG23 ' B' ' 179' ' ' VAL . 76.2 m-20 -75.05 -30.1 60.92 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.718 -0.614 . . . . 0.0 109.847 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.452 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -72.05 -31.19 65.91 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.636 -0.665 . . . . 0.0 109.848 179.766 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.72 -29.97 56.44 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.956 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -76.81 -30.1 56.26 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.608 -0.683 . . . . 0.0 109.829 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.784 HG23 ' O ' ' B' ' 175' ' ' ASN . 71.1 t -74.48 -29.69 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.616 -0.677 . . . . 0.0 109.687 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -71.63 -28.8 64.02 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.583 -0.698 . . . . 0.0 109.99 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 22.1 mtp180 -74.88 -29.49 61.03 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.591 -0.693 . . . . 0.0 110.031 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 182' ' ' GLU . . . . . 0.501 ' O ' HG23 ' B' ' 186' ' ' VAL . 3.0 tp10 -74.64 -34.44 62.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.725 -0.609 . . . . 0.0 110.039 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 78.3 mt -71.18 -28.77 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.715 -0.616 . . . . 0.0 109.768 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.6 m -72.17 -33.59 67.82 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.59 -0.694 . . . . 0.0 109.803 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 11.2 ttt -75.46 -36.86 60.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.62 -0.675 . . . . 0.0 109.733 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 186' ' ' VAL . . . . . 0.501 HG23 ' O ' ' B' ' 182' ' ' GLU . 58.5 t -74.88 -30.58 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.7 -0.625 . . . . 0.0 109.528 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -75.48 -28.77 59.34 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.716 -0.615 . . . . 0.0 109.915 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -74.44 -28.98 61.29 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.648 -0.657 . . . . 0.0 109.992 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.27 -36.71 63.84 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.637 -0.665 . . . . 0.0 109.952 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.805 HG12 HD22 ' A' ' 72' ' ' LEU . 82.0 mt -72.1 -31.55 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.621 -0.674 . . . . 0.0 109.607 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 3.7 m -71.36 -35.85 71.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.698 -0.626 . . . . 0.0 109.571 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 14.7 mmtt -75.52 -32.47 60.49 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.517 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.691 HD13 HD11 ' A' ' 72' ' ' LEU . 0.3 OUTLIER -77.0 -17.65 58.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.695 -0.628 . . . . 0.0 110.426 179.49 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 7.3 tptt -85.53 -27.0 25.87 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.349 -0.844 . . . . 0.0 109.545 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -76.45 -32.84 58.66 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.624 -0.673 . . . . 0.0 110.006 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.506 ' NZ ' HG21 ' A' ' 65' ' ' THR . 0.0 OUTLIER -70.56 -25.07 62.92 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.495 -0.753 . . . . 0.0 109.896 179.533 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -70.39 -30.07 66.88 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.509 -0.744 . . . . 0.0 109.591 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.61 -46.69 87.1 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.596 -0.69 . . . . 0.0 109.513 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -61.74 -36.94 82.44 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.738 -0.601 . . . . 0.0 109.899 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 19.6 tp -75.47 -35.32 60.89 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.603 -0.686 . . . . 0.0 109.658 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.585 ' HA ' HD11 ' A' ' 62' ' ' LEU . 13.5 mt-10 -77.86 -30.66 51.02 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.66 -0.65 . . . . 0.0 109.641 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.46 -28.56 46.57 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.61 -0.681 . . . . 0.0 109.738 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -77.06 -27.8 54.47 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.612 -0.68 . . . . 0.0 110.015 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.23 -24.64 51.19 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.549 -0.719 . . . . 0.0 110.33 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.35 -25.83 28.88 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.472 -0.768 . . . . 0.0 110.3 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 13.1 mttt -59.72 167.23 2.7 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.511 -0.743 . . . . 0.0 110.315 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo . . . . . 0 C--N 1.317 -1.12 0 O-C-N 123.35 1.184 . . . . 0.0 110.402 -179.963 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.7 mttm . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.038 0.447 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -117.13 -177.85 3.31 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.59 -0.694 . . . . 0.0 110.237 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 52.72 26.98 4.84 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.4 -0.813 . . . . 0.0 110.706 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.23 -45.82 0.34 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.583 -0.698 . . . . 0.0 110.118 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -64.58 -29.19 70.2 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.694 -0.628 . . . . 0.0 110.032 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -71.13 -28.74 64.51 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.634 -0.666 . . . . 0.0 110.03 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -29.53 67.11 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.601 -0.687 . . . . 0.0 110.078 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 6.3 mmm -74.12 -30.35 62.28 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.601 -0.687 . . . . 0.0 110.013 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 t -71.77 -29.77 64.84 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.672 -0.642 . . . . 0.0 109.898 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.717 ' HG ' HD23 ' B' ' 200' ' ' LEU . 2.0 mp -69.11 -28.98 66.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.623 -0.673 . . . . 0.0 109.97 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -67.23 -30.63 70.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.543 -0.723 . . . . 0.0 110.007 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -75.03 -39.23 61.18 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.608 -0.682 . . . . 0.0 109.87 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 47.3 m -72.21 -30.75 65.23 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.655 -0.653 . . . . 0.0 109.638 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -71.72 -27.47 63.02 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.647 -0.658 . . . . 0.0 109.967 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -69.64 -34.84 74.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.626 -0.671 . . . . 0.0 110.175 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 -75.67 -35.27 60.42 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.612 -0.68 . . . . 0.0 109.652 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.3 mt -72.34 -27.52 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.781 -0.574 . . . . 0.0 109.554 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.405 HD23 ' C ' ' A' ' 70' ' ' LEU . 9.6 tt -71.13 -38.88 72.27 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.635 -0.666 . . . . 0.0 109.915 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -35.02 79.51 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.596 -0.69 . . . . 0.0 109.676 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.614 ' CD1' HD13 ' B' ' 193' ' ' LEU . 5.5 mt -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.719 -0.613 . . . . 0.0 109.825 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.9 -36.13 83.38 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.607 -0.683 . . . . 0.0 109.977 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -76.1 -30.98 58.48 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.634 -0.666 . . . . 0.0 109.724 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tttm -77.19 -31.71 55.55 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.715 -0.616 . . . . 0.0 109.774 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 36.4 tp -77.74 -30.65 51.73 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.624 -0.672 . . . . 0.0 109.681 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.79 -30.94 56.66 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.678 -0.639 . . . . 0.0 109.639 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.32 -29.99 61.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.593 -0.692 . . . . 0.0 109.956 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.405 HD12 HG12 ' B' ' 183' ' ' ILE . 0.4 OUTLIER -76.34 -38.2 56.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.639 -0.663 . . . . 0.0 109.631 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -71.69 -29.07 64.17 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.589 -0.694 . . . . 0.0 109.748 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -71.4 -29.47 64.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.581 -0.7 . . . . 0.0 109.866 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -70.8 -43.57 68.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.619 -0.676 . . . . 0.0 109.852 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -62.96 -29.31 70.71 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.587 -0.696 . . . . 0.0 109.748 179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -63.44 -31.14 72.21 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.622 -0.674 . . . . 0.0 109.848 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -62.8 -32.82 74.08 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.672 -0.643 . . . . 0.0 109.852 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.487 HD13 ' HG2' ' B' ' 176' ' ' MET . 0.4 OUTLIER -68.39 -35.93 78.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.647 -0.658 . . . . 0.0 109.81 179.692 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -64.18 -29.24 70.36 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.682 -0.636 . . . . 0.0 110.052 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 tp -65.85 -30.12 70.68 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.58 -0.7 . . . . 0.0 110.004 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.58 27.38 9.23 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.601 -0.687 . . . . 0.0 110.289 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.772 HD11 ' CD1' ' B' ' 173' ' ' ILE . 51.2 tp . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 118.045 -0.978 . . . . 0.0 110.168 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.882 HD21 HD13 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -140.84 -84.07 0.21 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.578 -0.954 . . . . 0.0 110.561 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -128.64 19.66 6.16 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.143 -0.973 . . . . 0.0 110.9 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 7.6 tptm 50.76 26.09 2.4 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.21 -0.931 . . . . 0.0 110.604 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -149.33 -45.87 0.14 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.627 -0.67 . . . . 0.0 109.694 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.599 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.1 OUTLIER -66.45 -35.85 81.33 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.804 -0.759 . . . . 0.0 109.292 179.498 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.882 HD13 HD21 ' B' ' 167' ' ' LEU . 10.2 tp -76.9 -28.79 55.45 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 178.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.772 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.7 mm -66.59 -31.38 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.616 -0.677 . . . . 0.0 109.196 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -74.98 -31.08 61.35 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.124 -0.63 . . . . 0.0 109.775 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.596 ' O ' HG23 ' B' ' 179' ' ' VAL . 83.7 m-20 -75.03 -34.72 61.91 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.681 -0.637 . . . . 0.0 109.77 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.574 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -70.01 -30.67 68.03 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.743 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -67.15 -35.26 79.33 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.666 -0.647 . . . . 0.0 109.727 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.51 -30.73 59.92 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.72 -0.612 . . . . 0.0 109.686 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.596 HG23 ' O ' ' B' ' 175' ' ' ASN . 69.3 t -76.67 -30.96 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.702 -0.624 . . . . 0.0 109.569 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -75.24 -29.72 60.31 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.728 -0.608 . . . . 0.0 109.907 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -73.47 -30.16 62.99 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.691 -0.631 . . . . 0.0 109.851 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -72.53 -36.91 68.41 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.652 -0.655 . . . . 0.0 109.965 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.405 HG12 HD12 ' A' ' 79' ' ' LEU . 82.0 mt -70.02 -30.52 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.705 -0.622 . . . . 0.0 109.652 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.8 m -68.58 -35.04 76.82 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.673 -0.642 . . . . 0.0 109.652 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -46.63 74.79 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.582 -0.699 . . . . 0.0 109.659 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 60.5 t -70.57 -33.03 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.634 -0.666 . . . . 0.0 109.307 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -72.86 -29.95 63.6 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.775 -0.578 . . . . 0.0 109.675 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 37.5 mm-40 -68.89 -30.27 68.73 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.636 -0.665 . . . . 0.0 109.781 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.55 -36.83 63.11 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.594 -0.691 . . . . 0.0 109.841 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.609 ' CG1' HD22 ' A' ' 72' ' ' LEU . 79.4 mt -69.54 -30.58 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.627 -0.671 . . . . 0.0 109.523 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 20.4 m -66.67 -40.29 88.53 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.701 -0.624 . . . . 0.0 109.612 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -72.32 -31.53 65.75 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 120.087 -0.645 . . . . 0.0 109.495 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.614 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.4 OUTLIER -72.39 -35.41 68.41 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.756 -0.59 . . . . 0.0 109.418 179.364 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -68.5 -43.09 77.6 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.693 -0.63 . . . . 0.0 109.497 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -67.3 -32.0 72.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.667 -0.646 . . . . 0.0 109.327 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -34.89 79.25 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -63.01 -30.37 71.55 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.795 -0.566 . . . . 0.0 109.637 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.42 -46.24 90.93 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.705 -0.622 . . . . 0.0 109.743 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.09 -46.2 90.11 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.714 -0.617 . . . . 0.0 109.843 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.717 HD23 ' HG ' ' A' ' 62' ' ' LEU . 4.9 tp -69.48 -34.34 74.19 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.623 -0.673 . . . . 0.0 109.822 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -76.72 -30.34 56.6 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.649 -0.657 . . . . 0.0 109.811 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -77.08 -29.78 55.15 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.595 -0.691 . . . . 0.0 109.799 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.36 -27.83 56.57 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.664 -0.648 . . . . 0.0 110.036 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.31 -27.81 47.3 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.576 -0.703 . . . . 0.0 110.206 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -88.36 -28.69 20.81 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.552 -0.717 . . . . 0.0 110.166 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 153.07 78.05 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.565 -0.71 . . . . 0.0 110.13 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo . . . . . 0 C--N 1.318 -1.078 0 O-C-N 123.417 1.22 . . . . 0.0 110.371 179.978 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.7 mtpp . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.037 0.446 . . . . 0.0 110.186 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.3 tttt -146.95 178.58 8.24 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.601 -0.687 . . . . 0.0 110.189 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -99.51 -29.36 12.77 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.533 -0.729 . . . . 0.0 110.11 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -89.9 -24.31 21.38 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.592 -0.692 . . . . 0.0 110.43 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.74 -26.67 62.16 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.366 -0.834 . . . . 0.0 110.509 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -61.27 -41.47 96.98 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.481 -0.762 . . . . 0.0 110.096 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -70.17 -29.88 66.88 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.619 -0.676 . . . . 0.0 109.855 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.6 mmm -72.23 -30.22 64.69 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.638 -0.664 . . . . 0.0 109.737 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 t -67.65 -28.07 67.39 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.654 -0.654 . . . . 0.0 109.938 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.665 HD11 ' HG2' ' B' ' 201' ' ' GLU . 6.1 tp -66.73 -29.16 69.07 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.539 -0.725 . . . . 0.0 110.131 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -76.29 -31.71 58.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.579 -0.701 . . . . 0.0 110.082 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -76.78 -30.8 56.63 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.596 -0.69 . . . . 0.0 109.798 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.459 HG22 HD11 ' A' ' 69' ' ' ILE . 5.9 m -75.16 -30.04 60.62 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.686 -0.634 . . . . 0.0 109.755 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.1 mmtt -72.33 -27.21 62.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.624 -0.672 . . . . 0.0 110.137 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -72.86 -35.32 67.18 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.562 -0.711 . . . . 0.0 110.206 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.1 tp60 -76.07 -35.09 59.56 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.502 -0.748 . . . . 0.0 109.706 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.806 HG12 HD23 ' B' ' 193' ' ' LEU . 67.6 mt -75.39 -28.62 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.771 -0.58 . . . . 0.0 109.503 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.469 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.3 tt -75.19 -36.93 61.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.625 -0.672 . . . . 0.0 109.601 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -66.31 -29.45 69.65 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.469 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.629 HD22 HG12 ' B' ' 190' ' ' ILE . 6.6 mt -62.04 -33.03 73.62 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.695 -0.628 . . . . 0.0 109.899 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -61.6 -36.04 79.56 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.523 -0.736 . . . . 0.0 109.888 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -77.31 -31.46 54.66 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.71 -0.618 . . . . 0.0 109.353 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.596 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -74.3 -30.67 62.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.705 -0.622 . . . . 0.0 109.621 179.517 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -74.01 -34.89 64.32 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.667 -0.646 . . . . 0.0 109.647 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tp -71.83 -36.71 70.3 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.693 -0.629 . . . . 0.0 109.61 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.69 -30.38 71.06 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.745 -0.597 . . . . 0.0 109.481 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' B' ' 183' ' ' ILE . 2.8 mp -61.6 -41.88 98.08 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.707 -0.621 . . . . 0.0 109.828 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -67.58 -30.26 69.84 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.614 -0.679 . . . . 0.0 109.753 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -30.18 69.42 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.688 -0.632 . . . . 0.0 109.765 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.33 -49.29 57.09 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.657 -0.652 . . . . 0.0 109.782 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.9 ttpt -66.96 -31.27 71.73 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.578 -0.701 . . . . 0.0 109.494 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -70.12 -30.24 67.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.753 -0.592 . . . . 0.0 109.775 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -67.43 -29.72 69.28 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.571 -0.706 . . . . 0.0 109.886 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.59 HD23 HD21 ' B' ' 172' ' ' LEU . 0.7 OUTLIER -66.47 -39.55 88.85 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.579 -0.701 . . . . 0.0 109.922 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -61.14 -29.26 69.67 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.546 -0.721 . . . . 0.0 110.14 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.9 tp -70.32 -27.65 64.54 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.628 -0.67 . . . . 0.0 110.199 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -119.84 26.99 8.96 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.528 -0.733 . . . . 0.0 110.412 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.71 HD13 ' CE ' ' B' ' 176' ' ' MET . 29.2 tp . . . . . 0 N--CA 1.496 1.861 0 CA-C-O 117.933 -1.032 . . . . 0.0 109.989 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.779 HD21 HD12 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -142.43 -77.59 0.25 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.553 -0.969 . . . . 0.0 110.536 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 18.1 t -136.48 18.62 3.12 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.105 -0.997 . . . . 0.0 110.876 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 40.6 tptt 50.67 25.95 2.28 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.238 -0.914 . . . . 0.0 110.562 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -148.23 -46.66 0.16 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.692 -0.63 . . . . 0.0 109.386 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.598 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.4 OUTLIER -68.18 -32.56 72.88 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.21 179.331 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.779 HD12 HD21 ' B' ' 167' ' ' LEU . 3.9 tt -78.96 -29.28 43.88 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.531 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.8 mm -68.61 -30.55 47.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.721 -0.612 . . . . 0.0 109.4 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -72.67 -30.55 64.36 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.6 -0.688 . . . . 0.0 109.803 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.793 ' O ' HG23 ' B' ' 179' ' ' VAL . 96.9 m-20 -74.67 -31.7 62.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.619 -0.676 . . . . 0.0 109.701 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.71 ' CE ' HD13 ' A' ' 90' ' ' LEU . 1.6 mtt -70.16 -30.83 68.08 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.763 -0.586 . . . . 0.0 109.869 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -76.95 -30.94 56.25 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.635 -0.666 . . . . 0.0 109.886 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -29.84 57.37 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.661 -0.649 . . . . 0.0 109.735 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.793 HG23 ' O ' ' B' ' 175' ' ' ASN . 73.9 t -74.39 -28.45 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.6 -0.688 . . . . 0.0 109.81 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -74.65 -36.72 62.86 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.613 -0.68 . . . . 0.0 110.047 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 15.3 mtt85 -70.09 -26.32 63.93 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.639 -0.663 . . . . 0.0 109.977 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -72.87 -36.1 67.31 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.515 -0.741 . . . . 0.0 110.142 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.752 ' HA ' HD23 ' A' ' 79' ' ' LEU . 87.3 mt -67.89 -27.94 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.57 -0.707 . . . . 0.0 109.874 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 7.8 m -67.97 -34.61 76.89 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.559 -0.713 . . . . 0.0 109.787 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 mtm -73.78 -37.71 64.9 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.6 -0.688 . . . . 0.0 109.742 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 186' ' ' VAL . . . . . 0.678 HG21 HD21 ' A' ' 79' ' ' LEU . 57.7 t -73.29 -30.42 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.642 -0.661 . . . . 0.0 109.616 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.56 -29.22 61.27 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.6 -0.688 . . . . 0.0 109.991 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -73.52 -30.85 63.37 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.651 -0.655 . . . . 0.0 109.939 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -32.57 69.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.625 -0.672 . . . . 0.0 109.942 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.629 HG12 HD22 ' A' ' 72' ' ' LEU . 78.1 mt -75.3 -30.71 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.546 -0.721 . . . . 0.0 109.739 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 27.6 m -75.53 -35.86 60.62 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.632 -0.667 . . . . 0.0 109.654 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 28.5 mtmt -73.48 -34.19 65.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.662 -0.649 . . . . 0.0 109.538 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.806 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -69.28 -35.6 76.21 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -64.15 -47.32 80.37 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -67.43 -31.93 72.45 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -64.83 -34.18 77.77 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -63.41 -30.85 71.91 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 120.223 -0.591 . . . . 0.0 109.48 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -60.98 -45.89 92.96 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.655 -0.653 . . . . 0.0 109.885 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -61.82 -39.51 92.04 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.745 -0.597 . . . . 0.0 109.739 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 13.7 tp -74.89 -30.52 61.33 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.65 -0.656 . . . . 0.0 109.582 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.665 ' HG2' HD11 ' A' ' 62' ' ' LEU . 24.5 mt-10 -78.44 -31.33 48.0 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.644 -0.66 . . . . 0.0 109.761 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -77.92 -28.87 49.83 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.719 -0.613 . . . . 0.0 109.786 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -79.43 -29.73 42.0 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.637 -0.664 . . . . 0.0 109.949 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -81.04 -27.69 35.67 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.632 -0.668 . . . . 0.0 110.025 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -92.95 -26.51 17.54 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.53 -0.732 . . . . 0.0 110.325 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 52.78 76.83 0.49 Allowed Pre-proline 0 N--CA 1.501 2.111 0 O-C-N 121.406 -0.809 . . . . 0.0 110.764 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.317 -1.095 0 O-C-N 123.339 1.178 . . . . 0.0 110.403 -179.984 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.033 0.445 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -147.1 -165.66 2.3 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.585 -0.697 . . . . 0.0 110.221 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 52.43 24.86 3.18 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.407 -0.808 . . . . 0.0 110.852 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.2 mmt -132.54 21.73 4.31 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.522 -0.737 . . . . 0.0 110.337 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -83.11 -29.86 28.38 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.406 -0.809 . . . . 0.0 110.014 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -71.53 -30.23 65.67 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.591 -0.693 . . . . 0.0 109.954 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -30.3 69.58 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.597 -0.69 . . . . 0.0 109.82 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.2 mmt -63.77 -33.52 75.85 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.639 -0.663 . . . . 0.0 109.952 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.9 t -66.66 -28.81 68.76 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.637 -0.664 . . . . 0.0 109.972 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.499 HD11 ' CG ' ' B' ' 201' ' ' GLU . 10.3 tt -66.23 -29.51 69.77 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.601 -0.687 . . . . 0.0 110.082 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -64.58 -31.41 72.61 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.626 -0.671 . . . . 0.0 110.067 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -72.25 -33.15 67.29 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.595 -0.69 . . . . 0.0 109.924 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.8 m -70.56 -38.51 74.15 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.689 -0.632 . . . . 0.0 109.76 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -63.99 -27.04 68.86 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.625 -0.672 . . . . 0.0 109.943 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -66.82 -39.58 87.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.532 -0.73 . . . . 0.0 110.204 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.0 tp60 -76.07 -31.48 58.8 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.608 -0.682 . . . . 0.0 109.624 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.816 HG12 HD23 ' B' ' 193' ' ' LEU . 90.8 mt -77.42 -28.12 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.743 -0.598 . . . . 0.0 109.533 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 24.5 tp -75.14 -38.12 61.14 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.585 -0.697 . . . . 0.0 109.536 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -65.54 -30.95 71.76 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.623 -0.673 . . . . 0.0 109.565 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.613 HD22 HG12 ' B' ' 190' ' ' ILE . 6.7 mt -62.64 -35.72 80.54 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.655 -0.653 . . . . 0.0 110.06 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.403 ' O ' HD13 ' A' ' 77' ' ' LEU . 3.1 tt0 -61.99 -35.69 79.24 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.598 -0.689 . . . . 0.0 110.033 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -76.16 -30.66 58.18 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.612 -0.68 . . . . 0.0 109.731 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.6 tttt -75.81 -28.95 58.51 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.658 -0.651 . . . . 0.0 109.888 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.7 tp -76.83 -32.37 57.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.676 -0.64 . . . . 0.0 109.984 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 73' ' ' GLU . 0.9 OUTLIER -76.64 -31.56 57.45 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.652 -0.655 . . . . 0.0 109.792 179.7 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.24 -27.71 59.6 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.699 -0.626 . . . . 0.0 110.068 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.761 HD23 ' HA ' ' B' ' 183' ' ' ILE . 7.1 tp -76.55 -31.66 57.72 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.543 -0.723 . . . . 0.0 110.086 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -75.07 -30.48 60.99 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.642 -0.661 . . . . 0.0 109.784 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -71.91 -28.13 63.29 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.689 -0.632 . . . . 0.0 109.81 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -68.76 -37.5 79.4 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.565 -0.709 . . . . 0.0 110.012 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -70.32 -29.65 66.42 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.474 -0.766 . . . . 0.0 109.923 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -69.67 -29.83 67.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.591 -0.693 . . . . 0.0 109.75 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.0 tm0? -64.85 -34.19 77.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.647 -0.658 . . . . 0.0 109.959 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.44 HD23 HD21 ' B' ' 172' ' ' LEU . 0.5 OUTLIER -64.24 -38.62 91.7 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.586 -0.696 . . . . 0.0 109.858 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.405 ' N ' ' HE2' ' B' ' 176' ' ' MET . 9.6 m-85 -60.76 -28.59 68.84 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.628 -0.67 . . . . 0.0 110.141 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 66.7 mt -72.85 -28.72 62.7 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.572 -0.705 . . . . 0.0 110.138 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -116.99 25.82 10.23 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.628 -0.67 . . . . 0.0 110.433 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.106 HD23 ' HE3' ' B' ' 176' ' ' MET . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.805 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.903 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.741 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.0 OUTLIER -149.66 -80.03 0.13 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.476 -1.014 . . . . 0.0 110.524 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 3.1 t -134.18 19.2 3.72 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.234 -0.916 . . . . 0.0 110.919 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 25.4 tptt 50.63 25.92 2.24 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.175 -0.953 . . . . 0.0 110.598 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -148.2 -46.66 0.16 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.722 -0.611 . . . . 0.0 109.354 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.626 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.8 mm-40 -67.77 -32.16 72.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.593 -0.692 . . . . 0.0 109.32 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.782 HD22 HD22 ' A' ' 90' ' ' LEU . 1.3 tt -78.95 -28.17 43.66 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.762 ' CD1' HD11 ' A' ' 90' ' ' LEU . 49.6 mm -70.6 -31.41 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.652 -0.655 . . . . 0.0 109.418 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 52.9 tp60 -71.07 -28.22 64.2 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.666 -0.646 . . . . 0.0 109.939 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.722 ' O ' HG23 ' B' ' 179' ' ' VAL . 70.7 m-20 -70.34 -28.62 65.28 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.622 -0.674 . . . . 0.0 110.151 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 176' ' ' MET . . . . . 1.106 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -75.27 -31.84 60.87 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.49 -0.757 . . . . 0.0 110.049 179.845 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -73.18 -30.02 63.25 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.614 -0.679 . . . . 0.0 109.967 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -77.69 -30.52 51.94 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.645 -0.659 . . . . 0.0 109.865 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.722 HG23 ' O ' ' B' ' 175' ' ' ASN . 65.7 t -76.8 -30.31 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.698 -0.626 . . . . 0.0 109.738 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -76.98 -29.64 55.61 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.7 -0.625 . . . . 0.0 109.989 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.5 -28.32 59.13 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.655 -0.653 . . . . 0.0 109.971 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -74.96 -33.85 61.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.613 -0.68 . . . . 0.0 110.052 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.761 ' HA ' HD23 ' A' ' 79' ' ' LEU . 89.1 mt -71.47 -28.23 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.589 -0.694 . . . . 0.0 109.817 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.7 m -71.51 -34.73 70.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.57 -0.706 . . . . 0.0 109.918 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -39.21 62.87 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.597 -0.689 . . . . 0.0 109.775 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 60.2 t -74.34 -29.89 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.569 -0.707 . . . . 0.0 109.564 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -76.34 -28.48 56.89 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.623 -0.673 . . . . 0.0 109.958 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -75.13 -28.06 60.04 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.539 -0.725 . . . . 0.0 110.11 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.89 -29.22 61.95 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.585 -0.697 . . . . 0.0 110.022 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.613 HG12 HD22 ' A' ' 72' ' ' LEU . 81.0 mt -76.04 -34.28 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.632 -0.667 . . . . 0.0 109.71 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 86.9 p -70.57 -30.95 67.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.74 -0.6 . . . . 0.0 109.501 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 25.2 mmtt -77.36 -33.86 55.2 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.638 -0.664 . . . . 0.0 109.591 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.816 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -72.5 -31.52 65.42 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.594 -0.691 . . . . 0.0 109.27 179.283 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -66.96 -41.27 87.18 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.614 -0.679 . . . . 0.0 109.476 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -71.32 -31.77 67.81 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.676 -0.64 . . . . 0.0 109.284 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 9.7 ttpt -67.88 -32.39 72.85 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -64.77 -30.07 71.06 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.706 -0.621 . . . . 0.0 109.485 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.77 -46.07 91.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.652 -0.655 . . . . 0.0 109.81 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -61.92 -37.72 85.71 Favored 'General case' 0 N--CA 1.496 1.842 0 C-N-CA 120.228 -0.589 . . . . 0.0 109.807 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.6 tp -73.59 -33.61 64.69 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.583 -0.698 . . . . 0.0 109.673 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.499 ' CG ' HD11 ' A' ' 62' ' ' LEU . 8.4 mt-10 -76.94 -33.87 57.67 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.684 -0.635 . . . . 0.0 109.707 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.27 -29.99 48.31 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.703 -0.623 . . . . 0.0 109.594 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -77.6 -27.49 51.27 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.626 -0.671 . . . . 0.0 109.796 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.14 -23.61 51.69 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.547 -0.721 . . . . 0.0 110.338 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -82.15 -24.78 34.86 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.425 -0.797 . . . . 0.0 110.189 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt -58.64 165.37 3.16 Favored Pre-proline 0 N--CA 1.496 1.859 0 O-C-N 121.479 -0.763 . . . . 0.0 110.372 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 C--N 1.317 -1.125 0 O-C-N 123.427 1.225 . . . . 0.0 110.376 179.994 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.4 ttmt . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.125 0.488 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -153.95 -168.06 2.85 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.506 -0.746 . . . . 0.0 110.198 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -82.7 -27.72 31.02 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.625 -0.672 . . . . 0.0 110.356 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.1 mtt -73.31 -30.2 63.22 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.563 -0.71 . . . . 0.0 110.158 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.6 -29.3 62.3 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.667 -0.645 . . . . 0.0 110.039 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -72.1 -27.53 62.71 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.627 -0.671 . . . . 0.0 110.114 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.7 mtt85 -71.21 -29.27 64.95 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.49 -0.756 . . . . 0.0 110.115 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 49.8 mtt -70.93 -41.04 71.7 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.631 -0.668 . . . . 0.0 109.847 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.2 p -62.46 -28.33 69.74 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.74 -0.6 . . . . 0.0 109.747 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.654 ' HG ' HD23 ' B' ' 200' ' ' LEU . 0.5 OUTLIER -64.34 -30.38 71.43 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.613 -0.679 . . . . 0.0 110.059 179.726 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -72.23 -34.29 68.2 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.035 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -75.06 -31.33 61.24 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.635 -0.665 . . . . 0.0 109.779 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 56.7 m -72.52 -29.79 63.91 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.717 -0.614 . . . . 0.0 109.76 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -69.15 -26.98 65.14 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.619 -0.676 . . . . 0.0 110.149 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -70.36 -31.89 69.35 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.586 -0.697 . . . . 0.0 110.328 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.1 tp60 -77.51 -34.25 54.12 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.492 -0.755 . . . . 0.0 109.847 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.762 HG12 HD22 ' B' ' 193' ' ' LEU . 81.1 mt -74.08 -26.98 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.721 -0.612 . . . . 0.0 109.56 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.9 mt -72.38 -37.27 68.8 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.5 -0.75 . . . . 0.0 109.882 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -65.26 -30.63 71.53 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.585 -0.697 . . . . 0.0 109.846 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.699 HD12 HG12 ' B' ' 190' ' ' ILE . 1.6 mm? -68.72 -29.27 67.65 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.65 -0.656 . . . . 0.0 110.049 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.514 ' O ' HD13 ' A' ' 77' ' ' LEU . 22.8 mt-10 -69.44 -33.74 73.39 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.546 -0.721 . . . . 0.0 110.033 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -30.0 58.56 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.646 -0.659 . . . . 0.0 109.87 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -76.19 -29.42 57.66 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.686 -0.634 . . . . 0.0 109.986 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.687 HD13 HD12 ' B' ' 190' ' ' ILE . 13.5 tp -76.76 -32.12 57.51 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.585 -0.697 . . . . 0.0 109.863 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 73' ' ' GLU . 5.6 mp -76.55 -32.56 58.27 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.747 -0.595 . . . . 0.0 109.782 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.1 -28.73 61.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.698 -0.626 . . . . 0.0 109.811 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.529 HD12 HG12 ' B' ' 183' ' ' ILE . 0.8 OUTLIER -74.0 -36.69 64.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.619 -0.676 . . . . 0.0 109.89 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -69.25 -28.37 66.27 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.593 -0.692 . . . . 0.0 110.014 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -70.94 -27.92 64.11 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.564 -0.71 . . . . 0.0 110.052 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -44.18 64.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.532 -0.73 . . . . 0.0 109.804 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.6 ttpp -62.78 -27.66 69.45 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.513 -0.742 . . . . 0.0 109.673 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -63.95 -32.95 74.66 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.565 -0.71 . . . . 0.0 110.023 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -64.49 -34.88 79.24 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.534 -0.729 . . . . 0.0 109.792 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' B' ' 176' ' ' MET . 0.6 OUTLIER -64.22 -35.22 80.1 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.599 -0.688 . . . . 0.0 109.896 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -60.75 -35.45 76.42 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.585 -0.697 . . . . 0.0 110.029 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mt -62.81 -30.31 71.38 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.637 -0.664 . . . . 0.0 109.674 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -96.77 -26.79 15.01 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.693 -0.63 . . . . 0.0 110.095 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.759 HD11 ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.005 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.494 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 166' ' ' GLY . . . . . 0.716 ' HA2' HD22 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.75 HD12 ' N ' ' B' ' 168' ' ' SER . 0.5 OUTLIER -119.5 -28.62 5.29 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.589 -0.947 . . . . 0.0 110.615 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.75 ' N ' HD12 ' B' ' 167' ' ' LEU . 8.3 t -165.84 18.12 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.349 -0.845 . . . . 0.0 111.62 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 48.66 26.58 1.26 Allowed 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.095 -1.003 . . . . 0.0 111.291 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -154.44 -46.56 0.09 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.723 -0.611 . . . . 0.0 110.109 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.465 ' HB2' HD13 ' B' ' 167' ' ' LEU . 5.2 mt-10 -74.12 -35.38 64.12 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.921 -0.712 . . . . 0.0 109.291 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.735 ' N ' HD11 ' B' ' 167' ' ' LEU . 19.3 tp -76.01 -26.48 56.71 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.759 ' CD1' HD11 ' A' ' 90' ' ' LEU . 49.1 mm -69.22 -32.85 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -70.44 -30.18 66.96 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.716 -0.615 . . . . 0.0 109.869 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.416 ' O ' HG23 ' B' ' 179' ' ' VAL . 89.8 m-20 -67.22 -32.24 73.16 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.612 -0.68 . . . . 0.0 109.858 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.562 ' HE1' ' HG ' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -71.14 -31.51 67.81 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.713 -0.617 . . . . 0.0 109.746 179.611 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.79 -30.27 63.96 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.707 -0.621 . . . . 0.0 109.856 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -39.94 61.96 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.619 -0.676 . . . . 0.0 109.926 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.416 HG23 ' O ' ' B' ' 175' ' ' ASN . 61.2 t -72.09 -30.97 38.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.675 -0.641 . . . . 0.0 109.458 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.73 -30.09 65.25 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.664 -0.648 . . . . 0.0 109.748 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -67.33 -32.75 73.92 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.645 -0.659 . . . . 0.0 109.768 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 182' ' ' GLU . . . . . 0.525 ' O ' HG23 ' B' ' 186' ' ' VAL . 16.4 tt0 -74.14 -35.87 64.1 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.58 -0.7 . . . . 0.0 109.942 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.529 HG12 HD12 ' A' ' 79' ' ' LEU . 82.5 mt -72.99 -29.76 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.703 -0.623 . . . . 0.0 109.705 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 53.7 m -74.15 -32.7 63.24 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.633 -0.667 . . . . 0.0 109.806 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.0 mtt -74.33 -39.27 62.94 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.669 -0.644 . . . . 0.0 109.705 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 186' ' ' VAL . . . . . 0.525 HG23 ' O ' ' B' ' 182' ' ' GLU . 57.3 t -72.33 -30.83 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.586 -0.696 . . . . 0.0 109.511 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -72.72 -29.7 63.58 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.711 -0.618 . . . . 0.0 109.905 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -70.44 -29.89 66.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.641 -0.662 . . . . 0.0 109.899 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.06 -34.05 63.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.706 -0.621 . . . . 0.0 109.989 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.699 HG12 HD12 ' A' ' 72' ' ' LEU . 72.9 mt -73.86 -31.77 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.583 -0.698 . . . . 0.0 109.742 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 89.8 p -72.21 -34.88 68.69 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.615 -0.678 . . . . 0.0 109.462 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 4.0 mmmt -76.35 -32.51 58.69 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.366 179.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.762 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -71.08 -31.37 67.73 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 179.276 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.9 tptt -68.83 -46.68 67.94 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.592 -0.693 . . . . 0.0 109.651 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 3.2 tptp -66.58 -31.47 72.19 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.563 -0.71 . . . . 0.0 109.287 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -65.25 -34.87 79.37 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -65.3 -29.11 69.84 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.688 -0.633 . . . . 0.0 109.676 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -62.16 -40.19 95.16 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.629 -0.669 . . . . 0.0 109.76 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -62.49 -34.63 77.22 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.79 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.654 HD23 ' HG ' ' A' ' 62' ' ' LEU . 11.0 tp -76.88 -30.69 56.33 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.653 -0.655 . . . . 0.0 109.702 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.514 ' HG2' HD11 ' A' ' 62' ' ' LEU . 8.8 mt-10 -79.2 -31.18 43.67 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.613 -0.68 . . . . 0.0 109.713 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -78.99 -29.76 43.96 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.719 -0.613 . . . . 0.0 109.79 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -78.28 -28.14 47.53 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.623 -0.673 . . . . 0.0 109.924 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.51 -27.72 46.14 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.598 -0.689 . . . . 0.0 110.072 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -86.76 -33.29 19.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.59 -0.694 . . . . 0.0 110.172 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 9.9 mmtp 51.85 94.71 0.05 OUTLIER Pre-proline 0 N--CA 1.502 2.129 0 O-C-N 121.546 -0.721 . . . . 0.0 110.906 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.316 -1.184 0 O-C-N 123.365 1.192 . . . . 0.0 110.404 179.944 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.0 mtpt . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.194 0.521 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.72 -172.8 3.83 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.46 -0.775 . . . . 0.0 110.151 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -111.3 -29.25 7.9 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.608 -0.682 . . . . 0.0 110.154 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.8 mtt -87.81 -28.07 21.89 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.607 -0.683 . . . . 0.0 110.26 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -61.0 -28.08 68.78 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.539 -0.726 . . . . 0.0 110.256 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.5 -28.1 63.67 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.611 -0.68 . . . . 0.0 110.199 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -73.28 -29.61 62.85 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.56 -0.713 . . . . 0.0 110.123 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -34.13 68.59 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.525 -0.735 . . . . 0.0 109.843 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -67.53 -29.89 69.41 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.61 -0.681 . . . . 0.0 109.901 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.907 HD22 HD23 ' B' ' 200' ' ' LEU . 1.5 mm? -65.49 -29.22 69.85 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.618 -0.676 . . . . 0.0 109.842 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -63.24 -41.82 99.13 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.666 -0.646 . . . . 0.0 109.997 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -72.16 -37.55 69.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.667 -0.646 . . . . 0.0 109.642 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.49 HG22 ' CD1' ' A' ' 69' ' ' ILE . 89.7 m -73.62 -30.9 63.25 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.757 -0.59 . . . . 0.0 109.413 179.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -69.9 -27.66 64.98 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 120.166 -0.614 . . . . 0.0 109.92 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.47 -38.54 81.16 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.587 -0.695 . . . . 0.0 110.084 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -75.99 -36.02 59.36 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.612 -0.68 . . . . 0.0 109.606 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.738 HG12 HD23 ' B' ' 193' ' ' LEU . 86.1 mt -75.61 -26.2 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.777 -0.577 . . . . 0.0 109.644 179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.419 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.0 tt -76.03 -33.89 59.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.549 -0.72 . . . . 0.0 109.812 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.9 mmtm -70.41 -32.97 70.82 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.601 -0.687 . . . . 0.0 109.655 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.704 HD22 HG12 ' B' ' 190' ' ' ILE . 6.9 mt -65.8 -29.96 70.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.679 -0.638 . . . . 0.0 109.707 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.11 -44.18 96.39 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.648 -0.658 . . . . 0.0 109.82 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.08 -32.5 72.87 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.693 -0.63 . . . . 0.0 109.428 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -67.53 -35.2 78.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.773 -0.579 . . . . 0.0 109.743 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -71.19 -31.64 67.88 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.719 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.65 -38.72 67.58 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.718 -0.614 . . . . 0.0 109.572 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.17 -30.57 71.08 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.714 -0.617 . . . . 0.0 109.742 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.418 ' HA ' HD13 ' A' ' 79' ' ' LEU . 1.1 mm? -70.33 -46.75 63.55 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.708 -0.62 . . . . 0.0 109.734 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -64.28 -31.04 72.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.633 -0.667 . . . . 0.0 109.602 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.75 -29.43 69.95 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.688 -0.633 . . . . 0.0 109.781 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -64.62 -47.65 77.78 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.656 -0.653 . . . . 0.0 109.669 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 tptm -63.1 -30.77 71.86 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.671 -0.643 . . . . 0.0 109.619 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -64.93 -34.31 78.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.744 -0.598 . . . . 0.0 109.832 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -70.52 -37.35 74.11 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.709 -0.619 . . . . 0.0 109.745 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.641 HD23 HD21 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -66.1 -29.42 69.74 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.711 -0.618 . . . . 0.0 109.763 179.557 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -29.53 69.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.57 -0.706 . . . . 0.0 109.829 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.0 mp -76.62 -28.83 56.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.702 -0.624 . . . . 0.0 110.044 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -95.72 1.61 53.51 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.578 -0.701 . . . . 0.0 111.071 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.533 HD11 ' CD1' ' B' ' 173' ' ' ILE . 55.1 tp . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.272 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.852 HD21 HD12 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -146.26 -79.48 0.16 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.561 -0.964 . . . . 0.0 110.471 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 35.5 t -134.35 18.85 3.66 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.19 -0.944 . . . . 0.0 110.799 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 7.4 tptm 50.76 25.9 2.32 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.222 -0.924 . . . . 0.0 110.558 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -148.44 -46.49 0.15 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.612 -0.68 . . . . 0.0 109.417 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.619 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.3 mm-40 -67.39 -33.08 74.44 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.286 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.852 HD12 HD21 ' B' ' 167' ' ' LEU . 1.2 tt -78.5 -28.42 46.33 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 178.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.533 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.7 mm -68.5 -30.82 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -71.76 -30.27 65.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.648 -0.658 . . . . 0.0 109.979 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.744 ' O ' HG23 ' B' ' 179' ' ' VAL . 96.6 m-20 -74.72 -32.9 62.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.636 -0.665 . . . . 0.0 109.716 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.456 ' CE ' HD13 ' A' ' 90' ' ' LEU . 1.4 mtt -70.13 -29.77 66.78 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.692 -0.63 . . . . 0.0 109.983 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -73.81 -35.12 64.83 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.584 -0.697 . . . . 0.0 110.044 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -75.55 -29.93 59.54 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.636 -0.665 . . . . 0.0 109.876 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.744 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.4 t -76.05 -29.88 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.608 -0.682 . . . . 0.0 109.653 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 180' ' ' ASP . . . . . 0.406 ' HA ' HD12 ' B' ' 183' ' ' ILE . 17.8 t70 -75.73 -35.93 60.09 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.653 -0.654 . . . . 0.0 109.834 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.4 mtt85 -71.46 -28.45 63.96 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.632 -0.668 . . . . 0.0 109.723 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -70.19 -32.96 71.14 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.531 -0.731 . . . . 0.0 109.953 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' B' ' 180' ' ' ASP . 76.0 mt -70.88 -29.05 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.568 -0.707 . . . . 0.0 109.766 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.9 m -71.34 -34.73 70.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.574 -0.704 . . . . 0.0 109.742 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.22 -43.85 66.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.615 -0.678 . . . . 0.0 109.731 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 73.4 t -71.95 -31.53 40.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.577 -0.702 . . . . 0.0 109.426 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.49 -30.18 59.79 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.659 -0.651 . . . . 0.0 109.704 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 12.0 tp-100 -73.03 -30.13 63.52 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.643 -0.66 . . . . 0.0 109.843 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -37.44 73.73 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.683 -0.636 . . . . 0.0 109.823 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.704 HG12 HD22 ' A' ' 72' ' ' LEU . 75.8 mt -71.26 -31.15 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.63 -0.668 . . . . 0.0 109.554 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 6.4 m -68.49 -35.0 76.9 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.679 -0.638 . . . . 0.0 109.517 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 3.5 mmmm -74.73 -37.05 62.64 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.702 -0.624 . . . . 0.0 109.393 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.738 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -70.92 -31.82 68.56 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.635 -0.665 . . . . 0.0 109.367 179.297 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.7 tptm -66.56 -40.25 88.92 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.724 -0.61 . . . . 0.0 109.446 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -64.37 -31.62 72.9 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.666 -0.646 . . . . 0.0 109.43 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -63.74 -36.39 83.73 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.671 -0.643 . . . . 0.0 109.462 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -62.83 -30.03 71.18 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.774 -0.579 . . . . 0.0 109.632 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.54 -44.24 97.41 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.646 -0.659 . . . . 0.0 109.894 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -63.55 -39.98 95.82 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.699 -0.626 . . . . 0.0 109.699 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.907 HD23 HD22 ' A' ' 62' ' ' LEU . 3.6 tp -70.8 -40.64 72.4 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.655 -0.653 . . . . 0.0 109.721 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -73.12 -30.5 63.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.656 -0.653 . . . . 0.0 109.668 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -74.84 -29.97 61.22 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.69 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -69.79 -30.25 67.75 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.663 -0.648 . . . . 0.0 109.659 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -64.07 -30.28 71.36 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.651 -0.656 . . . . 0.0 109.762 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -110.57 28.46 8.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.698 -0.626 . . . . 0.0 110.086 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -107.63 88.3 4.16 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.535 -0.728 . . . . 0.0 110.178 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo . . . . . 0 C--N 1.318 -1.071 0 O-C-N 123.354 1.186 . . . . 0.0 110.404 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 19.0 pttp . . . . . 0 N--CA 1.493 1.699 0 CA-C-O 121.141 0.496 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -126.4 -169.63 2.05 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.552 -0.717 . . . . 0.0 110.187 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 52.87 38.74 27.59 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.465 -0.772 . . . . 0.0 110.758 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 7.0 mtt -135.03 -43.71 0.72 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.608 -0.682 . . . . 0.0 110.413 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.66 -28.65 68.75 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.63 -0.669 . . . . 0.0 110.269 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -77.24 -32.32 55.67 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.637 -0.665 . . . . 0.0 109.982 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -74.94 -27.05 60.04 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.698 -0.626 . . . . 0.0 110.01 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 20.0 mtp -75.74 -28.74 58.61 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.6 -0.688 . . . . 0.0 110.096 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.2 t -74.33 -29.23 61.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.565 -0.71 . . . . 0.0 110.135 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.0 tp -75.41 -28.34 59.37 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.663 -0.648 . . . . 0.0 110.084 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.16 -32.38 61.28 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.534 -0.729 . . . . 0.0 110.127 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -75.89 -36.79 59.36 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.629 -0.669 . . . . 0.0 109.735 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.412 HG22 HD11 ' A' ' 69' ' ' ILE . 89.6 m -71.87 -30.51 65.5 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.734 -0.603 . . . . 0.0 109.446 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -67.1 -28.91 68.56 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.593 -0.692 . . . . 0.0 109.767 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -63.49 -40.17 96.38 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.623 -0.673 . . . . 0.0 110.058 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -74.22 -34.54 63.71 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.653 -0.654 . . . . 0.0 109.609 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.486 HG12 HD22 ' B' ' 193' ' ' LEU . 73.8 mt -74.63 -27.05 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.744 -0.598 . . . . 0.0 109.578 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.481 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.3 tt -73.01 -31.56 64.55 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.544 -0.723 . . . . 0.0 109.843 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -30.88 70.94 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.509 -0.744 . . . . 0.0 109.843 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.663 HD22 HG12 ' B' ' 190' ' ' ILE . 18.9 mt -65.02 -29.1 69.99 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.624 -0.673 . . . . 0.0 110.036 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.605 ' O ' HD13 ' A' ' 77' ' ' LEU . 2.6 tp10 -66.76 -35.32 79.83 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.653 -0.654 . . . . 0.0 110.076 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.5 -32.8 58.53 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.603 -0.686 . . . . 0.0 109.826 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.7 tmtm? -77.73 -30.19 51.53 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.729 -0.607 . . . . 0.0 109.586 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.552 HD13 HD12 ' B' ' 190' ' ' ILE . 27.8 tp -79.16 -30.19 43.42 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.665 -0.647 . . . . 0.0 109.78 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.605 HD13 ' O ' ' A' ' 73' ' ' GLU . 1.4 mp -77.68 -31.28 52.41 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.634 -0.666 . . . . 0.0 109.719 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.26 -28.66 59.9 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.655 -0.653 . . . . 0.0 109.875 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.75 HD23 ' HA ' ' B' ' 183' ' ' ILE . 4.6 tp -76.48 -36.24 57.94 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.603 -0.686 . . . . 0.0 109.893 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -73.04 -30.46 63.74 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.614 -0.679 . . . . 0.0 109.694 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -70.85 -27.95 64.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.677 -0.64 . . . . 0.0 109.875 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -39.67 81.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.571 -0.706 . . . . 0.0 109.935 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -68.99 -29.72 67.98 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.592 -0.693 . . . . 0.0 109.91 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -69.91 -29.75 67.01 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.7 -0.625 . . . . 0.0 109.943 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -67.15 -36.27 81.48 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.66 -0.65 . . . . 0.0 109.861 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.413 HD13 ' HG2' ' B' ' 176' ' ' MET . 3.7 mt -59.99 -36.59 77.51 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.659 -0.651 . . . . 0.0 110.01 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -63.6 -51.66 64.31 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.618 -0.676 . . . . 0.0 109.666 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.6 mt -62.14 -27.36 68.89 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.696 -0.627 . . . . 0.0 109.611 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -107.78 21.12 17.88 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.621 -0.674 . . . . 0.0 110.417 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.698 ' HA ' HD23 ' B' ' 172' ' ' LEU . 3.4 mt . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.445 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 1.022 HD21 HD13 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -49.67 -61.9 1.86 Allowed 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.545 -0.974 . . . . 0.0 111.596 -179.658 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 5.3 t -149.14 14.74 0.9 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.995 -1.065 . . . . 0.0 111.328 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 19.6 tptt 49.94 26.21 1.92 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.081 -1.012 . . . . 0.0 110.867 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -150.86 -46.48 0.12 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.695 -0.628 . . . . 0.0 109.753 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.76 -42.64 85.8 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.355 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 1.022 HD13 HD21 ' B' ' 167' ' ' LEU . 9.8 tp -71.44 -28.78 64.21 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.0 mm -66.35 -32.1 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -74.94 -31.17 61.43 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.734 -0.604 . . . . 0.0 109.637 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.797 ' O ' HG23 ' B' ' 179' ' ' VAL . 89.3 m-20 -71.64 -29.95 65.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.692 -0.63 . . . . 0.0 109.805 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.466 ' HE1' HD11 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -68.06 -32.31 72.57 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.657 -0.652 . . . . 0.0 109.938 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -72.65 -34.49 67.3 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.616 -0.677 . . . . 0.0 109.933 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.41 -29.68 61.62 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.823 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.797 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.6 t -74.44 -30.17 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.638 -0.664 . . . . 0.0 109.75 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -71.94 -30.84 65.73 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.671 -0.643 . . . . 0.0 110.045 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -28.8 61.31 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.635 -0.666 . . . . 0.0 109.933 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -74.63 -37.24 62.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.587 -0.696 . . . . 0.0 109.928 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.75 ' HA ' HD23 ' A' ' 79' ' ' LEU . 90.3 mt -71.19 -29.66 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.689 -0.632 . . . . 0.0 109.592 179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 184' ' ' THR . . . . . 0.405 HG22 ' OE1' ' B' ' 188' ' ' GLN . 65.5 m -70.71 -33.79 71.23 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.664 -0.648 . . . . 0.0 109.664 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.0 mtt -70.18 -44.54 68.52 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.637 -0.664 . . . . 0.0 109.686 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 67.4 t -66.92 -30.98 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.676 -0.64 . . . . 0.0 109.563 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.88 -30.69 68.19 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.654 -0.653 . . . . 0.0 109.808 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 188' ' ' GLN . . . . . 0.405 ' OE1' HG22 ' B' ' 184' ' ' THR . 0.0 OUTLIER -67.97 -36.59 80.32 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.663 -0.648 . . . . 0.0 109.712 179.716 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -38.56 82.06 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.633 -0.667 . . . . 0.0 109.85 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.663 HG12 HD22 ' A' ' 72' ' ' LEU . 72.9 mt -70.62 -37.09 68.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.623 -0.673 . . . . 0.0 109.667 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 32.5 m -68.87 -33.39 73.72 Favored 'General case' 0 N--CA 1.496 1.842 0 C-N-CA 120.192 -0.603 . . . . 0.0 109.605 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -77.01 -33.03 57.51 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.629 -0.67 . . . . 0.0 109.488 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.65 HD13 HD11 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -73.31 -33.14 65.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.68 -0.638 . . . . 0.0 109.324 179.186 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 16.5 tptt -65.4 -38.69 90.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.567 -0.708 . . . . 0.0 109.394 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -67.57 -31.24 71.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.627 -0.67 . . . . 0.0 109.336 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -37.1 86.01 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.664 -0.648 . . . . 0.0 109.422 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -62.79 -30.35 71.4 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.702 -0.624 . . . . 0.0 109.691 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -61.52 -41.2 96.95 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.672 -0.643 . . . . 0.0 109.874 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -62.29 -41.83 98.83 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.24 -0.584 . . . . 0.0 109.849 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.3 tp -72.36 -30.66 64.91 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.69 -0.631 . . . . 0.0 109.765 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -77.37 -30.67 53.87 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.679 -0.638 . . . . 0.0 109.832 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -77.07 -29.04 54.9 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.699 -0.626 . . . . 0.0 109.852 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -77.68 -29.27 51.36 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.637 -0.665 . . . . 0.0 110.012 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.94 -28.32 43.72 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.549 -0.719 . . . . 0.0 110.121 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -97.65 -25.69 15.02 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.626 -0.671 . . . . 0.0 110.278 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 24.3 mttt 52.89 87.07 0.14 Allowed Pre-proline 0 N--CA 1.501 2.107 0 O-C-N 121.369 -0.832 . . . . 0.0 110.807 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo . . . . . 0 C--N 1.317 -1.099 0 O-C-N 123.448 1.236 . . . . 0.0 110.409 179.951 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 121.009 0.433 . . . . 0.0 110.363 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 170.45 3.26 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.547 -0.72 . . . . 0.0 110.272 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -82.54 -28.81 30.78 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.674 -0.641 . . . . 0.0 110.221 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.1 mtm -61.91 -24.41 66.95 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.601 -0.687 . . . . 0.0 110.455 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.15 -39.01 81.09 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.496 -0.752 . . . . 0.0 110.364 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.93 -34.01 66.3 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.664 -0.648 . . . . 0.0 109.762 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -73.54 -28.03 61.66 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.71 -0.618 . . . . 0.0 109.771 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 48.4 mtp -72.21 -29.38 63.91 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.576 -0.703 . . . . 0.0 109.941 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.9 p -69.06 -30.73 69.13 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.648 -0.658 . . . . 0.0 109.897 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.682 HD12 HD23 ' B' ' 200' ' ' LEU . 1.6 tp -67.56 -28.69 68.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.68 -0.637 . . . . 0.0 109.923 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -65.75 -30.0 70.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.53 -0.731 . . . . 0.0 110.009 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -48.99 66.1 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.59 -0.694 . . . . 0.0 109.976 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.429 HG23 ' NZ ' ' B' ' 196' ' ' LYS . 26.6 m -67.02 -30.61 70.75 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.612 -0.68 . . . . 0.0 109.472 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -68.97 -28.12 66.34 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.681 -0.637 . . . . 0.0 109.883 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -65.19 -39.08 92.37 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.553 -0.717 . . . . 0.0 109.943 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.73 -41.09 65.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.615 -0.678 . . . . 0.0 109.42 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.439 HG12 HD23 ' B' ' 193' ' ' LEU . 87.4 mt -66.43 -27.21 39.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 mt -62.65 -41.32 98.99 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.588 -0.695 . . . . 0.0 109.629 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -65.14 -30.35 71.27 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.53 -0.731 . . . . 0.0 109.621 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.727 ' CD1' HD13 ' B' ' 193' ' ' LEU . 12.3 mt -73.05 -29.02 62.66 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.691 -0.63 . . . . 0.0 109.95 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.78 -34.71 72.07 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.599 -0.688 . . . . 0.0 109.881 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -74.03 -29.94 62.18 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.619 -0.676 . . . . 0.0 109.73 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -73.66 -30.02 62.67 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.637 -0.664 . . . . 0.0 109.916 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.945 HD13 HD12 ' B' ' 190' ' ' ILE . 13.0 tp -75.32 -32.51 60.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.638 -0.664 . . . . 0.0 109.935 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.54 -30.94 57.32 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.633 -0.667 . . . . 0.0 109.748 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.23 -28.84 60.06 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.688 -0.632 . . . . 0.0 109.845 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.432 ' HA ' HD13 ' A' ' 79' ' ' LEU . 1.1 mm? -75.08 -36.95 61.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.536 -0.728 . . . . 0.0 109.823 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -70.63 -29.85 66.34 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.538 -0.726 . . . . 0.0 109.802 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -69.78 -27.85 65.25 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.693 -0.629 . . . . 0.0 109.973 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -40.37 83.8 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.544 -0.723 . . . . 0.0 109.849 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -69.14 -30.46 68.72 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.474 -0.766 . . . . 0.0 109.627 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.4 t-80 -67.19 -29.62 69.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.655 -0.653 . . . . 0.0 109.826 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -63.06 -36.17 82.7 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.624 -0.672 . . . . 0.0 109.936 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.693 HD23 HD21 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -67.52 -32.56 73.44 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.582 -0.699 . . . . 0.0 109.887 179.814 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -66.9 -29.48 69.37 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.658 -0.651 . . . . 0.0 109.996 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.0 mt -66.86 -29.29 69.17 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.601 -0.687 . . . . 0.0 110.049 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -120.14 29.28 7.59 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.58 -0.7 . . . . 0.0 110.161 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.705 HD13 ' CE ' ' B' ' 176' ' ' MET . 27.7 tp . . . . . 0 N--CA 1.497 1.906 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.053 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.764 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.0 OUTLIER -141.74 -82.62 0.21 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.681 -0.893 . . . . 0.0 110.413 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 59.8 p -129.5 19.52 5.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.13 -0.981 . . . . 0.0 110.825 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 5.7 tptm 50.61 25.99 2.26 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.272 -0.893 . . . . 0.0 110.616 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -148.79 -46.0 0.15 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.648 -0.657 . . . . 0.0 109.605 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.604 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.8 OUTLIER -68.33 -33.16 73.79 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.92 -0.712 . . . . 0.0 109.322 179.467 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.764 ' N ' HD11 ' B' ' 167' ' ' LEU . 2.7 tt -78.11 -28.37 48.59 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 178.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.426 HD13 HD11 ' A' ' 90' ' ' LEU . 50.8 mm -67.54 -30.76 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.736 -0.602 . . . . 0.0 109.381 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -72.04 -29.73 64.46 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.668 -0.645 . . . . 0.0 109.926 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -75.44 -30.95 60.16 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.611 -0.681 . . . . 0.0 109.8 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.705 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.9 OUTLIER -71.92 -29.14 63.99 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.734 -0.604 . . . . 0.0 109.84 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -70.42 -29.96 66.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.592 -0.692 . . . . 0.0 110.027 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.9 ttp180 -71.99 -36.36 69.75 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.617 -0.677 . . . . 0.0 109.923 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 58.4 t -67.22 -29.82 47.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.707 -0.62 . . . . 0.0 109.881 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -69.12 -28.95 66.92 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.632 -0.667 . . . . 0.0 110.141 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.36 -30.0 63.01 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.654 -0.654 . . . . 0.0 110.066 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -74.63 -35.74 62.9 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.597 -0.689 . . . . 0.0 109.956 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.9 mt -71.82 -30.85 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.705 -0.622 . . . . 0.0 109.56 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.7 m -69.71 -35.14 74.78 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.63 -0.669 . . . . 0.0 109.617 179.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.7 ttp -66.61 -44.84 81.0 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.654 -0.654 . . . . 0.0 109.815 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 64.6 t -68.96 -30.65 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.628 -0.67 . . . . 0.0 109.476 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -70.18 -28.51 65.38 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.67 -0.644 . . . . 0.0 110.021 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -67.47 -32.86 73.99 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.582 -0.699 . . . . 0.0 110.041 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.05 -33.65 57.22 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.663 -0.648 . . . . 0.0 109.67 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.945 HD12 HD13 ' A' ' 76' ' ' LEU . 75.2 mt -76.01 -27.91 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.615 -0.678 . . . . 0.0 109.705 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.33 -30.48 63.38 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.632 -0.667 . . . . 0.0 109.572 179.473 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 19.8 mmtt -76.27 -37.11 58.0 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.596 -0.69 . . . . 0.0 109.749 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.727 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.1 OUTLIER -71.03 -30.79 67.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.615 -0.678 . . . . 0.0 109.428 179.355 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.1 tptm -67.56 -38.26 83.88 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.635 -0.665 . . . . 0.0 109.614 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.3 tptt -69.62 -30.28 67.98 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.575 -0.703 . . . . 0.0 109.533 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.429 ' NZ ' HG23 ' A' ' 65' ' ' THR . 31.2 ttpt -67.52 -32.77 73.8 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.603 -0.685 . . . . 0.0 109.606 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -65.27 -30.91 71.82 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.692 -0.63 . . . . 0.0 109.684 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -43.42 98.88 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.765 -0.584 . . . . 0.0 109.93 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -46.76 87.84 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.696 -0.627 . . . . 0.0 109.942 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.682 HD23 HD12 ' A' ' 62' ' ' LEU . 4.8 tp -70.27 -32.87 70.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.649 -0.657 . . . . 0.0 109.725 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -77.22 -29.68 54.3 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.642 -0.661 . . . . 0.0 109.878 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -78.41 -28.8 46.93 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.648 -0.657 . . . . 0.0 109.875 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -79.58 -29.46 41.26 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.582 -0.699 . . . . 0.0 109.977 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -81.05 -27.62 35.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.667 -0.646 . . . . 0.0 110.108 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -91.82 -26.38 18.54 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.548 -0.72 . . . . 0.0 110.349 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 16.0 mmtp 53.06 84.33 0.21 Allowed Pre-proline 0 N--CA 1.501 2.108 0 O-C-N 121.298 -0.876 . . . . 0.0 110.769 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo . . . . . 0 C--N 1.318 -1.052 0 O-C-N 123.49 1.258 . . . . 0.0 110.428 -179.989 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.066 0.46 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.4 pttt -164.47 169.0 17.79 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.554 -0.716 . . . . 0.0 110.251 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -154.28 28.2 0.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.594 -0.691 . . . . 0.0 110.205 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -155.79 -44.03 0.08 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.565 -0.709 . . . . 0.0 110.072 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.7 mp0 -60.17 -27.71 67.34 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.634 -0.666 . . . . 0.0 110.262 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -72.5 -29.21 63.42 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.553 -0.717 . . . . 0.0 110.094 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -70.67 -28.7 64.98 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.696 -0.628 . . . . 0.0 110.053 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.2 ttp -69.04 -29.27 67.39 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.575 -0.703 . . . . 0.0 110.001 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.9 t -72.37 -29.58 63.91 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.568 -0.707 . . . . 0.0 110.023 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.606 HD21 ' HG2' ' B' ' 201' ' ' GLU . 0.5 OUTLIER -70.85 -27.44 63.85 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.626 -0.671 . . . . 0.0 110.168 179.869 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -70.68 -29.32 65.6 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.55 -0.719 . . . . 0.0 110.184 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -74.74 -40.22 61.39 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.58 -0.7 . . . . 0.0 109.973 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.7 m -71.48 -29.75 65.19 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.729 -0.607 . . . . 0.0 109.723 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.421 ' HA ' HD12 ' A' ' 69' ' ' ILE . 3.5 mmtp -72.5 -28.48 62.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.649 -0.657 . . . . 0.0 109.925 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -34.6 73.12 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.59 -0.694 . . . . 0.0 109.979 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -37.17 65.64 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.668 -0.645 . . . . 0.0 109.706 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.518 HG22 ' OE2' ' A' ' 73' ' ' GLU . 66.5 mt -68.77 -27.77 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.714 -0.616 . . . . 0.0 109.619 179.472 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.22 -35.93 80.62 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.58 -0.7 . . . . 0.0 109.936 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.0 mttt -70.03 -30.18 67.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.6 -0.687 . . . . 0.0 109.96 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.705 HD12 HG12 ' B' ' 190' ' ' ILE . 2.9 mm? -70.86 -28.7 64.76 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.61 -0.681 . . . . 0.0 109.964 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.518 ' OE2' HG22 ' A' ' 69' ' ' ILE . 0.4 OUTLIER -69.34 -35.82 76.3 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.535 -0.728 . . . . 0.0 110.099 179.863 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -73.11 -31.7 64.49 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.716 -0.615 . . . . 0.0 109.827 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -75.04 -34.71 61.89 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.687 -0.633 . . . . 0.0 109.788 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.855 HD13 HD12 ' B' ' 190' ' ' ILE . 10.0 tp -74.19 -30.42 62.21 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.663 -0.648 . . . . 0.0 109.703 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.5 tp -74.8 -35.34 62.5 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.74 -0.6 . . . . 0.0 109.69 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.97 -29.82 68.12 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.707 -0.621 . . . . 0.0 109.758 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.75 HD23 ' HA ' ' B' ' 183' ' ' ILE . 2.8 mp -69.81 -43.1 72.76 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.767 -0.583 . . . . 0.0 109.813 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -66.64 -29.14 69.09 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.657 -0.652 . . . . 0.0 109.89 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -69.33 -30.46 68.51 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.557 -0.714 . . . . 0.0 109.826 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.4 -48.26 50.99 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.619 -0.676 . . . . 0.0 109.729 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.5 tttp -63.87 -29.52 70.7 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.587 -0.696 . . . . 0.0 109.568 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -66.08 -29.98 70.41 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.675 -0.641 . . . . 0.0 109.948 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -64.15 -40.62 96.52 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.638 -0.664 . . . . 0.0 109.86 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.835 HD23 HD21 ' B' ' 172' ' ' LEU . 2.8 mt -60.41 -33.5 72.58 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.557 -0.715 . . . . 0.0 110.066 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -63.8 -47.13 82.09 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.59 -0.694 . . . . 0.0 109.786 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.54 -28.63 68.69 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.722 -0.611 . . . . 0.0 109.678 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.48 13.06 36.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.679 -0.638 . . . . 0.0 110.81 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.52 HD11 ' CD1' ' B' ' 173' ' ' ILE . 27.7 tp . . . . . 0 N--CA 1.499 1.984 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.315 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.956 HD21 HD12 ' B' ' 172' ' ' LEU . 0.1 OUTLIER -144.64 -68.93 0.3 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.556 -0.967 . . . . 0.0 110.67 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 13.1 t -145.44 16.41 1.48 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.225 -0.922 . . . . 0.0 110.974 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.7 tptm 50.65 26.06 2.32 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.119 -0.988 . . . . 0.0 110.615 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -149.14 -46.58 0.14 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.606 -0.684 . . . . 0.0 109.491 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.607 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.8 mt-10 -66.26 -37.13 84.76 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.979 -0.688 . . . . 0.0 109.395 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.956 HD12 HD21 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -75.2 -28.66 60.08 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.859 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.52 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.5 mm -66.84 -30.49 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.67 -0.644 . . . . 0.0 109.341 179.345 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -74.56 -30.12 61.62 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.68 -0.638 . . . . 0.0 109.847 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.58 ' O ' HG23 ' B' ' 179' ' ' VAL . 83.7 m-20 -74.38 -29.3 61.49 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.639 -0.663 . . . . 0.0 109.979 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.456 ' HE2' ' C ' ' A' ' 86' ' ' LEU . 0.8 OUTLIER -72.49 -29.63 63.8 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.68 -0.638 . . . . 0.0 109.952 179.764 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -75.79 -28.96 58.58 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.657 -0.652 . . . . 0.0 110.138 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.91 -31.76 56.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.582 -0.699 . . . . 0.0 109.898 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.58 HG23 ' O ' ' B' ' 175' ' ' ASN . 66.4 t -74.93 -29.29 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.668 -0.645 . . . . 0.0 109.774 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 180' ' ' ASP . . . . . 0.403 ' O ' ' OG1' ' B' ' 184' ' ' THR . 14.6 t70 -73.7 -28.26 61.63 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.59 -0.694 . . . . 0.0 110.089 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.09 -31.38 64.32 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.625 -0.672 . . . . 0.0 110.101 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -73.53 -37.65 65.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.609 -0.682 . . . . 0.0 110.004 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.75 ' HA ' HD23 ' A' ' 79' ' ' LEU . 85.1 mt -68.57 -28.1 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.704 -0.623 . . . . 0.0 109.702 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 184' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 2.7 m -67.46 -34.54 77.39 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.492 -0.755 . . . . 0.0 109.85 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -48.26 69.41 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.552 -0.718 . . . . 0.0 109.833 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 186' ' ' VAL . . . . . 0.441 HG21 HD21 ' A' ' 79' ' ' LEU . 58.5 t -64.44 -28.93 45.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.61 -0.681 . . . . 0.0 109.816 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -70.81 -28.94 65.0 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.638 -0.664 . . . . 0.0 110.068 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -68.95 -31.31 70.09 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.548 -0.72 . . . . 0.0 110.047 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -40.53 65.48 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.703 -0.623 . . . . 0.0 109.893 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.855 HD12 HD13 ' A' ' 76' ' ' LEU . 77.2 mt -70.5 -28.51 35.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.687 -0.633 . . . . 0.0 109.819 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.0 m -73.85 -36.03 64.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.554 -0.716 . . . . 0.0 109.842 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -77.17 -31.08 55.22 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.615 -0.678 . . . . 0.0 109.611 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.474 HD23 ' HE2' ' B' ' 196' ' ' LYS . 0.2 OUTLIER -77.78 -21.76 51.18 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.576 -0.702 . . . . 0.0 110.159 179.411 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.8 tptm -81.35 -27.54 34.87 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.325 -0.86 . . . . 0.0 109.673 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 27.4 tptt -75.67 -35.3 60.42 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.54 -0.725 . . . . 0.0 109.94 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.474 ' HE2' HD23 ' B' ' 193' ' ' LEU . 13.8 pttt -69.04 -25.42 64.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.511 -0.743 . . . . 0.0 109.892 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -71.8 -29.96 65.01 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.521 -0.737 . . . . 0.0 109.603 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -62.38 -41.91 99.01 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.705 -0.622 . . . . 0.0 109.751 179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.75 -38.79 91.94 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.733 -0.604 . . . . 0.0 109.639 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.513 HD23 HD12 ' A' ' 62' ' ' LEU . 2.6 tp -75.7 -32.33 60.04 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.61 -0.681 . . . . 0.0 109.508 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.606 ' HG2' HD21 ' A' ' 62' ' ' LEU . 2.7 mm-40 -78.45 -30.49 47.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.658 -0.651 . . . . 0.0 109.738 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -79.19 -29.11 42.74 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.633 -0.667 . . . . 0.0 109.812 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -79.65 -28.74 40.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.637 -0.664 . . . . 0.0 109.928 179.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -80.86 -28.15 36.16 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.564 -0.71 . . . . 0.0 110.074 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -92.64 -27.07 17.53 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.553 -0.717 . . . . 0.0 110.313 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt 52.61 69.55 2.32 Favored Pre-proline 0 N--CA 1.501 2.077 0 O-C-N 121.428 -0.795 . . . . 0.0 110.73 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.317 -1.112 0 O-C-N 123.306 1.161 . . . . 0.0 110.389 179.998 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.7 mttp . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.113 0.482 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -86.54 -161.2 0.63 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.568 -0.708 . . . . 0.0 110.276 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 52.67 24.78 3.33 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.424 -0.797 . . . . 0.0 110.854 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.1 tpt -103.43 -36.23 8.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.504 -0.747 . . . . 0.0 109.985 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.35 -29.35 68.06 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.689 -0.632 . . . . 0.0 109.943 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -69.12 -29.45 67.51 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.637 -0.664 . . . . 0.0 110.006 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.23 -38.77 88.71 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.589 -0.694 . . . . 0.0 109.804 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.3 mtp -65.9 -31.01 71.7 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.699 -0.625 . . . . 0.0 109.622 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 29.5 t -63.56 -30.03 71.21 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.716 -0.615 . . . . 0.0 109.718 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.7 tp -61.82 -28.96 69.84 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.621 -0.675 . . . . 0.0 110.048 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -69.97 -48.65 57.43 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.479 -0.763 . . . . 0.0 109.982 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.92 -30.94 70.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.73 -0.606 . . . . 0.0 109.797 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.55 HG22 HD11 ' A' ' 69' ' ' ILE . 84.1 m -74.67 -30.71 61.68 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.69 -0.631 . . . . 0.0 109.742 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -71.41 -27.18 63.13 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.603 -0.686 . . . . 0.0 110.064 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -72.41 -35.1 68.3 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.598 -0.688 . . . . 0.0 110.22 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 -76.22 -35.07 59.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.69 -0.631 . . . . 0.0 109.792 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.55 HD11 HG22 ' A' ' 65' ' ' THR . 62.2 mt -75.2 -27.14 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.683 -0.636 . . . . 0.0 109.494 179.462 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.83 -34.55 62.35 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.58 -0.7 . . . . 0.0 109.887 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -71.41 -33.51 69.51 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.564 -0.71 . . . . 0.0 109.613 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.812 HD22 HG12 ' B' ' 190' ' ' ILE . 5.6 mt -66.92 -33.0 74.64 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.655 -0.653 . . . . 0.0 109.853 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -67.67 -36.85 81.47 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.613 -0.679 . . . . 0.0 109.878 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -71.21 -32.0 68.3 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.63 -0.669 . . . . 0.0 109.412 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -67.86 -36.05 79.61 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.701 -0.624 . . . . 0.0 109.825 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 21.4 tp -68.49 -30.09 68.85 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.644 -0.66 . . . . 0.0 109.844 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.5 mt -75.07 -38.84 61.17 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.643 -0.661 . . . . 0.0 109.771 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.75 -28.99 66.25 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.688 -0.633 . . . . 0.0 109.902 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.642 HD23 ' HA ' ' B' ' 183' ' ' ILE . 5.9 tp -72.88 -37.25 67.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.587 -0.696 . . . . 0.0 110.022 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -70.04 -30.65 67.98 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.558 -0.713 . . . . 0.0 109.689 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -28.42 67.46 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.738 -0.601 . . . . 0.0 109.839 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -45.04 80.3 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.641 -0.662 . . . . 0.0 109.778 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.05 -30.86 71.85 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.605 -0.684 . . . . 0.0 109.665 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -65.32 -30.93 71.82 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.723 -0.61 . . . . 0.0 109.823 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -65.27 -32.33 73.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.594 -0.691 . . . . 0.0 109.839 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.529 HD23 HD21 ' B' ' 172' ' ' LEU . 0.5 OUTLIER -66.28 -33.92 76.83 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.642 -0.661 . . . . 0.0 109.71 179.633 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -60.85 -34.8 75.14 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.642 -0.661 . . . . 0.0 109.862 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.7 mp -69.86 -29.38 66.6 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.732 -0.605 . . . . 0.0 109.775 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -95.09 -15.74 23.18 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.631 -0.668 . . . . 0.0 110.634 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.785 ' HA ' HD13 ' B' ' 172' ' ' LEU . 16.8 tp . . . . . 0 N--CA 1.501 2.094 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.746 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.371 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.568 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.6 OUTLIER -50.13 -52.17 37.32 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.581 -0.952 . . . . 0.0 111.746 -179.912 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 25.2 p -153.07 15.23 0.54 Allowed 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.119 -0.988 . . . . 0.0 111.532 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 27.3 tptt 49.78 26.19 1.81 Allowed 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.077 -1.014 . . . . 0.0 110.893 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -150.5 -47.56 0.12 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.674 -0.641 . . . . 0.0 109.739 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.401 ' HB2' ' CD1' ' B' ' 167' ' ' LEU . 1.9 mt-10 -74.54 -31.56 62.16 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.053 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.785 HD13 ' HA ' ' A' ' 90' ' ' LEU . 2.9 tt -76.47 -28.18 56.41 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.627 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.0 mm -68.49 -30.2 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.642 -0.661 . . . . 0.0 109.624 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -70.89 -29.43 65.51 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.67 -0.644 . . . . 0.0 109.984 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.755 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.8 m-20 -75.71 -29.66 59.04 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.674 -0.642 . . . . 0.0 110.065 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.47 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -75.53 -29.38 59.43 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.625 -0.672 . . . . 0.0 110.023 179.749 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.2 -31.29 58.38 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.617 -0.677 . . . . 0.0 110.05 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -28.51 58.67 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.67 -0.644 . . . . 0.0 110.001 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.755 HG23 ' O ' ' B' ' 175' ' ' ASN . 60.1 t -76.12 -31.94 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.62 -0.675 . . . . 0.0 109.723 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -73.54 -29.92 62.75 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.591 -0.693 . . . . 0.0 109.917 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.2 -29.77 63.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.724 -0.61 . . . . 0.0 109.894 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -72.72 -38.82 67.33 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.653 -0.655 . . . . 0.0 109.953 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.642 ' HA ' HD23 ' A' ' 79' ' ' LEU . 88.1 mt -66.74 -28.02 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.694 -0.629 . . . . 0.0 109.702 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.0 m -67.26 -35.78 80.24 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.601 -0.687 . . . . 0.0 109.889 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.8 ttt -72.13 -37.52 69.42 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.648 -0.658 . . . . 0.0 109.856 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 186' ' ' VAL . . . . . 0.408 HG21 ' CD2' ' A' ' 79' ' ' LEU . 59.3 t -73.0 -30.69 32.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.591 -0.693 . . . . 0.0 109.618 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -74.12 -28.62 61.44 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.726 -0.608 . . . . 0.0 110.077 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -74.13 -29.33 61.77 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.603 -0.686 . . . . 0.0 110.044 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -37.63 61.15 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.7 -0.625 . . . . 0.0 109.94 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.812 HG12 HD22 ' A' ' 72' ' ' LEU . 81.4 mt -72.51 -30.52 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.602 -0.686 . . . . 0.0 109.635 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 17.8 m -71.65 -34.94 70.18 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.631 -0.668 . . . . 0.0 109.604 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.6 mmtp -75.34 -37.77 60.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.644 -0.66 . . . . 0.0 109.383 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.59 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -71.6 -30.26 65.6 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.743 -0.598 . . . . 0.0 109.455 179.27 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 17.1 tptt -70.29 -41.03 73.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.699 -0.626 . . . . 0.0 109.622 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.9 mmtm -67.14 -31.28 71.6 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.631 -0.668 . . . . 0.0 109.33 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -63.75 -36.15 82.94 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.681 -0.637 . . . . 0.0 109.293 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -63.07 -30.23 71.43 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.773 -0.58 . . . . 0.0 109.58 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -60.99 -41.95 97.47 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.691 -0.631 . . . . 0.0 109.911 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -61.75 -49.52 76.06 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.664 -0.647 . . . . 0.0 109.895 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 19.5 tp -68.27 -29.86 68.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.621 -0.675 . . . . 0.0 109.685 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -76.93 -31.37 56.6 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 0.0 109.929 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -78.17 -34.1 49.84 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.729 -0.607 . . . . 0.0 109.709 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -77.17 -27.48 53.76 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.684 -0.635 . . . . 0.0 109.909 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -79.66 -25.32 41.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.538 -0.726 . . . . 0.0 110.305 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -86.13 -27.88 24.35 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.497 -0.752 . . . . 0.0 110.115 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 15.8 mmtp -61.77 149.48 84.93 Favored Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 121.598 -0.689 . . . . 0.0 110.111 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.318 -1.04 0 O-C-N 123.33 1.174 . . . . 0.0 110.403 179.985 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.092 0.472 . . . . 0.0 110.143 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.9 mttp -98.24 173.0 7.22 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.569 -0.707 . . . . 0.0 110.239 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -79.28 -28.88 42.3 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.565 -0.709 . . . . 0.0 110.148 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 21.5 mtt -82.84 -24.71 33.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.613 -0.679 . . . . 0.0 110.428 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -58.6 -27.82 65.02 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.452 -0.78 . . . . 0.0 110.434 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -75.1 -29.67 60.67 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.579 -0.7 . . . . 0.0 109.962 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 24.5 mtt85 -72.62 -28.46 62.78 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 110.031 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 10.3 mmm -70.89 -29.98 66.22 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.66 -0.65 . . . . 0.0 109.998 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.9 m -67.65 -30.38 69.92 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.618 -0.676 . . . . 0.0 109.918 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.613 HD11 ' HG2' ' B' ' 201' ' ' GLU . 0.4 OUTLIER -64.97 -28.44 69.51 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.727 -0.608 . . . . 0.0 110.041 179.733 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -64.28 -31.54 72.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.641 -0.662 . . . . 0.0 110.001 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -70.44 -47.75 59.22 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.598 -0.689 . . . . 0.0 109.92 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.9 m -66.49 -31.36 72.05 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.739 -0.601 . . . . 0.0 109.538 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.92 -27.23 65.58 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.672 -0.642 . . . . 0.0 109.896 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -66.54 -36.02 81.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.498 -0.751 . . . . 0.0 109.988 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.0 tp60 -76.39 -34.56 58.85 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.567 -0.708 . . . . 0.0 109.563 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.9 mt -73.26 -27.51 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.691 -0.63 . . . . 0.0 109.491 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.1 tp -71.77 -38.78 70.29 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.556 -0.715 . . . . 0.0 109.953 179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.3 mmtt -65.64 -35.44 80.79 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.543 -0.723 . . . . 0.0 109.728 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.813 HD22 HG12 ' B' ' 190' ' ' ILE . 3.2 mt -69.54 -27.96 65.61 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.72 -0.612 . . . . 0.0 109.809 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -69.91 -38.91 76.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.579 -0.701 . . . . 0.0 109.975 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -67.38 -41.38 85.11 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.681 -0.637 . . . . 0.0 109.62 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.7 tptt -64.32 -35.23 80.18 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.77 -0.581 . . . . 0.0 109.713 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.546 HD13 HD12 ' B' ' 190' ' ' ILE . 18.5 tp -73.49 -31.41 63.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.679 -0.638 . . . . 0.0 109.529 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 tp -70.51 -34.83 72.76 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.693 -0.629 . . . . 0.0 109.702 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.04 -30.78 62.58 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.721 -0.612 . . . . 0.0 109.68 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.847 HD12 ' CG1' ' B' ' 183' ' ' ILE . 0.2 OUTLIER -76.16 -37.76 57.53 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.649 -0.657 . . . . 0.0 109.643 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -71.96 -29.75 64.59 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.617 -0.677 . . . . 0.0 109.686 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.5 -29.68 66.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 109.72 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -68.48 -43.67 76.41 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.612 -0.68 . . . . 0.0 109.744 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -64.7 -29.93 70.93 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.555 -0.716 . . . . 0.0 109.647 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -64.33 -32.56 74.22 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.699 -0.625 . . . . 0.0 109.829 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -73.57 -35.33 65.43 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.672 -0.642 . . . . 0.0 109.715 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.401 ' CD2' ' CD2' ' B' ' 172' ' ' LEU . 3.2 mt -70.87 -33.32 70.5 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.69 -0.631 . . . . 0.0 109.685 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.469 ' HA ' ' HE1' ' B' ' 176' ' ' MET . 0.2 OUTLIER -68.27 -33.12 73.79 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.715 -0.616 . . . . 0.0 109.718 179.848 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 tp -79.16 -30.0 43.31 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.643 -0.661 . . . . 0.0 109.764 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -89.11 -8.7 53.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.626 -0.672 . . . . 0.0 110.848 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.643 HD13 ' HE3' ' B' ' 176' ' ' MET . 56.4 tp . . . . . 0 N--CA 1.5 2.026 0 O-C-N 121.093 -1.004 . . . . 0.0 110.46 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.307 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.712 HD13 ' HB2' ' B' ' 171' ' ' GLU . 0.3 OUTLIER -117.75 -31.16 5.23 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.684 -0.892 . . . . 0.0 110.32 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.71 ' H ' HD12 ' B' ' 167' ' ' LEU . 1.4 m -167.53 18.08 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.375 -0.828 . . . . 0.0 111.808 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 24.4 tptt 48.3 26.98 1.21 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.04 -1.038 . . . . 0.0 110.99 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.32 -47.24 0.11 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.774 -0.579 . . . . 0.0 109.695 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.712 ' HB2' HD13 ' B' ' 167' ' ' LEU . 0.5 OUTLIER -69.79 -37.02 76.18 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.259 179.499 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.602 ' N ' HD11 ' B' ' 167' ' ' LEU . 3.2 mt -74.2 -28.14 61.13 Favored 'General case' 0 N--CA 1.493 1.679 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.443 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.1 mm -68.25 -31.84 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.687 -0.633 . . . . 0.0 109.404 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -74.43 -31.35 62.25 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.757 -0.589 . . . . 0.0 109.955 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -75.06 -34.21 61.79 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.62 -0.675 . . . . 0.0 109.885 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.643 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -71.42 -27.23 63.15 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.611 -0.681 . . . . 0.0 109.75 179.475 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.05 -31.71 69.47 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.553 -0.717 . . . . 0.0 110.104 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.58 -29.32 46.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.607 -0.683 . . . . 0.0 109.952 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.443 ' O ' HD12 ' B' ' 183' ' ' ILE . 76.0 t -79.29 -25.8 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.639 -0.663 . . . . 0.0 109.53 179.285 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -78.16 -38.7 43.0 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.463 -0.773 . . . . 0.0 110.073 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 10.3 ptt85 -73.09 -24.8 60.7 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 119.868 -0.733 . . . . 0.0 110.158 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 182' ' ' GLU . . . . . 0.503 ' O ' HG23 ' B' ' 186' ' ' VAL . 2.4 tp10 -80.78 -37.02 31.02 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.511 -0.743 . . . . 0.0 109.87 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.847 ' CG1' HD12 ' A' ' 79' ' ' LEU . 76.0 mt -76.52 -27.32 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.611 -0.681 . . . . 0.0 109.556 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 72.2 m -76.62 -30.98 57.12 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.496 -0.752 . . . . 0.0 109.676 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.5 mtp -76.07 -39.32 55.68 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.619 -0.676 . . . . 0.0 109.666 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 186' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 182' ' ' GLU . 59.3 t -72.98 -29.9 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.628 -0.67 . . . . 0.0 109.499 179.378 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -72.75 -28.15 62.45 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.539 -0.726 . . . . 0.0 109.984 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -71.94 -34.48 69.07 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.635 -0.666 . . . . 0.0 109.985 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -40.67 64.04 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.622 -0.674 . . . . 0.0 109.684 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.813 HG12 HD22 ' A' ' 72' ' ' LEU . 84.2 mt -71.04 -30.54 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.654 -0.654 . . . . 0.0 109.477 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 50.9 m -69.26 -35.57 76.21 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.688 -0.633 . . . . 0.0 109.41 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.9 mmmt -76.53 -36.4 57.72 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.451 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -71.75 -30.01 65.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.683 -0.636 . . . . 0.0 109.531 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -69.24 -37.75 78.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.613 -0.679 . . . . 0.0 109.764 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.6 -31.23 71.13 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.562 -0.711 . . . . 0.0 109.467 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -64.13 -36.49 84.2 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.659 -0.65 . . . . 0.0 109.742 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -63.77 -30.59 71.67 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.667 -0.646 . . . . 0.0 109.867 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.39 -38.61 90.28 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.59 -0.693 . . . . 0.0 109.897 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -62.22 -41.47 98.42 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.715 -0.615 . . . . 0.0 109.9 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.462 HD23 ' HG ' ' A' ' 62' ' ' LEU . 5.5 tp -73.14 -32.37 64.85 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.587 -0.695 . . . . 0.0 109.687 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.613 ' HG2' HD11 ' A' ' 62' ' ' LEU . 24.6 mt-10 -77.78 -30.14 51.25 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.685 -0.635 . . . . 0.0 109.812 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -77.78 -28.31 50.47 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.626 -0.672 . . . . 0.0 109.8 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -77.23 -28.27 53.67 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.492 -0.755 . . . . 0.0 110.079 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.81 -28.44 44.5 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.561 -0.712 . . . . 0.0 110.176 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -99.22 -28.16 13.47 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.539 -0.725 . . . . 0.0 110.26 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp 52.83 92.07 0.06 OUTLIER Pre-proline 0 N--CA 1.5 2.066 0 O-C-N 121.419 -0.801 . . . . 0.0 110.736 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.317 -1.119 0 O-C-N 123.434 1.228 . . . . 0.0 110.348 -179.994 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.129 0.49 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.4 mttp -102.93 171.73 7.23 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.512 -0.742 . . . . 0.0 110.132 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -78.42 -28.97 46.88 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.536 -0.727 . . . . 0.0 110.164 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -83.72 -23.55 31.59 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.606 -0.684 . . . . 0.0 110.504 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -58.52 -31.42 67.89 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.493 -0.754 . . . . 0.0 110.361 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -71.61 -43.9 65.38 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.597 -0.69 . . . . 0.0 109.805 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -65.32 -28.15 69.1 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.73 -0.606 . . . . 0.0 109.808 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.3 mtt -68.6 -30.62 69.39 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.633 -0.667 . . . . 0.0 110.042 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.4 t -67.51 -29.77 69.27 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.649 -0.657 . . . . 0.0 109.989 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.751 HD11 ' HG2' ' B' ' 201' ' ' GLU . 0.6 OUTLIER -66.93 -29.96 69.97 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.632 -0.668 . . . . 0.0 109.982 179.643 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -64.18 -30.0 71.08 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.66 -0.65 . . . . 0.0 109.954 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -68.45 -51.41 43.91 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.615 -0.678 . . . . 0.0 109.866 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 79.7 m -63.45 -32.08 73.42 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.637 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.41 -29.09 68.5 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.647 -0.658 . . . . 0.0 109.76 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.7 -36.7 84.72 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.66 -0.65 . . . . 0.0 109.956 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 36.6 tp60 -73.46 -35.75 65.76 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.652 -0.655 . . . . 0.0 109.708 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.5 mt -71.0 -28.31 32.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.656 -0.653 . . . . 0.0 109.553 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.418 HD23 ' C ' ' A' ' 70' ' ' LEU . 9.8 tt -68.71 -37.5 79.54 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.492 -0.755 . . . . 0.0 109.806 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -65.01 -37.96 89.35 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.66 -0.65 . . . . 0.0 109.701 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.627 HD22 HG12 ' B' ' 190' ' ' ILE . 12.3 mt -62.37 -29.55 70.55 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.689 -0.632 . . . . 0.0 109.939 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 tm-20 -63.3 -42.84 99.09 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.537 -0.727 . . . . 0.0 109.945 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.19 -34.48 74.97 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.671 -0.643 . . . . 0.0 109.559 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.01 -36.9 69.84 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.733 -0.605 . . . . 0.0 109.595 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.8 tp -75.11 -31.36 61.11 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.626 -0.671 . . . . 0.0 109.582 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tt -76.06 -32.2 59.16 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.738 -0.601 . . . . 0.0 109.604 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.411 ' HA ' ' HG2' ' A' ' 81' ' ' GLU . . . -73.26 -27.09 61.37 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.1 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.48 -27.07 41.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.46 -0.775 . . . . 0.0 109.813 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -76.34 -36.58 58.16 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.582 -0.699 . . . . 0.0 109.976 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.411 ' HG2' ' HA ' ' A' ' 78' ' ' ALA . 7.6 pt-20 -68.76 -24.62 64.46 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 119.889 -0.724 . . . . 0.0 109.822 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.05 -41.8 81.5 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.495 -0.753 . . . . 0.0 109.478 179.407 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.4 ttpm? -68.29 -31.05 70.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.593 -0.692 . . . . 0.0 109.435 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -65.5 -30.08 70.81 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.687 -0.633 . . . . 0.0 109.734 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -61.79 -34.72 76.41 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.63 -0.669 . . . . 0.0 109.726 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.866 HD23 HD21 ' B' ' 172' ' ' LEU . 0.8 OUTLIER -70.66 -30.31 66.88 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.635 -0.665 . . . . 0.0 109.81 179.571 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -69.79 -30.51 68.07 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.602 -0.686 . . . . 0.0 110.019 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.4 tp -67.5 -31.61 71.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.576 -0.703 . . . . 0.0 109.888 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -117.38 29.84 7.64 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.648 -0.657 . . . . 0.0 109.987 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.612 ' CD2' HD11 ' B' ' 173' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.498 1.945 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.305 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.369 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.784 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.0 OUTLIER -141.35 -82.6 0.22 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.556 -0.967 . . . . 0.0 110.453 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 8.4 t -129.48 20.74 5.64 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.946 . . . . 0.0 110.848 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 169' ' ' LYS . . . . . 0.459 ' C ' HD13 ' B' ' 173' ' ' ILE . 13.8 tptm 50.76 25.94 2.33 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.238 -0.914 . . . . 0.0 110.729 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -150.99 -45.58 0.12 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.694 -0.628 . . . . 0.0 109.724 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.617 ' HB2' HD12 ' B' ' 167' ' ' LEU . 1.4 mt-10 -67.7 -31.12 70.86 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 120.003 -0.679 . . . . 0.0 109.621 179.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.866 HD21 HD23 ' A' ' 86' ' ' LEU . 2.8 tt -80.94 -30.57 35.22 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.622 -0.674 . . . . 0.0 109.341 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.619 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.0 mp -72.53 -31.29 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -64.7 -32.62 74.38 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.524 ' O ' HG23 ' B' ' 179' ' ' VAL . 76.8 m-20 -74.16 -32.76 63.25 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -65.23 -29.46 70.26 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.785 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -72.12 -31.94 66.48 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.566 -0.709 . . . . 0.0 110.021 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.03 -30.17 58.36 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.617 -0.677 . . . . 0.0 109.838 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.524 HG23 ' O ' ' B' ' 175' ' ' ASN . 66.2 t -74.54 -29.57 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.673 -0.642 . . . . 0.0 109.689 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -72.64 -28.67 62.88 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.591 -0.693 . . . . 0.0 110.049 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -71.92 -29.52 64.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.591 -0.693 . . . . 0.0 110.02 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -72.85 -38.87 66.93 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.542 -0.724 . . . . 0.0 110.044 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 80.8 mt -68.53 -29.03 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 C-N-CA 120.172 -0.611 . . . . 0.0 109.678 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 24.6 m -68.72 -32.88 72.98 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.689 -0.632 . . . . 0.0 109.849 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.92 -47.81 60.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.556 -0.715 . . . . 0.0 109.724 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 65.6 t -70.42 -31.95 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.62 -0.675 . . . . 0.0 109.402 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -74.81 -28.89 60.9 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.771 -0.581 . . . . 0.0 109.715 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -72.59 -29.94 63.95 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.612 -0.68 . . . . 0.0 109.956 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -72.26 -34.72 68.45 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.639 -0.663 . . . . 0.0 109.841 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.627 HG12 HD22 ' A' ' 72' ' ' LEU . 80.5 mt -70.63 -31.3 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.666 -0.646 . . . . 0.0 109.511 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 4.8 m -67.31 -40.17 86.0 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.629 -0.67 . . . . 0.0 109.524 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -72.3 -34.37 68.08 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.678 -0.639 . . . . 0.0 109.337 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.543 HD23 ' HE2' ' B' ' 196' ' ' LYS . 0.3 OUTLIER -78.01 -10.97 59.85 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.682 -0.636 . . . . 0.0 110.558 179.423 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 18.4 tptt -91.72 -28.7 17.26 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.245 -0.91 . . . . 0.0 109.227 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.0 tptm -75.61 -32.68 60.38 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.702 -0.624 . . . . 0.0 109.733 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.543 ' HE2' HD23 ' B' ' 193' ' ' LEU . 0.0 OUTLIER -67.23 -28.58 68.18 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.493 179.335 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -69.27 -29.45 67.35 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.653 -0.654 . . . . 0.0 109.47 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -61.22 -41.72 97.35 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.641 -0.662 . . . . 0.0 109.789 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -62.37 -37.83 87.22 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.727 -0.608 . . . . 0.0 109.641 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.486 HD23 ' HG ' ' A' ' 62' ' ' LEU . 7.2 tp -75.08 -30.67 61.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.683 -0.636 . . . . 0.0 109.527 179.298 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.751 ' HG2' HD11 ' A' ' 62' ' ' LEU . 1.8 tm-20 -76.38 -32.13 58.4 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.708 -0.62 . . . . 0.0 109.688 179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -75.22 -31.57 60.9 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.638 -0.664 . . . . 0.0 109.746 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -71.46 -30.31 65.87 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.65 -0.656 . . . . 0.0 109.81 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -67.07 -27.94 67.78 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.657 -0.652 . . . . 0.0 109.921 179.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -116.76 30.41 7.35 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.518 -0.739 . . . . 0.0 110.184 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.43 98.46 10.75 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.558 -0.714 . . . . 0.0 110.156 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo . . . . . 0 C--N 1.318 -1.056 0 O-C-N 123.329 1.173 . . . . 0.0 110.368 179.993 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.055 0.455 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.2 mttp -163.41 160.37 23.38 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.569 -0.707 . . . . 0.0 110.227 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -81.8 -28.42 33.17 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.599 -0.688 . . . . 0.0 110.25 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.6 ttt -80.96 -27.79 35.91 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.542 -0.724 . . . . 0.0 110.29 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.74 -28.14 68.46 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.523 -0.736 . . . . 0.0 110.232 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.2 -28.63 67.43 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.564 -0.71 . . . . 0.0 110.186 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.2 mtp85 -75.07 -30.16 60.9 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.535 -0.728 . . . . 0.0 110.002 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.3 mtt -72.67 -29.99 63.88 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.64 -0.662 . . . . 0.0 109.919 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.6 m -69.3 -28.5 66.32 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.619 -0.676 . . . . 0.0 109.936 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.55 ' HG ' HD23 ' B' ' 200' ' ' LEU . 0.8 OUTLIER -68.02 -28.51 67.47 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.582 -0.699 . . . . 0.0 110.163 179.878 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -70.4 -36.1 73.84 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.619 -0.676 . . . . 0.0 110.157 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -74.7 -34.58 62.64 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.63 -0.669 . . . . 0.0 109.773 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.412 HG22 HD11 ' A' ' 69' ' ' ILE . 88.2 m -74.55 -30.55 61.79 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.705 -0.622 . . . . 0.0 109.665 179.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.13 -27.19 62.46 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.669 -0.645 . . . . 0.0 110.012 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -72.1 -36.23 69.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.483 -0.76 . . . . 0.0 110.187 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -72.32 -39.81 67.93 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.641 -0.662 . . . . 0.0 109.717 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.863 HG12 HD23 ' B' ' 193' ' ' LEU . 46.3 mt -66.74 -27.64 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.45 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.49 -41.44 96.46 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.623 -0.673 . . . . 0.0 109.484 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -69.96 -29.62 66.78 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.587 -0.695 . . . . 0.0 109.633 179.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.852 HD12 HD22 ' B' ' 193' ' ' LEU . 3.6 mt -71.11 -28.38 64.27 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.726 -0.609 . . . . 0.0 109.917 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -75.84 -34.49 60.09 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.595 -0.691 . . . . 0.0 109.929 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -31.73 68.7 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 120.182 -0.607 . . . . 0.0 109.543 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -64.58 -33.42 75.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.733 -0.604 . . . . 0.0 109.743 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 20.2 tp -72.07 -28.77 63.54 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.637 -0.665 . . . . 0.0 109.953 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 mt -75.04 -34.89 61.93 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.667 -0.646 . . . . 0.0 109.924 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.48 -31.54 65.47 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.583 -0.698 . . . . 0.0 109.949 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.743 HD23 ' HA ' ' B' ' 183' ' ' ILE . 6.5 tp -75.06 -37.25 61.71 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.711 -0.618 . . . . 0.0 109.812 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -72.26 -30.42 64.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.601 -0.687 . . . . 0.0 109.563 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -69.18 -29.2 67.14 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.208 -0.597 . . . . 0.0 109.795 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.44 -45.13 76.94 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.549 -0.719 . . . . 0.0 109.826 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.4 tttm -62.92 -29.49 70.82 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.495 -0.753 . . . . 0.0 109.563 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -62.57 -32.87 73.92 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.675 -0.641 . . . . 0.0 109.784 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -65.88 -30.8 71.46 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.682 -0.636 . . . . 0.0 109.722 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.2 OUTLIER -67.62 -33.09 74.29 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.607 -0.683 . . . . 0.0 109.65 179.695 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -61.81 -35.69 78.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.541 -0.724 . . . . 0.0 109.89 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.7 mp -74.0 -30.29 62.4 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.735 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -85.04 -21.89 29.23 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.741 -0.599 . . . . 0.0 110.414 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.653 ' HA ' HD23 ' B' ' 172' ' ' LEU . 56.2 tp . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.574 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.33 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.937 HD21 HD13 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -141.32 -83.5 0.21 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.572 -0.958 . . . . 0.0 110.654 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.2 m -128.79 19.62 6.08 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.148 -0.97 . . . . 0.0 110.994 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.3 tptt 50.71 25.81 2.25 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.228 -0.92 . . . . 0.0 110.539 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -147.95 -46.38 0.16 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.714 -0.616 . . . . 0.0 109.394 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.575 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.0 mm-40 -68.69 -32.93 73.1 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 119.9 -0.72 . . . . 0.0 109.276 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.937 HD13 HD21 ' B' ' 167' ' ' LEU . 13.8 tp -77.5 -29.17 52.41 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 49.3 mm -65.92 -31.6 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.669 -0.644 . . . . 0.0 109.322 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -71.28 -29.65 65.31 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.753 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.793 ' O ' HG23 ' B' ' 179' ' ' VAL . 13.3 m120 -72.07 -42.35 66.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.636 -0.665 . . . . 0.0 109.772 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.57 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -65.82 -33.99 77.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.684 -0.635 . . . . 0.0 109.651 179.736 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.34 -30.22 57.55 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.643 -0.661 . . . . 0.0 109.807 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -77.19 -30.0 54.59 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.668 -0.645 . . . . 0.0 109.865 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.793 HG23 ' O ' ' B' ' 175' ' ' ASN . 72.2 t -75.83 -30.03 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.587 -0.696 . . . . 0.0 109.592 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -74.08 -29.7 61.99 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.681 -0.637 . . . . 0.0 109.966 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -73.55 -29.43 62.44 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.65 -0.656 . . . . 0.0 109.957 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -73.28 -38.06 66.05 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.568 -0.708 . . . . 0.0 109.949 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.743 ' HA ' HD23 ' A' ' 79' ' ' LEU . 90.2 mt -67.39 -30.0 47.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.633 -0.667 . . . . 0.0 109.634 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.3 m -66.07 -35.69 81.19 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.597 -0.689 . . . . 0.0 109.743 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -50.34 58.24 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.648 -0.658 . . . . 0.0 109.643 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.6 t -63.85 -31.9 54.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.601 -0.687 . . . . 0.0 109.314 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -65.52 -34.85 79.24 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.7 -0.625 . . . . 0.0 109.947 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -63.89 -29.98 71.11 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.642 -0.661 . . . . 0.0 109.824 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.15 -27.68 61.8 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.669 -0.644 . . . . 0.0 109.969 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.713 HD13 HD22 ' A' ' 72' ' ' LEU . 45.0 mm -75.72 -41.99 40.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.606 -0.684 . . . . 0.0 109.525 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 51.8 m -68.66 -29.19 67.61 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.704 -0.622 . . . . 0.0 109.699 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 54.0 mmtt -74.27 -42.81 59.0 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.615 -0.678 . . . . 0.0 109.807 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.863 HD23 HG12 ' A' ' 69' ' ' ILE . 0.0 OUTLIER -72.15 -31.09 65.65 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.471 -0.768 . . . . 0.0 109.283 179.351 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -70.26 -37.76 74.98 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.662 -0.649 . . . . 0.0 109.392 179.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.3 mmtt -70.08 -31.52 69.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.592 -0.692 . . . . 0.0 109.319 179.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -65.01 -34.24 77.97 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -64.41 -30.25 71.3 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.661 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.83 -43.16 99.41 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.703 -0.623 . . . . 0.0 109.804 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -62.59 -40.15 95.98 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.75 -0.594 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.55 HD23 ' HG ' ' A' ' 62' ' ' LEU . 5.4 tp -73.23 -32.39 64.72 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.69 -0.631 . . . . 0.0 109.687 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -77.35 -30.78 54.02 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.555 -0.716 . . . . 0.0 109.836 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -77.11 -29.13 54.66 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.723 -0.611 . . . . 0.0 109.875 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -76.54 -28.94 56.52 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.578 -0.701 . . . . 0.0 109.977 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -75.54 -28.9 59.24 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.657 -0.652 . . . . 0.0 110.057 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -123.38 28.42 7.06 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.561 -0.712 . . . . 0.0 110.176 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.0 143.61 91.75 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.562 -0.711 . . . . 0.0 110.122 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo . . . . . 0 C--N 1.318 -1.05 0 O-C-N 123.278 1.146 . . . . 0.0 110.423 179.994 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.2 mttm . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.089 0.471 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -91.46 157.04 17.28 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.514 -0.741 . . . . 0.0 110.172 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -169.56 -39.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.556 -0.715 . . . . 0.0 110.527 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 8.5 mtp -70.8 -28.64 64.79 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.562 -0.711 . . . . 0.0 110.278 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.77 -29.66 56.18 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.587 -0.695 . . . . 0.0 110.108 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -76.61 -29.67 56.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.614 -0.679 . . . . 0.0 109.97 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.3 -28.14 59.59 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.619 -0.675 . . . . 0.0 110.019 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 19.4 mmm -74.49 -29.58 61.48 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.594 -0.691 . . . . 0.0 110.04 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 41.3 t -72.68 -28.1 62.49 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.572 -0.705 . . . . 0.0 110.094 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.565 HD22 ' CD2' ' B' ' 200' ' ' LEU . 0.2 OUTLIER -72.51 -27.79 62.47 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.552 -0.718 . . . . 0.0 110.065 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -72.7 -34.67 67.3 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.586 -0.696 . . . . 0.0 110.232 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -75.04 -33.37 61.73 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.671 -0.643 . . . . 0.0 109.9 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.8 m -75.31 -30.37 60.33 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.633 -0.667 . . . . 0.0 109.631 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -73.04 -26.58 61.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.686 -0.634 . . . . 0.0 110.057 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -72.8 -32.48 65.58 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.528 -0.732 . . . . 0.0 110.179 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -76.05 -36.38 59.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.659 -0.65 . . . . 0.0 109.691 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.9 mt -70.67 -27.66 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.682 -0.636 . . . . 0.0 109.63 179.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.1 tt -68.43 -36.81 79.59 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.513 -0.742 . . . . 0.0 109.821 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -69.77 -30.09 67.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.64 -0.663 . . . . 0.0 109.843 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.782 HD22 HG12 ' B' ' 190' ' ' ILE . 9.2 mt -70.0 -28.57 65.62 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.702 -0.624 . . . . 0.0 110.028 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.517 ' O ' HD13 ' A' ' 77' ' ' LEU . 6.6 mt-10 -72.35 -32.1 66.19 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.596 -0.69 . . . . 0.0 110.03 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.43 -30.9 60.17 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.604 -0.685 . . . . 0.0 109.78 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.78 -32.5 62.06 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.71 -0.619 . . . . 0.0 109.785 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.717 HD13 ' O ' ' A' ' 76' ' ' LEU . 0.5 OUTLIER -74.94 -31.01 61.4 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.576 -0.702 . . . . 0.0 109.654 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.517 HD13 ' O ' ' A' ' 73' ' ' GLU . 1.1 mp -74.64 -35.29 62.88 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.625 -0.672 . . . . 0.0 109.812 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.37 -30.61 64.86 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.651 -0.655 . . . . 0.0 109.77 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.641 HD23 ' HA ' ' B' ' 183' ' ' ILE . 5.9 tp -73.66 -37.9 65.12 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.642 -0.661 . . . . 0.0 109.817 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 15.6 tp60 -70.46 -30.95 67.91 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.63 -0.668 . . . . 0.0 109.625 179.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.11 -30.13 69.22 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.62 -0.675 . . . . 0.0 109.742 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -66.01 -46.53 77.61 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.664 -0.647 . . . . 0.0 109.698 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.3 tttt -64.0 -28.98 70.17 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.502 -0.749 . . . . 0.0 109.443 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -63.83 -31.38 72.54 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.671 -0.643 . . . . 0.0 109.932 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -65.28 -31.25 72.3 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.508 -0.745 . . . . 0.0 109.704 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' B' ' 176' ' ' MET . 0.6 OUTLIER -68.24 -32.84 73.32 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.674 -0.641 . . . . 0.0 109.588 179.679 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -61.65 -35.18 77.21 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.638 -0.664 . . . . 0.0 109.898 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.3 tp -63.45 -29.63 70.88 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.587 -0.695 . . . . 0.0 109.768 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -94.97 -23.46 17.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.666 -0.646 . . . . 0.0 110.379 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.625 HD11 HD11 ' B' ' 173' ' ' ILE . 56.6 tp . . . . . 0 N--CA 1.502 2.147 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.74 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 166' ' ' GLY . . . . . 0.504 ' HA2' HD12 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.82 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.5 OUTLIER -109.46 -61.98 1.56 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.677 -0.896 . . . . 0.0 109.2 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 52.1 m -153.53 37.09 0.46 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.322 0.582 . . . . 0.0 109.498 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 169' ' ' LYS . . . . . 0.495 ' C ' HD13 ' B' ' 173' ' ' ILE . 28.0 tptt 52.44 26.62 4.31 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.606 -0.684 . . . . 0.0 110.346 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -153.72 -43.7 0.09 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.619 -0.675 . . . . 0.0 110.397 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.685 ' HB3' HD13 ' B' ' 167' ' ' LEU . 1.0 OUTLIER -61.77 -29.59 70.23 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.82 ' HG ' HD11 ' B' ' 167' ' ' LEU . 0.6 OUTLIER -85.53 -28.98 24.56 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.933 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.625 HD11 HD11 ' A' ' 90' ' ' LEU . 2.7 mp -76.83 -30.97 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -66.0 -34.6 78.48 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -78.0 -32.57 51.25 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 178.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.466 ' O ' HG12 ' B' ' 179' ' ' VAL . 0.0 OUTLIER -69.31 -29.98 67.94 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 120.184 -0.606 . . . . 0.0 109.526 179.341 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -74.12 -27.48 60.89 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.598 -0.689 . . . . 0.0 110.006 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.2 -41.07 58.6 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.549 -0.719 . . . . 0.0 109.967 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.466 HG12 ' O ' ' B' ' 176' ' ' MET . 10.5 p -70.33 -26.96 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.606 -0.684 . . . . 0.0 109.999 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -76.04 -29.08 57.93 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.519 -0.738 . . . . 0.0 109.961 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 5.6 mtp-105 -73.42 -29.35 62.52 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.653 -0.654 . . . . 0.0 110.05 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -72.56 -36.97 68.35 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.573 -0.704 . . . . 0.0 109.9 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.641 ' HA ' HD23 ' A' ' 79' ' ' LEU . 88.3 mt -66.38 -28.63 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.652 -0.655 . . . . 0.0 109.664 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.4 m -65.43 -30.95 71.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.598 -0.689 . . . . 0.0 109.677 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -42.97 61.22 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.783 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.5 t -71.78 -31.23 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.645 -0.659 . . . . 0.0 109.46 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.9 -29.06 60.88 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.648 -0.658 . . . . 0.0 109.836 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -72.87 -29.64 63.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.707 -0.62 . . . . 0.0 109.999 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -73.26 -36.45 66.36 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.597 -0.689 . . . . 0.0 109.842 179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.782 HG12 HD22 ' A' ' 72' ' ' LEU . 78.0 mt -71.49 -31.35 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.674 -0.641 . . . . 0.0 109.584 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 44.8 m -69.95 -37.62 75.88 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.682 -0.636 . . . . 0.0 109.65 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -71.59 -37.42 71.0 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.614 -0.679 . . . . 0.0 109.495 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.575 HD13 HD11 ' A' ' 72' ' ' LEU . 0.3 OUTLIER -75.38 -11.85 60.13 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.731 -0.606 . . . . 0.0 110.601 179.53 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.55 -28.56 19.52 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.17 -0.956 . . . . 0.0 109.41 179.264 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -32.19 55.68 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.665 -0.647 . . . . 0.0 109.89 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.481 ' HE3' HD23 ' B' ' 193' ' ' LEU . 0.0 OUTLIER -71.96 -28.25 63.32 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.49 -0.756 . . . . 0.0 109.652 179.483 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 197' ' ' GLN . . . . . 0.506 ' OE1' HD11 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -68.13 -30.54 69.71 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.642 -0.661 . . . . 0.0 109.657 179.525 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -62.65 -44.17 96.95 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.757 -0.589 . . . . 0.0 109.951 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -61.36 -40.63 95.0 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.045 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.565 ' CD2' HD22 ' A' ' 62' ' ' LEU . 29.1 tp -70.38 -40.98 73.65 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.607 -0.683 . . . . 0.0 109.746 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.15 -29.86 62.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.653 -0.654 . . . . 0.0 109.637 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -78.99 -29.31 43.71 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.674 -0.641 . . . . 0.0 109.768 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -77.59 -27.88 51.44 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.523 -0.736 . . . . 0.0 109.993 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.19 -28.33 48.09 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.558 -0.714 . . . . 0.0 110.169 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.69 -31.61 24.02 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.586 -0.696 . . . . 0.0 110.138 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt 51.9 93.96 0.05 OUTLIER Pre-proline 0 N--CA 1.501 2.094 0 O-C-N 121.45 -0.781 . . . . 0.0 110.848 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.317 -1.085 0 O-C-N 123.459 1.242 . . . . 0.0 110.399 179.936 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 19.1 ttmt . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.059 0.457 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.0 mttm -112.36 178.26 4.36 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.645 -0.66 . . . . 0.0 110.209 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -84.87 -28.89 25.7 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.571 -0.705 . . . . 0.0 110.185 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 32.3 mtt -67.01 -29.02 68.73 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.625 -0.672 . . . . 0.0 110.132 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -71.27 -28.28 64.03 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.484 -0.76 . . . . 0.0 110.189 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -71.24 -28.52 64.24 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.563 -0.711 . . . . 0.0 110.238 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 35.4 mtt180 -73.51 -41.13 63.45 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.672 -0.642 . . . . 0.0 110.029 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.9 mtt -70.28 -30.88 68.0 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.703 -0.623 . . . . 0.0 109.771 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.75 -28.72 64.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.724 -0.61 . . . . 0.0 109.807 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.656 HD11 ' CG ' ' B' ' 201' ' ' GLU . 1.2 tt -67.88 -29.13 68.17 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.644 -0.66 . . . . 0.0 110.03 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -70.4 -36.03 73.82 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.608 -0.683 . . . . 0.0 109.981 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.53 -30.67 61.86 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.618 -0.676 . . . . 0.0 109.788 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 83.4 m -73.71 -30.62 62.95 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.655 -0.653 . . . . 0.0 109.587 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -69.81 -28.88 66.09 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.604 -0.685 . . . . 0.0 110.06 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -70.89 -33.22 70.36 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.57 -0.706 . . . . 0.0 110.155 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -72.43 -34.87 68.13 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.674 -0.641 . . . . 0.0 109.941 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.3 mt -68.43 -27.58 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.664 -0.647 . . . . 0.0 109.787 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.471 ' O ' HD23 ' A' ' 70' ' ' LEU . 4.8 tt -69.88 -44.31 70.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.553 -0.717 . . . . 0.0 109.783 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -65.11 -30.9 71.88 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.598 -0.689 . . . . 0.0 109.668 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.842 ' CD1' HD13 ' B' ' 193' ' ' LEU . 1.6 mt -66.54 -29.42 69.49 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.634 -0.666 . . . . 0.0 109.978 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -68.46 -45.8 71.49 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.604 -0.685 . . . . 0.0 110.029 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -63.93 -31.08 72.14 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.662 -0.649 . . . . 0.0 109.593 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.1 tttm -64.37 -35.19 80.07 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.635 -0.665 . . . . 0.0 109.913 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.9 tp -66.18 -33.75 76.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.626 -0.671 . . . . 0.0 109.824 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 mt -73.09 -37.9 66.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.728 -0.607 . . . . 0.0 109.552 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.33 -28.44 68.67 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.701 -0.624 . . . . 0.0 109.884 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.803 HD12 HG12 ' B' ' 183' ' ' ILE . 0.2 OUTLIER -69.07 -43.57 74.31 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.651 -0.655 . . . . 0.0 109.883 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -66.17 -32.81 74.46 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.62 -0.675 . . . . 0.0 109.713 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.9 -28.55 69.03 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.747 -0.596 . . . . 0.0 109.755 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.5 -44.39 94.47 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.664 -0.647 . . . . 0.0 109.735 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -65.81 -29.91 70.46 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.602 -0.686 . . . . 0.0 109.752 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -67.95 -34.17 76.06 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.578 -0.701 . . . . 0.0 109.903 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -68.9 -46.59 67.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.648 -0.658 . . . . 0.0 109.705 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.599 HD22 ' CG ' ' B' ' 176' ' ' MET . 0.2 OUTLIER -62.11 -29.58 70.43 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.658 -0.651 . . . . 0.0 109.832 179.528 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.405 ' HA ' ' HE1' ' B' ' 176' ' ' MET . 0.4 OUTLIER -66.16 -34.15 77.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.62 -0.675 . . . . 0.0 109.822 179.856 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.73 -30.4 71.5 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.6 -0.688 . . . . 0.0 109.858 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -85.26 -17.66 36.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.676 -0.64 . . . . 0.0 110.673 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.698 HD11 HD11 ' B' ' 173' ' ' ILE . 49.4 tp . . . . . 0 N--CA 1.5 2.058 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.743 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.775 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.5 OUTLIER -108.15 -61.71 1.55 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.541 -0.976 . . . . 0.0 109.165 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 88.5 p -154.5 37.3 0.42 Allowed 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 169' ' ' LYS . . . . . 0.477 ' C ' HD13 ' B' ' 173' ' ' ILE . 36.7 tptt 52.15 26.31 3.81 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.548 -0.72 . . . . 0.0 110.363 -179.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -152.86 -43.9 0.1 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.616 -0.678 . . . . 0.0 110.291 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.699 ' HB3' HD22 ' B' ' 167' ' ' LEU . 1.2 tt0 -61.85 -29.24 70.05 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 119.753 -0.779 . . . . 0.0 109.666 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.775 ' HG ' HD11 ' B' ' 167' ' ' LEU . 0.6 OUTLIER -85.21 -29.09 24.97 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.603 -0.685 . . . . 0.0 109.168 178.979 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.698 HD11 HD11 ' A' ' 90' ' ' LEU . 2.9 mp -78.38 -31.7 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.307 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -67.58 -33.88 75.91 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.784 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.3 m-20 -78.89 -32.32 45.77 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.599 ' CG ' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -71.78 -30.02 65.1 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.734 -0.604 . . . . 0.0 109.638 179.291 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.27 -33.49 61.27 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.57 -0.707 . . . . 0.0 109.827 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -71.67 -29.03 64.16 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.651 -0.656 . . . . 0.0 109.895 179.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.784 HG23 ' O ' ' B' ' 175' ' ' ASN . 64.6 t -69.51 -32.7 53.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.616 -0.677 . . . . 0.0 109.612 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -63.73 -37.26 86.71 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.666 -0.646 . . . . 0.0 109.81 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 5.7 mtp-105 -69.94 -29.4 66.54 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.748 -0.595 . . . . 0.0 109.722 179.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 182' ' ' GLU . . . . . 0.534 ' O ' HG23 ' B' ' 186' ' ' VAL . 5.7 tt0 -69.85 -32.35 70.7 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.676 -0.64 . . . . 0.0 109.869 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.803 HG12 HD12 ' A' ' 79' ' ' LEU . 86.6 mt -72.4 -33.17 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.676 -0.64 . . . . 0.0 109.616 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 58.9 m -71.96 -33.23 68.02 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.692 -0.63 . . . . 0.0 109.649 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.74 -41.46 71.78 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.644 -0.66 . . . . 0.0 109.602 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 186' ' ' VAL . . . . . 0.534 HG23 ' O ' ' B' ' 182' ' ' GLU . 63.2 t -68.28 -37.76 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 119.995 -0.682 . . . . 0.0 109.246 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.4 -33.57 75.83 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.805 -0.559 . . . . 0.0 109.893 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -66.75 -29.91 70.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.648 -0.658 . . . . 0.0 109.858 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -72.91 -21.55 60.88 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.594 -0.691 . . . . 0.0 110.371 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.774 HD13 HD22 ' A' ' 72' ' ' LEU . 35.3 mm -79.55 -39.04 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.413 -0.804 . . . . 0.0 109.603 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.27 -30.2 64.61 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.623 -0.673 . . . . 0.0 109.734 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 13.8 mmtm -75.28 -36.15 61.23 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.692 -0.63 . . . . 0.0 109.85 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.842 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -74.08 -21.47 59.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.579 -0.7 . . . . 0.0 110.242 179.696 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.6 tptt -80.45 -28.59 37.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 109.575 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 14.9 tptt -74.26 -40.05 62.6 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.638 -0.664 . . . . 0.0 109.76 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.529 ' HE3' HD23 ' B' ' 193' ' ' LEU . 2.6 pttp -64.64 -26.11 68.25 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.532 -0.73 . . . . 0.0 109.639 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -69.81 -30.64 68.21 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.513 -0.742 . . . . 0.0 109.569 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -43.59 98.48 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.684 -0.635 . . . . 0.0 109.764 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -61.71 -31.18 71.32 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.777 -0.577 . . . . 0.0 109.66 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.57 HD23 ' HG ' ' A' ' 62' ' ' LEU . 3.9 tp -77.41 -38.16 50.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.69 -0.631 . . . . 0.0 109.534 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.656 ' CG ' HD11 ' A' ' 62' ' ' LEU . 28.6 mt-10 -76.43 -30.77 57.54 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.687 -0.633 . . . . 0.0 109.598 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -78.88 -29.16 44.25 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.705 -0.622 . . . . 0.0 109.723 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -78.14 -28.28 48.39 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.593 -0.692 . . . . 0.0 109.928 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.99 -28.29 43.43 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.589 -0.694 . . . . 0.0 110.196 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -88.68 -29.13 20.12 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.586 -0.696 . . . . 0.0 110.179 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 4.2 mmtp -60.74 111.32 3.91 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.549 -0.719 . . . . 0.0 110.149 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 O-C-N 123.094 1.05 . . . . 0.0 110.4 179.954 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.7 mttt . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.103 0.478 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.9 pttt -136.77 172.17 13.41 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.579 -0.701 . . . . 0.0 110.355 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -84.03 -28.98 27.27 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.57 -0.706 . . . . 0.0 110.271 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.0 mtm -59.88 -24.51 64.33 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.576 -0.702 . . . . 0.0 110.462 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -71.55 -29.74 65.09 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.53 -0.731 . . . . 0.0 110.123 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -71.96 -27.71 62.96 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.664 -0.647 . . . . 0.0 110.097 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -71.39 -29.08 64.51 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.506 -0.746 . . . . 0.0 110.116 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.8 mtm -69.1 -35.6 76.63 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.641 -0.662 . . . . 0.0 110.049 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.9 m -68.58 -29.1 67.56 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.657 -0.652 . . . . 0.0 109.835 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.587 HD11 ' CG ' ' B' ' 201' ' ' GLU . 5.1 tt -67.11 -29.45 69.2 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.651 -0.656 . . . . 0.0 109.911 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -63.95 -42.77 97.2 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.686 -0.634 . . . . 0.0 109.986 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -72.02 -30.77 65.54 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.72 -0.612 . . . . 0.0 109.636 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 66.7 m -73.59 -28.43 61.83 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.793 -0.567 . . . . 0.0 109.793 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.4 mmtp -72.06 -26.47 62.19 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.489 -0.757 . . . . 0.0 110.382 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -74.94 -31.85 61.6 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.542 -0.724 . . . . 0.0 110.433 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -76.23 -34.4 59.22 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.63 -0.669 . . . . 0.0 109.785 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.768 HG12 HD22 ' B' ' 193' ' ' LEU . 69.3 mt -71.5 -26.13 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.653 -0.655 . . . . 0.0 109.679 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.402 ' O ' HD23 ' A' ' 70' ' ' LEU . 1.6 tt -71.12 -40.77 71.25 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.477 -0.765 . . . . 0.0 109.929 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.5 tppt? -62.62 -31.07 71.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.557 -0.715 . . . . 0.0 109.69 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.8 HD22 HG12 ' B' ' 190' ' ' ILE . 11.3 mt -62.67 -29.6 70.77 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.714 -0.616 . . . . 0.0 109.915 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -66.58 -39.28 88.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.625 -0.672 . . . . 0.0 109.847 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.03 -30.23 63.59 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.654 -0.654 . . . . 0.0 109.53 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -29.72 63.98 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.678 -0.639 . . . . 0.0 109.908 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.454 HD13 HD12 ' B' ' 190' ' ' ILE . 25.9 tp -74.1 -33.67 63.68 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.63 -0.669 . . . . 0.0 109.899 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.8 mt -74.32 -33.1 63.08 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.666 -0.646 . . . . 0.0 109.632 179.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.88 -29.21 66.36 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.725 -0.609 . . . . 0.0 109.706 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.64 -42.75 77.56 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.655 -0.653 . . . . 0.0 109.79 179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -65.73 -29.05 69.52 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.468 -0.77 . . . . 0.0 109.876 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.0 tm-20 -68.41 -28.24 66.91 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.646 -0.659 . . . . 0.0 110.044 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -70.23 -45.76 65.86 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.557 -0.714 . . . . 0.0 109.87 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.1 tttm -63.7 -29.56 70.77 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.509 -0.744 . . . . 0.0 109.945 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -67.38 -29.3 68.78 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.59 -0.694 . . . . 0.0 109.943 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -36.15 83.18 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.533 -0.729 . . . . 0.0 109.945 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.485 HD23 HD21 ' B' ' 172' ' ' LEU . 1.4 mt -64.29 -34.36 77.96 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.638 -0.664 . . . . 0.0 109.992 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -65.59 -26.49 67.87 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.619 -0.676 . . . . 0.0 110.332 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.8 -28.24 64.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.575 -0.703 . . . . 0.0 110.267 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -117.29 26.19 9.93 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.557 -0.714 . . . . 0.0 110.467 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.526 HD11 ' CD1' ' B' ' 173' ' ' ILE . 49.8 tp . . . . . 0 N--CA 1.498 1.943 0 CA-C-O 117.957 -1.02 . . . . 0.0 110.171 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.378 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.739 HD12 ' N ' ' B' ' 168' ' ' SER . 2.5 pp -139.85 -46.35 0.44 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.67 -0.9 . . . . 0.0 110.637 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.739 ' N ' HD12 ' B' ' 167' ' ' LEU . 33.9 p -153.46 14.56 0.5 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.31 -0.868 . . . . 0.0 111.499 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 9.5 tptm 49.53 26.37 1.7 Allowed 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.012 -1.055 . . . . 0.0 111.051 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -152.92 -46.83 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.665 -0.647 . . . . 0.0 110.047 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.456 ' CB ' HD11 ' B' ' 167' ' ' LEU . 1.0 OUTLIER -73.58 -36.73 65.59 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 179.427 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.485 HD21 HD23 ' A' ' 86' ' ' LEU . 1.0 OUTLIER -74.09 -28.05 61.19 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.818 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.526 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.3 mm -67.54 -31.04 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.694 -0.629 . . . . 0.0 109.385 179.397 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -72.38 -29.09 63.44 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.681 -0.637 . . . . 0.0 109.916 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -72.55 -32.17 65.85 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.621 -0.674 . . . . 0.0 110.026 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.464 ' CE ' HD13 ' A' ' 90' ' ' LEU . 1.3 mtt -70.37 -30.19 67.05 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.695 -0.628 . . . . 0.0 109.888 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -69.39 -30.87 68.94 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.644 -0.66 . . . . 0.0 109.863 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.13 -45.48 66.76 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.701 -0.625 . . . . 0.0 109.695 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.419 HG21 ' CD1' ' A' ' 86' ' ' LEU . 58.5 t -61.96 -30.45 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.827 -0.545 . . . . 0.0 109.773 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -67.85 -31.73 71.75 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.658 -0.651 . . . . 0.0 109.863 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.19 -30.39 63.5 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.698 -0.626 . . . . 0.0 109.715 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 182' ' ' GLU . . . . . 0.604 ' O ' HG23 ' B' ' 186' ' ' VAL . 13.3 tt0 -70.89 -34.69 71.82 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.664 -0.647 . . . . 0.0 109.815 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.5 mt -73.66 -30.6 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.721 -0.612 . . . . 0.0 109.654 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 53.1 m -73.31 -34.76 65.88 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.674 -0.641 . . . . 0.0 109.626 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 tpp -72.13 -39.18 69.02 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.605 -0.685 . . . . 0.0 109.677 179.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 186' ' ' VAL . . . . . 0.604 HG23 ' O ' ' B' ' 182' ' ' GLU . 64.8 t -70.89 -32.07 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.641 -0.662 . . . . 0.0 109.423 179.595 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -70.77 -30.01 66.39 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.684 -0.635 . . . . 0.0 109.894 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -73.71 -30.2 62.72 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.694 -0.629 . . . . 0.0 109.871 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -37.11 68.56 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.688 -0.632 . . . . 0.0 109.8 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.8 HG12 HD22 ' A' ' 72' ' ' LEU . 77.3 mt -72.95 -31.29 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.666 -0.646 . . . . 0.0 109.607 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.57 -34.7 65.26 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.656 -0.653 . . . . 0.0 109.662 179.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -73.1 -38.56 66.31 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.655 -0.653 . . . . 0.0 109.536 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.768 HD22 HG12 ' A' ' 69' ' ' ILE . 0.3 OUTLIER -67.34 -32.23 73.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.668 -0.645 . . . . 0.0 109.351 179.316 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -66.76 -47.23 72.86 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.66 -0.65 . . . . 0.0 109.387 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -64.21 -31.09 72.16 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 120.051 -0.66 . . . . 0.0 109.244 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.658 ' HE2' HD23 ' B' ' 193' ' ' LEU . 19.0 ttpt -62.79 -37.22 85.82 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.691 -0.631 . . . . 0.0 109.418 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 197' ' ' GLN . . . . . 0.405 HE22 HD12 ' A' ' 69' ' ' ILE . 5.5 tt0 -63.12 -30.16 71.37 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.722 -0.611 . . . . 0.0 109.66 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -61.04 -40.96 95.61 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.605 -0.685 . . . . 0.0 109.882 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -64.04 -36.43 83.97 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.753 -0.592 . . . . 0.0 109.644 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' B' ' 200' ' ' LEU . 14.0 tp -75.68 -31.02 59.55 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.658 -0.651 . . . . 0.0 109.632 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.587 ' CG ' HD11 ' A' ' 62' ' ' LEU . 14.9 mt-10 -77.95 -30.73 50.55 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.638 -0.664 . . . . 0.0 109.723 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -76.13 -31.07 58.42 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.651 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -72.02 -29.08 63.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.679 -0.638 . . . . 0.0 109.923 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -71.13 -26.81 63.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.588 -0.695 . . . . 0.0 110.141 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -118.23 27.35 9.03 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.547 -0.721 . . . . 0.0 110.394 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -77.14 152.67 82.15 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.552 -0.717 . . . . 0.0 110.058 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.316 -1.141 0 O-C-N 123.404 1.213 . . . . 0.0 110.409 179.936 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.0 ttmt . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.094 0.473 . . . . 0.0 110.244 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.2 mtpp -123.65 156.82 35.15 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.569 -0.707 . . . . 0.0 110.165 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -59.96 -26.09 65.72 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.522 -0.736 . . . . 0.0 110.421 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.2 mmt -83.78 -28.6 28.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.432 -0.793 . . . . 0.0 110.248 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -60.89 -28.25 68.75 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.553 -0.717 . . . . 0.0 110.265 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -71.43 -28.87 64.29 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.533 -0.729 . . . . 0.0 110.131 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -72.12 -29.26 63.89 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.653 -0.654 . . . . 0.0 110.039 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.2 ttt -70.54 -29.55 66.05 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.666 -0.646 . . . . 0.0 109.932 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.5 t -68.46 -29.09 67.64 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.604 -0.685 . . . . 0.0 110.016 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.831 HD12 HD23 ' B' ' 200' ' ' LEU . 4.5 tp -67.43 -28.37 67.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.648 -0.658 . . . . 0.0 110.087 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.71 -29.83 69.19 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.583 -0.698 . . . . 0.0 110.119 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -70.5 -46.13 64.3 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.623 -0.673 . . . . 0.0 109.886 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 21.0 m -62.93 -31.12 72.13 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.731 -0.606 . . . . 0.0 109.724 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -65.02 -28.27 69.38 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.628 -0.67 . . . . 0.0 109.93 179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -62.57 -39.75 94.68 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.609 -0.682 . . . . 0.0 110.104 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.4 tp60 -75.41 -30.69 60.15 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.6 -0.687 . . . . 0.0 109.632 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.418 HG12 HD22 ' B' ' 193' ' ' LEU . 73.7 mt -77.37 -27.04 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.785 -0.572 . . . . 0.0 109.712 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.1 mt -75.37 -32.69 60.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.458 -0.776 . . . . 0.0 109.826 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -31.62 70.41 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.567 -0.708 . . . . 0.0 109.822 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.672 HD22 HG12 ' B' ' 190' ' ' ILE . 5.3 mt -69.73 -28.96 66.25 Favored 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.898 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.28 -33.11 73.75 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.6 -0.688 . . . . 0.0 110.003 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -76.48 -33.23 58.68 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.557 -0.715 . . . . 0.0 109.71 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.8 tttt -75.35 -29.93 60.07 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.705 -0.622 . . . . 0.0 109.807 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.638 HD13 HD12 ' B' ' 190' ' ' ILE . 15.7 tp -77.22 -31.03 54.94 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.671 -0.643 . . . . 0.0 109.798 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mp -76.34 -33.57 58.97 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.642 -0.661 . . . . 0.0 109.634 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.92 -29.3 63.02 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.696 -0.627 . . . . 0.0 109.994 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.738 HD23 ' HA ' ' B' ' 183' ' ' ILE . 8.8 tp -75.14 -38.39 61.01 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.592 -0.693 . . . . 0.0 109.922 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.451 ' HG2' HG21 ' B' ' 183' ' ' ILE . 4.3 mm-40 -71.23 -29.69 65.43 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.734 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -69.99 -28.98 65.96 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.688 -0.632 . . . . 0.0 109.861 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -67.61 -43.04 81.42 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.522 -0.736 . . . . 0.0 109.863 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -62.3 -28.46 69.75 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.559 -0.713 . . . . 0.0 109.779 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -62.95 -31.86 73.05 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.619 -0.676 . . . . 0.0 109.875 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -40.04 94.61 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.675 -0.64 . . . . 0.0 109.9 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.702 HD23 HD21 ' B' ' 172' ' ' LEU . 2.9 mt -60.81 -35.5 76.65 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.629 -0.67 . . . . 0.0 110.127 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -61.3 -36.89 81.33 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.517 -0.739 . . . . 0.0 109.968 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mp -77.05 -29.17 55.06 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.703 -0.623 . . . . 0.0 109.684 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -95.18 -0.22 53.45 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.65 -0.656 . . . . 0.0 110.965 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.594 HD11 ' CD1' ' B' ' 173' ' ' ILE . 49.5 tp . . . . . 0 N--CA 1.498 1.964 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.245 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.559 HD12 ' N ' ' B' ' 168' ' ' SER . 1.3 pp -139.03 -48.73 0.5 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.624 -0.927 . . . . 0.0 110.753 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.559 ' N ' HD12 ' B' ' 167' ' ' LEU . 4.0 m -155.22 13.55 0.37 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.261 -0.9 . . . . 0.0 111.752 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 15.1 tptt 49.34 26.28 1.54 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.999 -1.063 . . . . 0.0 111.066 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -151.86 -47.26 0.11 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.684 -0.635 . . . . 0.0 109.829 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.38 -33.5 63.08 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.702 HD21 HD23 ' A' ' 86' ' ' LEU . 1.6 tt -75.56 -26.66 58.15 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.594 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.7 mm -69.4 -30.65 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.561 -0.712 . . . . 0.0 109.523 179.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -73.11 -28.57 62.34 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.714 -0.616 . . . . 0.0 110.15 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.709 ' O ' HG23 ' B' ' 179' ' ' VAL . 86.9 m-20 -74.86 -29.22 60.96 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.6 -0.687 . . . . 0.0 110.079 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -73.4 -29.96 62.95 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.581 -0.699 . . . . 0.0 109.921 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -77.25 -29.98 54.25 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.609 -0.682 . . . . 0.0 109.94 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.49 -31.13 47.63 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.646 -0.659 . . . . 0.0 109.787 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.709 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.0 t -77.96 -31.06 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.633 -0.667 . . . . 0.0 109.521 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -76.31 -29.0 57.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.654 -0.654 . . . . 0.0 109.811 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.38 -29.09 61.4 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.654 -0.654 . . . . 0.0 109.715 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -71.55 -31.4 66.97 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.579 -0.701 . . . . 0.0 110.039 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.738 ' HA ' HD23 ' A' ' 79' ' ' LEU . 83.9 mt -72.62 -29.64 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.628 -0.67 . . . . 0.0 109.706 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.4 -33.13 72.56 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.619 -0.675 . . . . 0.0 109.853 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 49.0 mtp -71.49 -45.76 61.61 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.589 -0.694 . . . . 0.0 109.768 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.1 t -71.57 -31.5 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.648 -0.658 . . . . 0.0 109.383 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 187' ' ' GLU . . . . . 0.457 ' HB2' HD11 ' A' ' 76' ' ' LEU . 10.7 tm-20 -74.51 -28.8 61.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.73 -0.606 . . . . 0.0 109.782 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -72.62 -29.72 63.72 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.558 -0.714 . . . . 0.0 110.044 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -36.43 65.71 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.683 -0.635 . . . . 0.0 109.935 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.672 HG12 HD22 ' A' ' 72' ' ' LEU . 75.6 mt -71.29 -31.05 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.639 -0.663 . . . . 0.0 109.573 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 3.2 m -67.77 -37.59 82.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.704 -0.623 . . . . 0.0 109.541 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -74.94 -32.46 61.76 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.622 -0.674 . . . . 0.0 109.4 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.477 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -71.39 -31.56 67.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.631 -0.668 . . . . 0.0 109.295 179.259 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 11.9 tptm -68.81 -46.3 69.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.629 -0.669 . . . . 0.0 109.407 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.67 -29.67 70.67 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 119.967 -0.693 . . . . 0.0 109.151 179.12 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -62.52 -36.55 82.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.604 -0.685 . . . . 0.0 109.208 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.15 -31.16 72.24 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -58.93 -42.78 90.54 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.684 -0.635 . . . . 0.0 109.986 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.64 -39.46 93.92 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.737 -0.602 . . . . 0.0 109.596 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.831 HD23 HD12 ' A' ' 62' ' ' LEU . 15.1 tp -74.41 -28.54 61.13 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.676 -0.64 . . . . 0.0 109.666 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -78.11 -30.47 49.5 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.544 -0.723 . . . . 0.0 109.906 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -78.04 -29.9 49.57 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.622 -0.674 . . . . 0.0 109.792 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -76.29 -27.86 56.79 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.656 -0.652 . . . . 0.0 110.037 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -76.18 -27.96 57.12 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.534 -0.729 . . . . 0.0 110.203 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -81.09 -34.19 32.82 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.483 -0.761 . . . . 0.0 110.148 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 5.6 mmtm 51.89 93.58 0.05 OUTLIER Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 121.376 -0.827 . . . . 0.0 110.878 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 C--N 1.316 -1.162 0 O-C-N 123.413 1.218 . . . . 0.0 110.374 -179.978 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.144 0.497 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.1 mtpp -95.9 -175.74 3.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.566 -0.709 . . . . 0.0 110.185 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -80.03 -29.49 39.34 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.537 -0.727 . . . . 0.0 110.178 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.8 ttt -88.24 -28.36 21.18 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.646 -0.659 . . . . 0.0 110.232 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -60.64 -28.44 68.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.582 -0.699 . . . . 0.0 110.242 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -66.78 -37.24 84.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.535 -0.728 . . . . 0.0 109.996 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -73.73 -31.38 63.34 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.589 -0.694 . . . . 0.0 109.772 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.2 mtp -74.54 -29.72 61.48 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.689 -0.632 . . . . 0.0 109.762 179.559 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.5 m -71.08 -29.49 65.36 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.664 -0.648 . . . . 0.0 109.825 179.634 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.542 HD12 HD23 ' B' ' 200' ' ' LEU . 1.0 OUTLIER -68.25 -29.37 68.16 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.697 -0.627 . . . . 0.0 109.999 179.737 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -73.86 -33.1 63.95 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.63 -0.669 . . . . 0.0 109.932 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -74.45 -38.82 62.87 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.66 -0.65 . . . . 0.0 109.752 179.648 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 58.5 m -71.85 -32.62 67.7 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.723 -0.611 . . . . 0.0 109.434 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -68.14 -29.45 68.36 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.581 179.406 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -63.0 -36.86 84.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.611 -0.681 . . . . 0.0 109.827 179.668 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -75.48 -34.69 60.91 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.466 179.501 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.432 HG12 HD22 ' B' ' 193' ' ' LEU . 83.1 mt -72.12 -28.57 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.734 -0.604 . . . . 0.0 109.397 179.274 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.8 tp -69.21 -40.45 78.0 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.589 -0.694 . . . . 0.0 109.748 179.583 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.23 -31.89 73.15 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.533 -0.729 . . . . 0.0 109.696 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.794 HD22 HG12 ' B' ' 190' ' ' ILE . 6.4 mt -69.69 -30.37 68.01 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.685 -0.634 . . . . 0.0 109.773 179.575 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -69.49 -34.24 74.05 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.598 -0.689 . . . . 0.0 109.758 179.631 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -75.25 -31.7 60.88 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.695 -0.628 . . . . 0.0 109.508 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.15 -30.53 66.57 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.523 179.546 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -74.05 -31.3 62.82 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.61 -0.681 . . . . 0.0 109.714 179.605 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 tp -73.26 -37.85 66.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.673 -0.642 . . . . 0.0 109.693 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.36 -30.9 70.83 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.602 179.483 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.619 HD12 HG12 ' B' ' 183' ' ' ILE . 0.5 OUTLIER -70.76 -46.31 63.19 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.676 -0.64 . . . . 0.0 109.639 179.529 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -66.18 -29.3 69.56 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.661 -0.649 . . . . 0.0 109.644 179.453 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -68.95 -30.27 68.68 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.661 -0.649 . . . . 0.0 109.788 179.662 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -69.93 -47.05 63.93 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.668 -0.645 . . . . 0.0 109.808 179.692 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.4 tttt -62.28 -29.87 70.73 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.522 -0.736 . . . . 0.0 109.603 179.441 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -62.98 -31.83 73.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.662 -0.649 . . . . 0.0 109.743 179.561 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -67.2 -32.09 72.92 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.661 -0.649 . . . . 0.0 109.744 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.543 HD23 ' CD2' ' B' ' 172' ' ' LEU . 0.5 OUTLIER -67.57 -31.62 71.82 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.6 -0.687 . . . . 0.0 109.755 179.687 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -62.36 -35.45 79.18 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.615 -0.678 . . . . 0.0 109.88 179.659 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.44 -30.5 64.65 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.671 -0.643 . . . . 0.0 109.696 179.569 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.471 ' O ' HD13 ' B' ' 172' ' ' LEU . 18.8 mt-30 -88.72 -18.51 27.69 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.647 -0.658 . . . . 0.0 110.519 179.649 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.603 HD11 HD11 ' B' ' 173' ' ' ILE . 32.8 tp . . . . . 0 N--CA 1.501 2.097 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.646 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 166' ' ' GLY . . . . . 0.557 ' HA2' HD12 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.34 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' B' ' 171' ' ' GLU . 0.4 OUTLIER -109.96 -62.51 1.5 Allowed 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.63 -0.923 . . . . 0.0 109.088 179.975 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 6.2 t -154.41 35.99 0.42 Allowed 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.315 0.579 . . . . 0.0 109.528 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 5.9 tptm 51.87 26.07 3.39 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.524 -0.735 . . . . 0.0 110.118 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -147.61 -45.39 0.17 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.707 -0.621 . . . . 0.0 109.962 -179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.696 ' HB3' HD22 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -64.68 -30.27 71.28 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 119.618 -0.833 . . . . 0.0 109.2 179.39 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.557 HD12 ' HA2' ' B' ' 166' ' ' GLY . 0.3 OUTLIER -81.65 -27.53 34.06 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.63 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.603 HD11 HD11 ' A' ' 90' ' ' LEU . 49.9 mm -69.93 -30.82 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.753 -0.592 . . . . 0.0 109.498 179.428 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.95 -30.31 66.56 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.636 -0.665 . . . . 0.0 109.946 179.77 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.77 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.6 m-20 -76.83 -29.25 55.84 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.623 -0.673 . . . . 0.0 109.871 179.59 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.449 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -75.63 -28.31 58.76 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.653 -0.654 . . . . 0.0 110.056 179.761 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.75 -32.22 57.61 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.583 -0.698 . . . . 0.0 110.057 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -75.22 -29.99 60.46 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.611 -0.681 . . . . 0.0 109.889 179.711 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.77 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.9 t -73.75 -29.43 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.646 -0.659 . . . . 0.0 109.717 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.42 -29.21 65.76 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.558 -0.714 . . . . 0.0 110.029 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 -74.36 -28.9 61.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.602 -0.686 . . . . 0.0 110.118 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 182' ' ' GLU . . . . . 0.436 ' O ' HG23 ' B' ' 186' ' ' VAL . 9.0 tt0 -75.73 -34.34 60.32 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.533 -0.73 . . . . 0.0 110.155 179.954 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.619 HG12 HD12 ' A' ' 79' ' ' LEU . 83.4 mt -74.0 -29.07 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.628 -0.67 . . . . 0.0 109.768 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.6 m -73.92 -33.92 64.15 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.613 -0.68 . . . . 0.0 109.714 179.549 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.28 -39.2 78.52 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.664 -0.648 . . . . 0.0 109.77 179.662 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 186' ' ' VAL . . . . . 0.436 HG23 ' O ' ' B' ' 182' ' ' GLU . 57.6 t -70.66 -29.89 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.673 -0.642 . . . . 0.0 109.598 179.612 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -71.17 -28.63 64.38 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.603 -0.685 . . . . 0.0 110.07 179.724 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -69.72 -33.96 73.22 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.562 -0.711 . . . . 0.0 109.995 179.908 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -37.93 62.17 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.64 -0.663 . . . . 0.0 109.702 179.74 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.794 HG12 HD22 ' A' ' 72' ' ' LEU . 78.7 mt -73.29 -28.91 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.659 -0.651 . . . . 0.0 109.683 179.629 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 23.5 p -73.39 -34.76 65.7 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.571 -0.706 . . . . 0.0 109.759 179.504 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -77.36 -33.02 55.38 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.611 -0.681 . . . . 0.0 109.473 179.399 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.584 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -74.4 -30.42 61.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.712 -0.617 . . . . 0.0 109.387 179.353 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.0 tptm -68.42 -36.57 79.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.595 -0.691 . . . . 0.0 109.528 179.483 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 8.5 tptp -68.49 -30.25 69.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.663 -0.648 . . . . 0.0 109.547 179.414 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -35.63 81.24 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.612 -0.68 . . . . 0.0 109.484 179.525 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -63.4 -30.74 71.82 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.747 -0.596 . . . . 0.0 109.8 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.97 -41.73 98.34 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.71 -0.619 . . . . 0.0 109.91 179.71 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -61.99 -45.76 92.2 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.741 -0.599 . . . . 0.0 109.969 179.756 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.542 HD23 HD12 ' A' ' 62' ' ' LEU . 4.4 tp -70.32 -32.84 70.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.621 -0.674 . . . . 0.0 109.716 179.586 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -76.34 -29.32 57.2 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.678 -0.639 . . . . 0.0 109.895 179.619 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -77.01 -28.27 54.92 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.587 -0.696 . . . . 0.0 110.026 179.778 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -78.45 -29.25 46.85 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.546 -0.721 . . . . 0.0 109.985 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -79.74 -27.41 40.57 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.592 -0.693 . . . . 0.0 110.132 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.68 -22.66 29.72 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.593 -0.692 . . . . 0.0 110.412 179.886 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.42 147.37 59.41 Favored Pre-proline 0 N--CA 1.498 1.94 0 O-C-N 121.355 -0.841 . . . . 0.0 110.385 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo . . . . . 0 C--N 1.317 -1.087 0 O-C-N 123.343 1.18 . . . . 0.0 110.366 -179.952 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.148 0.499 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.6 mptt -81.68 170.69 15.49 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.553 -0.717 . . . . 0.0 110.23 179.994 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -100.06 -24.32 14.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.626 -0.671 . . . . 0.0 110.444 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.1 -32.57 63.28 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.437 -0.789 . . . . 0.0 110.102 179.92 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -63.39 -25.59 68.35 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.61 -0.681 . . . . 0.0 110.329 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -73.51 -28.56 61.96 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.512 -0.742 . . . . 0.0 110.128 179.785 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 ttt-85 -69.71 -31.62 69.73 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.642 -0.661 . . . . 0.0 110.054 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.3 -45.01 64.07 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.628 -0.67 . . . . 0.0 109.735 179.791 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.31 -27.97 68.98 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.84 179.6 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.541 HD11 ' HA ' ' B' ' 201' ' ' GLU . 0.3 OUTLIER -69.78 -28.87 66.11 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.566 -0.709 . . . . 0.0 110.113 179.858 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -72.94 -33.15 65.75 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.578 -0.701 . . . . 0.0 110.1 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -75.84 -30.03 58.8 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.653 -0.654 . . . . 0.0 109.908 179.762 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.487 HG23 ' NZ ' ' B' ' 196' ' ' LYS . 88.2 m -75.84 -29.59 58.67 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.654 -0.654 . . . . 0.0 109.875 179.621 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -73.83 -26.7 60.73 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.575 -0.703 . . . . 0.0 110.162 179.68 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.86 -33.28 62.08 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.597 -0.689 . . . . 0.0 110.133 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -76.38 -37.29 57.41 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.661 -0.649 . . . . 0.0 109.698 179.727 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.694 HG12 HD23 ' B' ' 193' ' ' LEU . 84.3 mt -72.6 -26.82 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.719 -0.613 . . . . 0.0 109.62 179.399 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.5 mt -72.91 -36.51 67.29 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.541 -0.724 . . . . 0.0 109.734 179.587 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -71.18 -31.06 67.2 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.611 -0.68 . . . . 0.0 109.718 179.605 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.41 HD22 HG12 ' B' ' 190' ' ' ILE . 5.0 mt -69.37 -30.57 68.59 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.774 -0.579 . . . . 0.0 109.831 179.667 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -69.21 -31.32 69.84 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.602 -0.686 . . . . 0.0 109.847 179.843 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.52 -32.73 54.26 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.603 -0.686 . . . . 0.0 109.626 179.583 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -76.06 -33.19 59.58 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.695 -0.628 . . . . 0.0 109.58 179.581 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.487 HD21 ' HG3' ' B' ' 187' ' ' GLU . 14.7 tp -74.96 -30.16 61.13 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.676 -0.64 . . . . 0.0 109.734 179.549 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.46 HD23 ' O ' ' A' ' 77' ' ' LEU . 2.8 tt -75.43 -36.2 60.82 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.667 -0.646 . . . . 0.0 109.71 179.562 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.72 -30.72 67.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.677 -0.639 . . . . 0.0 109.735 179.558 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.776 HD23 ' HA ' ' B' ' 183' ' ' ILE . 7.2 tp -69.32 -37.27 77.66 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.696 -0.628 . . . . 0.0 109.709 179.619 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -71.65 -30.09 65.35 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.598 -0.689 . . . . 0.0 109.639 179.359 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.52 -29.91 67.63 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.578 -0.701 . . . . 0.0 109.855 179.555 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.62 -42.8 81.76 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.634 -0.666 . . . . 0.0 109.885 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.53 ' HD3' HD12 ' B' ' 183' ' ' ILE . 3.3 ttpp -62.03 -29.61 70.4 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.555 -0.716 . . . . 0.0 109.769 179.596 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -62.48 -32.17 73.02 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.737 -0.602 . . . . 0.0 109.874 179.713 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -68.75 -37.7 79.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.639 -0.663 . . . . 0.0 109.714 179.68 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.701 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.3 OUTLIER -64.08 -30.08 71.17 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.678 -0.639 . . . . 0.0 109.711 179.668 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -62.47 -36.1 81.41 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.626 -0.671 . . . . 0.0 109.824 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.72 -28.86 69.72 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.638 -0.664 . . . . 0.0 110.007 179.703 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -87.68 -23.98 24.03 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.542 -0.723 . . . . 0.0 110.418 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.574 HD13 ' HE3' ' B' ' 176' ' ' MET . 29.4 tp . . . . . 0 N--CA 1.5 2.034 0 CA-C-O 118.018 -0.991 . . . . 0.0 110.575 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.8 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.4 OUTLIER -109.07 -61.98 1.54 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.561 -0.964 . . . . 0.0 109.01 179.897 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 93.7 p -155.27 35.41 0.38 Allowed 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 121.381 0.61 . . . . 0.0 109.451 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 4.8 tptm 51.88 26.16 3.46 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.526 -0.734 . . . . 0.0 110.146 -178.978 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -148.4 -44.84 0.15 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.679 -0.638 . . . . 0.0 109.916 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.691 ' HB3' HD22 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -63.89 -30.4 71.49 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 119.612 -0.835 . . . . 0.0 109.27 179.514 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.8 ' HG ' HD11 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -83.48 -28.88 28.43 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 178.567 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.553 HD11 HD11 ' A' ' 90' ' ' LEU . 51.0 mm -68.07 -30.96 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.058 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -70.3 -29.96 66.84 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.675 -0.641 . . . . 0.0 109.903 179.617 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.666 ' O ' HG23 ' B' ' 179' ' ' VAL . 56.4 m-20 -77.45 -32.96 54.83 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.618 -0.676 . . . . 0.0 109.771 179.683 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.701 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -75.68 -30.25 59.31 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.675 -0.641 . . . . 0.0 109.746 179.595 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -76.57 -30.53 57.07 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.634 -0.666 . . . . 0.0 109.859 179.767 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -77.43 -33.85 54.79 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.628 -0.67 . . . . 0.0 109.799 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.666 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.5 t -76.84 -30.65 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.632 -0.668 . . . . 0.0 109.476 179.497 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -75.41 -29.25 59.7 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.656 -0.653 . . . . 0.0 109.865 179.503 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -29.64 62.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.609 -0.682 . . . . 0.0 109.992 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -75.06 -33.18 61.68 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.601 -0.687 . . . . 0.0 109.984 179.74 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.776 ' HA ' HD23 ' A' ' 79' ' ' LEU . 89.2 mt -72.25 -30.05 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.66 -0.65 . . . . 0.0 109.739 179.698 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.63 -35.13 72.76 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.669 -0.644 . . . . 0.0 109.789 179.556 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.5 ttt -67.55 -41.84 83.6 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.567 -0.708 . . . . 0.0 109.802 179.618 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.5 t -70.79 -30.41 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.674 -0.641 . . . . 0.0 109.638 179.629 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 187' ' ' GLU . . . . . 0.487 ' HG3' HD21 ' A' ' 76' ' ' LEU . 4.0 tt0 -74.0 -29.9 62.2 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.584 -0.698 . . . . 0.0 109.964 179.697 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -72.36 -29.68 64.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.52 -0.738 . . . . 0.0 109.918 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -38.69 65.31 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.677 -0.64 . . . . 0.0 109.843 179.774 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.421 HD12 HD22 ' A' ' 76' ' ' LEU . 76.0 mt -70.82 -30.5 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.745 -0.597 . . . . 0.0 109.616 179.722 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.6 m -71.09 -36.72 72.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.649 -0.657 . . . . 0.0 109.603 179.557 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 16.5 mmtm -74.88 -31.95 61.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.642 -0.661 . . . . 0.0 109.584 179.478 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.694 HD23 HG12 ' A' ' 69' ' ' ILE . 0.3 OUTLIER -78.62 -14.42 59.33 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.694 -0.629 . . . . 0.0 110.438 179.358 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.7 tptp -87.65 -28.27 21.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.236 -0.915 . . . . 0.0 109.404 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.16 -34.92 56.39 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.583 -0.698 . . . . 0.0 109.753 179.523 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.487 ' NZ ' HG23 ' A' ' 65' ' ' THR . 0.0 OUTLIER -69.67 -27.62 65.18 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 119.785 -0.766 . . . . 0.0 109.538 179.454 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -69.29 -29.77 67.71 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.54 -0.725 . . . . 0.0 109.458 179.174 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -61.19 -43.58 98.65 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.705 -0.622 . . . . 0.0 109.707 179.52 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -61.58 -34.05 74.94 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.746 -0.596 . . . . 0.0 109.616 179.369 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 23.5 tp -78.12 -31.97 50.19 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.541 ' HA ' HD11 ' A' ' 62' ' ' LEU . 4.1 mm-40 -78.4 -32.43 48.74 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.715 -0.615 . . . . 0.0 109.581 179.447 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -76.8 -29.62 56.08 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.787 -0.57 . . . . 0.0 109.707 179.426 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -74.19 -28.34 61.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.65 -0.656 . . . . 0.0 109.882 179.478 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -72.27 -26.61 62.05 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.635 -0.665 . . . . 0.0 110.185 179.832 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -86.1 -28.91 23.74 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.518 -0.739 . . . . 0.0 110.15 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 8.7 mttp -60.69 111.28 3.85 Favored Pre-proline 0 N--CA 1.495 1.819 0 O-C-N 121.612 -0.68 . . . . 0.0 110.179 179.969 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 N--CA 1.486 1.086 0 O-C-N 123.218 1.115 . . . . 0.0 110.394 179.989 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.1 0.476 . . . . 0.0 110.321 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -165.66 -172.36 2.38 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.562 -0.712 . . . . 0.0 110.146 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -89.55 -29.22 19.06 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.64 -0.662 . . . . 0.0 110.247 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -28.87 22.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.618 -0.676 . . . . 0.0 110.211 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -66.66 -28.65 68.63 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.555 -0.715 . . . . 0.0 110.121 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -69.56 -27.87 65.5 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.585 -0.697 . . . . 0.0 110.231 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.6 mtt180 -75.51 -30.55 59.86 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.518 -0.739 . . . . 0.0 110.069 -179.985 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.2 mtp -74.57 -31.64 62.14 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.656 -0.653 . . . . 0.0 109.911 179.824 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.8 m -71.26 -29.51 65.17 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.634 -0.666 . . . . 0.0 109.84 179.607 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.604 HD11 ' HG2' ' B' ' 201' ' ' GLU . 2.3 tt -67.95 -29.31 68.33 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.683 -0.635 . . . . 0.0 109.89 179.719 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -64.52 -35.69 81.79 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.573 -0.705 . . . . 0.0 109.9 179.888 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -73.7 -35.43 65.15 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.582 -0.699 . . . . 0.0 109.794 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.437 HG21 ' NZ ' ' B' ' 196' ' ' LYS . 86.6 m -71.72 -31.32 66.58 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.741 -0.6 . . . . 0.0 109.604 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -68.07 -28.34 67.28 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.725 -0.609 . . . . 0.0 109.89 179.625 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -65.99 -34.73 78.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.59 -0.694 . . . . 0.0 110.006 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.6 tp60 -77.64 -31.71 52.87 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.679 -0.638 . . . . 0.0 109.64 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.596 HG12 HD22 ' B' ' 193' ' ' LEU . 82.0 mt -77.01 -28.8 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.732 -0.605 . . . . 0.0 109.562 179.496 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 25.4 tp -74.35 -33.89 63.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.598 -0.689 . . . . 0.0 109.632 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -29.94 70.0 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.574 -0.704 . . . . 0.0 109.745 179.626 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.594 HD11 HD13 ' B' ' 193' ' ' LEU . 14.2 mt -65.02 -30.98 72.0 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.642 -0.661 . . . . 0.0 110.046 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.98 -38.87 92.66 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.565 -0.709 . . . . 0.0 110.004 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -73.9 -31.76 63.26 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.548 179.574 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -76.07 -34.96 59.57 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.706 -0.621 . . . . 0.0 109.663 179.58 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.702 ' O ' HD13 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -74.57 -30.65 61.8 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.58 -0.7 . . . . 0.0 109.607 179.464 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.55 HD23 ' O ' ' A' ' 77' ' ' LEU . 5.9 tt -74.39 -34.69 63.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.634 -0.666 . . . . 0.0 109.726 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.37 69.56 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.676 -0.64 . . . . 0.0 109.723 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 79' ' ' LEU . 1.8 mm? -72.16 -43.17 65.02 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.617 -0.677 . . . . 0.0 109.756 179.709 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -67.62 -29.05 68.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.684 -0.635 . . . . 0.0 109.872 179.486 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -70.1 -30.01 67.11 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.583 -0.698 . . . . 0.0 109.847 179.671 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -69.63 -45.65 68.0 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.599 -0.688 . . . . 0.0 109.711 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -61.87 -27.63 68.93 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.531 -0.731 . . . . 0.0 109.606 179.204 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -62.57 -30.01 71.01 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.592 -0.693 . . . . 0.0 109.771 179.561 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -61.34 -43.93 98.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.535 -0.728 . . . . 0.0 109.856 179.685 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.606 HD23 HD21 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -63.74 -33.65 76.13 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.703 -0.623 . . . . 0.0 109.394 179.436 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -62.03 -35.14 77.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.685 -0.634 . . . . 0.0 109.872 179.817 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.68 -27.17 69.05 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.981 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -106.33 12.73 29.55 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.62 -0.675 . . . . 0.0 110.803 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 58.8 tp . . . . . 0 N--CA 1.499 1.983 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.12 -179.866 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.738 HD12 ' N ' ' B' ' 168' ' ' SER . 2.5 pp -140.43 -46.05 0.42 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.616 -0.932 . . . . 0.0 110.501 -179.808 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.738 ' N ' HD12 ' B' ' 167' ' ' LEU . 38.6 m -153.93 13.99 0.46 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.285 -0.884 . . . . 0.0 111.466 179.925 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 24.3 tptp 49.31 26.6 1.62 Allowed 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.085 -1.01 . . . . 0.0 111.02 -179.825 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -151.4 -47.43 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.735 -0.603 . . . . 0.0 109.738 179.858 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.453 ' CB ' HD11 ' B' ' 167' ' ' LEU . 2.5 mm-40 -74.01 -35.28 64.39 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.27 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.606 HD21 HD23 ' A' ' 86' ' ' LEU . 0.9 OUTLIER -77.12 -29.72 54.89 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.774 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.0 mm -69.51 -29.98 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.393 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -74.1 -31.46 62.81 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.651 -0.656 . . . . 0.0 109.852 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -74.57 -32.76 62.5 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.658 -0.651 . . . . 0.0 109.837 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -29.4 64.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.729 -0.607 . . . . 0.0 109.772 179.523 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.18 -29.76 66.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.557 -0.715 . . . . 0.0 110.054 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 8.0 mtm180 -73.28 -37.08 66.39 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.679 -0.638 . . . . 0.0 109.936 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 59.2 t -73.57 -31.46 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.654 -0.654 . . . . 0.0 109.479 179.594 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -72.2 -29.19 63.74 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.712 -0.617 . . . . 0.0 109.919 179.592 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.52 -31.98 70.53 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.592 -0.692 . . . . 0.0 109.947 179.768 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.06 -35.06 66.63 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.666 -0.646 . . . . 0.0 109.926 179.779 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 86.0 mt -69.51 -30.24 44.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.545 179.6 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.91 -30.98 71.66 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.636 -0.665 . . . . 0.0 109.808 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.6 mtt -68.5 -50.24 53.72 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.685 -0.634 . . . . 0.0 109.843 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -68.21 -30.89 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.578 -0.701 . . . . 0.0 109.564 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -75.23 -28.4 59.88 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.655 -0.653 . . . . 0.0 109.94 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -74.15 -28.89 61.53 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.564 -0.71 . . . . 0.0 110.036 179.729 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.03 -36.6 64.43 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.545 -0.722 . . . . 0.0 109.97 179.801 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.59 HG12 HD22 ' A' ' 72' ' ' LEU . 84.0 mt -68.99 -30.48 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.669 -0.644 . . . . 0.0 109.668 179.698 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.7 m -68.37 -40.94 81.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.63 -0.669 . . . . 0.0 109.559 179.513 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt -73.31 -33.44 65.17 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.682 -0.636 . . . . 0.0 109.4 179.426 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.596 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -72.37 -30.44 64.7 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.701 -0.625 . . . . 0.0 109.398 179.322 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.4 tppt? -69.75 -42.42 73.9 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.644 -0.66 . . . . 0.0 109.727 179.587 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.41 -31.83 73.19 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.561 -0.712 . . . . 0.0 109.383 179.493 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.437 ' NZ ' HG21 ' A' ' 65' ' ' THR . 2.0 ttpp -63.75 -37.12 86.16 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.697 -0.627 . . . . 0.0 109.452 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -62.28 -29.9 70.75 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.763 -0.586 . . . . 0.0 109.767 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -61.97 -44.97 95.62 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.707 -0.62 . . . . 0.0 109.886 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -63.1 -37.9 89.06 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.698 -0.626 . . . . 0.0 109.82 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.4 tp -73.22 -36.22 66.44 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.612 -0.68 . . . . 0.0 109.719 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.604 ' HG2' HD11 ' A' ' 62' ' ' LEU . 6.1 mt-10 -76.33 -30.62 57.75 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.599 -0.688 . . . . 0.0 109.76 179.639 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -78.64 -29.85 46.06 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.591 -0.693 . . . . 0.0 109.702 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.7 -28.2 55.8 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.628 -0.67 . . . . 0.0 109.952 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -76.0 -26.61 56.89 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.636 -0.665 . . . . 0.0 110.192 179.814 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -85.63 -26.14 26.22 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.55 -0.719 . . . . 0.0 110.263 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -59.9 166.52 3.51 Favored Pre-proline 0 N--CA 1.496 1.873 0 O-C-N 121.501 -0.749 . . . . 0.0 110.22 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo . . . . . 0 C--N 1.318 -1.073 0 O-C-N 123.369 1.194 . . . . 0.0 110.407 179.976 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.182 0.515 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.8 ptpt -62.87 -164.33 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.545 -0.722 . . . . 0.0 110.171 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 53.51 27.9 7.08 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.33 -0.856 . . . . 0.0 110.73 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.1 mtp -145.79 -53.25 0.26 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.551 -0.718 . . . . 0.0 110.141 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -60.98 -28.0 68.69 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.684 -0.635 . . . . 0.0 110.039 179.762 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -69.6 -29.43 66.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.672 -0.643 . . . . 0.0 109.928 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -66.06 -41.72 90.41 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.604 -0.685 . . . . 0.0 109.973 179.716 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.7 mtm -71.84 -30.84 65.89 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.585 -0.697 . . . . 0.0 109.631 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.65 -28.28 63.65 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.745 -0.597 . . . . 0.0 109.767 179.377 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.808 HD11 ' HG2' ' B' ' 201' ' ' GLU . 7.6 tt -68.06 -29.32 68.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.61 -0.681 . . . . 0.0 110.019 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -66.45 -39.33 88.79 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.6 -0.688 . . . . 0.0 109.93 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -71.95 -29.88 64.73 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.729 -0.607 . . . . 0.0 109.811 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 74.9 m -73.06 -29.77 63.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.625 -0.672 . . . . 0.0 109.884 179.658 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.79 -27.47 63.93 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.568 -0.707 . . . . 0.0 110.1 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -76.11 -28.1 57.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.508 -0.745 . . . . 0.0 110.235 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 72.8 tp60 -77.7 -33.24 53.24 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.566 -0.709 . . . . 0.0 109.852 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.62 HG12 HD22 ' B' ' 193' ' ' LEU . 68.1 mt -74.12 -28.42 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.718 -0.613 . . . . 0.0 109.577 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.24 -37.22 66.44 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.547 -0.72 . . . . 0.0 109.647 179.537 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.9 tptt -62.8 -29.58 70.82 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.535 -0.728 . . . . 0.0 109.633 179.443 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.629 HD22 HG12 ' B' ' 190' ' ' ILE . 10.9 mt -61.47 -29.6 70.07 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.684 -0.635 . . . . 0.0 109.903 179.593 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.2 -38.55 89.57 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.6 -0.688 . . . . 0.0 109.719 179.603 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.04 -31.68 58.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.636 -0.665 . . . . 0.0 109.268 179.259 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -75.38 -31.97 60.65 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.763 -0.585 . . . . 0.0 109.702 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.439 HD13 HD12 ' B' ' 190' ' ' ILE . 22.3 tp -76.36 -31.41 58.05 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.606 -0.684 . . . . 0.0 109.647 179.469 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 tp -74.81 -33.95 62.29 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 120.263 -0.575 . . . . 0.0 109.61 179.485 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.4 -31.42 69.77 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.721 -0.612 . . . . 0.0 109.735 179.581 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.405 ' HA ' HD13 ' A' ' 79' ' ' LEU . 1.2 mm? -70.34 -44.01 69.04 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.678 -0.639 . . . . 0.0 109.668 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.441 ' NE2' HG21 ' B' ' 183' ' ' ILE . 32.7 mm-40 -66.42 -30.5 70.87 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.715 179.505 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -67.77 -31.7 71.77 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.682 -0.636 . . . . 0.0 109.779 179.709 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.07 -44.72 88.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.614 -0.679 . . . . 0.0 109.636 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.3 tttm -64.05 -28.82 70.05 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 120.044 -0.662 . . . . 0.0 109.543 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -65.78 -28.69 69.2 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.689 -0.632 . . . . 0.0 110.118 179.749 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -37.51 78.62 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.526 -0.734 . . . . 0.0 109.748 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.561 HD23 ' CD1' ' B' ' 172' ' ' LEU . 2.6 mt -62.87 -29.06 70.46 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.663 -0.648 . . . . 0.0 109.845 179.635 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -62.14 -42.32 99.13 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.5 -0.75 . . . . 0.0 109.508 179.64 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.86 -30.58 69.12 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-O 121.382 0.61 . . . . 0.0 109.515 179.152 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -85.9 -19.54 30.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.675 -0.641 . . . . 0.0 110.53 179.565 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.823 HD11 HD11 ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.03 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.712 -179.815 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.872 HD13 ' CB ' ' B' ' 171' ' ' GLU . 0.1 OUTLIER -131.19 -63.17 0.86 Allowed 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.616 -0.932 . . . . 0.0 109.158 179.95 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 4.2 m -144.56 37.08 1.2 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 121.343 0.592 . . . . 0.0 109.559 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 17.0 tptt 51.92 25.74 3.25 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.483 -0.761 . . . . 0.0 110.17 -179.009 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -146.7 -45.11 0.18 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.661 -0.649 . . . . 0.0 109.953 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.872 ' CB ' HD13 ' B' ' 167' ' ' LEU . 5.3 mm-40 -64.62 -32.43 74.08 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.554 -0.859 . . . . 0.0 109.148 179.399 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.654 HD23 HD11 ' B' ' 167' ' ' LEU . 0.1 OUTLIER -80.35 -28.35 38.09 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.583 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.823 HD11 HD11 ' A' ' 90' ' ' LEU . 47.2 mm -73.9 -30.7 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.641 -0.662 . . . . 0.0 109.623 179.698 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -73.69 -29.26 62.18 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.619 -0.676 . . . . 0.0 110.13 179.897 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.5 ' O ' HG23 ' B' ' 179' ' ' VAL . 42.6 m-20 -73.35 -27.54 61.55 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.603 -0.685 . . . . 0.0 110.204 179.875 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.799 ' HE3' HD23 ' A' ' 90' ' ' LEU . 1.2 mtt -74.51 -28.94 61.21 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.553 -0.717 . . . . 0.0 110.276 179.95 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.77 -28.42 55.67 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.577 -0.702 . . . . 0.0 110.163 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 8.4 ttp180 -77.93 -34.45 51.24 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.595 -0.69 . . . . 0.0 109.918 179.861 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 175' ' ' ASN . 84.2 t -73.58 -29.17 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.671 -0.643 . . . . 0.0 109.479 179.445 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -68.82 -29.56 67.93 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.69 -0.631 . . . . 0.0 109.919 179.592 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 30.8 mtp180 -75.39 -27.78 59.21 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.59 -0.694 . . . . 0.0 109.969 179.681 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -75.49 -34.27 60.85 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.557 -0.715 . . . . 0.0 110.064 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.441 HG21 ' NE2' ' A' ' 80' ' ' GLN . 88.1 mt -71.49 -28.76 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.824 179.675 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -33.53 71.94 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.584 -0.697 . . . . 0.0 109.771 179.555 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 5.0 ttm -69.53 -45.49 68.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.651 -0.656 . . . . 0.0 109.856 179.794 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 61.6 t -70.18 -31.03 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.609 -0.682 . . . . 0.0 109.611 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -74.91 -28.98 60.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.672 -0.643 . . . . 0.0 109.876 179.598 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -73.3 -28.94 62.38 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.607 -0.683 . . . . 0.0 110.001 179.747 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -35.55 65.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.662 -0.649 . . . . 0.0 110.013 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.629 HG12 HD22 ' A' ' 72' ' ' LEU . 77.2 mt -70.57 -29.76 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.628 -0.67 . . . . 0.0 109.834 179.931 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.12 -39.66 68.67 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.672 -0.643 . . . . 0.0 109.791 179.664 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -73.92 -30.81 62.77 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.598 -0.689 . . . . 0.0 109.487 179.481 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.626 HD13 HD11 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -72.11 -31.03 65.66 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.614 -0.679 . . . . 0.0 109.38 179.282 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -46.63 66.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.602 -0.686 . . . . 0.0 109.456 179.411 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -68.03 -31.54 71.28 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.597 -0.689 . . . . 0.0 109.203 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.41 ' HE2' HD23 ' B' ' 193' ' ' LEU . 15.3 ttpt -65.7 -33.34 75.66 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.703 -0.623 . . . . 0.0 109.436 179.267 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -65.16 -29.98 70.86 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.751 -0.593 . . . . 0.0 109.707 179.544 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -62.83 -42.5 99.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.65 -0.656 . . . . 0.0 109.916 179.743 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -61.13 -45.46 94.57 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.67 -0.644 . . . . 0.0 109.927 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 13.4 tp -72.2 -30.14 64.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.581 -0.7 . . . . 0.0 109.673 179.638 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.808 ' HG2' HD11 ' A' ' 62' ' ' LEU . 6.0 mt-10 -79.15 -30.63 43.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.622 -0.674 . . . . 0.0 109.725 179.587 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -78.82 -30.28 45.23 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.72 -0.613 . . . . 0.0 109.701 179.547 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -76.85 -29.48 55.89 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.66 -0.65 . . . . 0.0 109.66 179.401 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -72.0 -29.74 64.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.656 -0.653 . . . . 0.0 109.765 179.569 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -113.86 26.32 10.44 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.619 -0.675 . . . . 0.0 110.184 179.738 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 11.5 tptt -80.85 135.29 52.15 Favored Pre-proline 0 N--CA 1.494 1.774 0 O-C-N 121.434 -0.791 . . . . 0.0 110.096 179.988 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo . . . . . 0 C--N 1.318 -1.037 0 O-C-N 123.195 1.103 . . . . 0.0 110.405 179.936 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.115 0.484 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.2 mttt -136.47 159.44 41.78 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.65 -0.656 . . . . 0.0 110.185 -179.953 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -65.89 -23.99 66.76 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.662 -0.649 . . . . 0.0 110.488 179.978 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.9 ttm -76.0 -28.3 57.75 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.555 -0.716 . . . . 0.0 110.306 -179.968 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -63.07 -29.63 70.97 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.573 -0.705 . . . . 0.0 110.118 -179.988 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.07 -28.66 64.51 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.599 -0.688 . . . . 0.0 110.071 179.84 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -69.55 -29.27 66.81 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.588 -0.695 . . . . 0.0 110.08 179.874 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -67.35 -37.08 82.67 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.54 -0.725 . . . . 0.0 109.954 179.84 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 53.6 p -69.5 -29.81 67.53 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.67 -0.643 . . . . 0.0 109.735 179.612 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.598 HD11 ' OE1' ' B' ' 197' ' ' GLN . 4.1 tp -68.53 -28.91 67.41 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.59 -0.694 . . . . 0.0 109.973 179.632 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.29 -38.79 88.58 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.552 -0.717 . . . . 0.0 110.035 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -73.44 -36.41 65.92 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.725 -0.609 . . . . 0.0 109.704 179.575 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.629 HG21 ' NZ ' ' B' ' 196' ' ' LYS . 90.8 m -74.06 -31.03 62.69 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.697 -0.627 . . . . 0.0 109.517 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -70.88 -26.67 63.35 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.677 -0.639 . . . . 0.0 109.965 179.51 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -69.11 -35.61 76.61 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.554 -0.716 . . . . 0.0 110.206 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -75.95 -37.06 59.05 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.551 -0.718 . . . . 0.0 109.681 179.665 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.443 HG12 HD22 ' B' ' 193' ' ' LEU . 90.1 mt -71.96 -26.61 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.692 -0.63 . . . . 0.0 109.603 179.256 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.4 tt -70.73 -37.21 73.47 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.493 -0.755 . . . . 0.0 109.884 179.591 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -67.85 -38.04 82.64 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.613 -0.679 . . . . 0.0 109.688 179.649 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.632 HD22 ' CG1' ' B' ' 190' ' ' ILE . 5.4 mt -63.95 -29.6 70.75 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.733 -0.604 . . . . 0.0 109.898 179.714 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.454 ' O ' HD23 ' A' ' 77' ' ' LEU . 2.9 mt-10 -65.22 -38.34 90.12 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.645 -0.659 . . . . 0.0 109.798 179.767 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -73.36 -32.87 64.76 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.383 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.9 tttt -69.76 -36.37 75.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.68 -0.638 . . . . 0.0 109.593 179.529 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.401 HD13 HD12 ' B' ' 190' ' ' ILE . 32.1 tp -70.39 -30.01 66.79 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.626 -0.671 . . . . 0.0 109.731 179.421 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 73' ' ' GLU . 1.9 mm? -73.29 -37.76 66.13 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.716 -0.615 . . . . 0.0 109.727 179.625 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.16 -30.26 70.19 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.716 -0.615 . . . . 0.0 109.826 179.675 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.767 HD23 ' HA ' ' B' ' 183' ' ' ILE . 3.3 mp -70.99 -43.79 67.27 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.687 -0.633 . . . . 0.0 109.829 179.863 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -66.2 -29.59 69.88 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.618 -0.676 . . . . 0.0 109.785 179.755 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -68.78 -30.5 69.1 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.572 -0.705 . . . . 0.0 109.77 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -48.72 56.81 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.635 -0.666 . . . . 0.0 109.777 179.729 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -63.69 -30.34 71.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.556 -0.715 . . . . 0.0 109.591 179.462 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -65.59 -34.6 78.62 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.676 -0.64 . . . . 0.0 109.817 179.613 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.444 ' HA ' HD12 ' A' ' 88' ' ' LEU . 29.8 tp60 -67.25 -37.76 84.05 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.725 -0.609 . . . . 0.0 109.713 179.61 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.635 HD23 HD21 ' B' ' 172' ' ' LEU . 1.3 mt -62.3 -38.45 89.44 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.646 -0.659 . . . . 0.0 109.762 179.66 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -60.9 -42.58 98.29 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.544 -0.722 . . . . 0.0 109.963 179.917 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 85' ' ' GLN . 15.8 mt -67.47 -30.08 69.7 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.742 -0.599 . . . . 0.0 109.676 179.465 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.53 -15.7 34.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.689 -0.632 . . . . 0.0 110.692 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.653 HD13 ' HE3' ' B' ' 176' ' ' MET . 30.5 tp . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.521 -179.859 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.593 HD12 ' N ' ' B' ' 168' ' ' SER . 1.6 pp -50.32 -46.37 55.51 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.793 -0.827 . . . . 0.0 111.607 179.868 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.593 ' N ' HD12 ' B' ' 167' ' ' LEU . 34.8 t -151.74 16.36 0.68 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.258 -0.902 . . . . 0.0 111.115 -179.987 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 169' ' ' LYS . . . . . 0.473 ' C ' HD13 ' B' ' 173' ' ' ILE . 26.0 tptt 49.94 26.36 1.97 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.131 -0.981 . . . . 0.0 111.021 -179.96 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -153.37 -46.4 0.09 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.648 -0.657 . . . . 0.0 110.03 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.587 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -74.64 -30.29 61.58 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.904 -0.718 . . . . 0.0 109.294 179.59 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.635 HD21 HD23 ' A' ' 86' ' ' LEU . 1.3 tt -79.13 -28.88 42.93 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.711 -0.618 . . . . 0.0 109.672 179.117 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.648 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.3 mp -76.82 -35.25 24.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -64.44 -31.39 72.58 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.905 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.807 ' O ' HG23 ' B' ' 179' ' ' VAL . 77.2 m-20 -75.83 -34.58 60.11 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.109 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.653 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -68.48 -31.76 71.28 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.645 179.524 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -76.93 -30.65 56.19 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.545 -0.722 . . . . 0.0 109.851 179.588 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 -74.8 -30.11 61.31 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.661 -0.65 . . . . 0.0 109.781 179.579 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.807 HG23 ' O ' ' B' ' 175' ' ' ASN . 66.5 t -72.12 -29.47 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.691 -0.63 . . . . 0.0 109.831 179.843 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.94 -31.38 67.95 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.543 -0.723 . . . . 0.0 109.985 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -30.03 63.61 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.739 -0.601 . . . . 0.0 109.828 179.746 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 47.6 tt0 -74.04 -41.17 62.19 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.639 -0.663 . . . . 0.0 109.901 179.716 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.767 ' HA ' HD23 ' A' ' 79' ' ' LEU . 84.0 mt -67.89 -28.37 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.674 -0.641 . . . . 0.0 109.505 179.482 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 35.2 m -66.74 -32.13 73.23 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.55 -0.719 . . . . 0.0 109.691 179.475 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.4 mtt -67.28 -50.28 60.97 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.716 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.9 t -65.13 -30.25 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.653 -0.655 . . . . 0.0 109.565 179.568 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -71.12 -29.61 65.46 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.672 -0.643 . . . . 0.0 109.932 179.734 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -30.5 69.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.618 -0.676 . . . . 0.0 109.861 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -37.42 56.75 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.604 -0.685 . . . . 0.0 109.612 179.689 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.632 ' CG1' HD22 ' A' ' 72' ' ' LEU . 70.9 mt -73.38 -28.98 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.651 -0.656 . . . . 0.0 109.593 179.673 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.2 m -73.18 -34.29 65.92 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.544 -0.722 . . . . 0.0 109.548 179.508 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -37.38 62.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.677 -0.639 . . . . 0.0 109.491 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.443 HD22 HG12 ' A' ' 69' ' ' ILE . 0.5 OUTLIER -69.54 -30.69 68.56 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.58 -0.7 . . . . 0.0 109.403 179.238 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -67.49 -42.93 82.1 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.633 -0.667 . . . . 0.0 109.663 179.54 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -68.74 -33.54 74.09 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.577 -0.702 . . . . 0.0 109.338 179.397 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.629 ' NZ ' HG21 ' A' ' 65' ' ' THR . 0.9 OUTLIER -64.42 -32.62 74.31 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.032 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 197' ' ' GLN . . . . . 0.598 ' OE1' HD11 ' A' ' 62' ' ' LEU . 6.8 mm-40 -65.49 -30.24 70.98 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.477 179.288 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -60.48 -42.47 96.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.684 -0.635 . . . . 0.0 109.868 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -45.42 93.6 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.679 -0.638 . . . . 0.0 109.689 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.429 HD23 HD12 ' A' ' 62' ' ' LEU . 5.0 tp -72.95 -30.9 64.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.707 -0.621 . . . . 0.0 109.422 179.231 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -77.0 -28.58 55.11 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.69 -0.631 . . . . 0.0 109.928 179.511 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -76.95 -28.89 55.35 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.605 -0.685 . . . . 0.0 109.99 179.836 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -78.65 -28.91 45.54 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.472 -0.768 . . . . 0.0 110.042 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -80.23 -27.86 38.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.642 -0.661 . . . . 0.0 110.208 179.795 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -90.0 -27.23 19.89 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.584 -0.697 . . . . 0.0 110.285 179.894 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -70.96 151.89 95.01 Favored Pre-proline 0 N--CA 1.495 1.783 0 O-C-N 121.505 -0.747 . . . . 0.0 110.213 179.938 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.317 -1.089 0 O-C-N 123.449 1.236 . . . . 0.0 110.42 179.943 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.6 tttt . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.099 0.476 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.2 mttt -85.22 -169.47 2.66 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.604 -0.685 . . . . 0.0 110.162 179.956 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -67.83 -29.11 68.18 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.585 -0.697 . . . . 0.0 110.149 -179.99 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.2 mmm -61.84 -28.19 69.31 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.623 -0.673 . . . . 0.0 110.235 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -71.8 -28.25 63.47 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.582 -0.699 . . . . 0.0 110.219 -179.976 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -72.23 -32.87 67.12 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.648 -0.657 . . . . 0.0 110.184 179.985 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 ttp180 -69.06 -30.09 68.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.682 -0.636 . . . . 0.0 109.902 179.717 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 10.3 mmt -66.28 -30.33 70.73 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.663 -0.648 . . . . 0.0 109.841 179.667 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 t -62.72 -29.93 71.04 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.727 -0.608 . . . . 0.0 109.926 179.695 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.923 HD12 HD23 ' B' ' 200' ' ' LEU . 18.6 tp -62.26 -28.94 70.06 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.628 -0.67 . . . . 0.0 110.046 179.791 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.82 -32.61 69.72 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.555 -0.716 . . . . 0.0 110.02 179.964 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -75.16 -34.19 61.57 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.638 -0.664 . . . . 0.0 109.816 179.669 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.414 HG21 ' OE1' ' B' ' 197' ' ' GLN . 35.9 m -73.53 -30.41 63.06 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.703 -0.623 . . . . 0.0 109.677 179.608 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -71.59 -27.76 63.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.611 -0.68 . . . . 0.0 110.05 179.611 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -70.0 -30.19 67.45 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.571 -0.706 . . . . 0.0 110.156 179.886 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.41 -37.14 60.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.578 -0.701 . . . . 0.0 109.914 179.797 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.447 HD12 HE21 ' B' ' 197' ' ' GLN . 84.9 mt -70.26 -27.77 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.671 -0.643 . . . . 0.0 109.697 179.611 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 21.4 tp -69.75 -35.06 74.64 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.563 -0.711 . . . . 0.0 109.895 179.679 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -67.98 -28.78 67.73 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.526 -0.734 . . . . 0.0 109.911 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.728 HD22 HG12 ' B' ' 190' ' ' ILE . 11.7 mt -68.57 -31.4 70.58 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.599 -0.688 . . . . 0.0 110.108 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -66.42 -37.31 84.92 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.583 -0.698 . . . . 0.0 110.039 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -74.9 -28.53 60.67 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.608 -0.682 . . . . 0.0 109.916 179.662 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -77.53 -29.8 52.52 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.64 -0.662 . . . . 0.0 109.899 179.78 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.1 tp -77.05 -30.71 55.73 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.602 -0.686 . . . . 0.0 109.97 179.837 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.4 mt -79.3 -31.03 43.16 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.625 -0.672 . . . . 0.0 109.74 179.666 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -77.08 -28.4 54.57 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.699 -0.625 . . . . 0.0 109.827 179.487 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.764 HD23 ' HA ' ' B' ' 183' ' ' ILE . 6.8 tp -76.06 -33.75 59.59 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.62 -0.675 . . . . 0.0 109.918 179.704 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -72.45 -31.16 65.22 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.578 -0.701 . . . . 0.0 109.586 179.372 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -67.89 -29.04 68.05 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.719 -0.613 . . . . 0.0 109.787 179.416 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.17 -44.98 82.48 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.544 -0.722 . . . . 0.0 109.864 179.772 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -62.89 -29.48 70.8 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.568 -0.707 . . . . 0.0 109.799 179.686 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -65.69 -38.59 89.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.616 -0.678 . . . . 0.0 109.844 179.721 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -64.99 -46.64 80.6 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.656 -0.653 . . . . 0.0 109.67 179.596 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.817 HD11 ' HB3' ' B' ' 175' ' ' ASN . 0.4 OUTLIER -61.52 -29.28 69.89 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.645 -0.659 . . . . 0.0 109.776 179.493 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.38 -35.58 81.36 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.59 -0.694 . . . . 0.0 109.537 179.619 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.93 -30.59 64.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.724 -0.61 . . . . 0.0 109.409 179.294 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.411 ' HB3' HD11 ' B' ' 172' ' ' LEU . 2.6 tt0 -75.44 -18.51 59.86 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.711 -0.618 . . . . 0.0 110.494 179.55 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.553 HD11 ' CD1' ' B' ' 173' ' ' ILE . 28.0 tp . . . . . 0 N--CA 1.5 2.068 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.643 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.881 HD13 ' CB ' ' B' ' 171' ' ' GLU . 0.2 OUTLIER -126.96 -62.91 1.09 Allowed 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.537 -0.978 . . . . 0.0 109.132 179.901 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 9.0 t -144.36 37.2 1.23 Allowed 'General case' 0 N--CA 1.489 1.484 0 CA-C-O 121.238 0.542 . . . . 0.0 109.576 179.747 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 10.1 tptt 51.76 26.14 3.32 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.569 -0.707 . . . . 0.0 110.138 -178.976 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -147.19 -44.99 0.17 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.691 -0.63 . . . . 0.0 109.834 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.881 ' CB ' HD13 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -65.12 -32.32 73.97 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.383 179.599 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.595 HD23 HD11 ' B' ' 167' ' ' LEU . 0.1 OUTLIER -79.45 -27.34 41.64 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.438 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.553 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.6 mm -70.07 -30.37 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.629 -0.67 . . . . 0.0 109.605 179.501 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -74.93 -27.82 60.36 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.566 -0.709 . . . . 0.0 110.225 179.97 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.817 ' HB3' HD11 ' A' ' 86' ' ' LEU . 55.3 m-20 -77.37 -29.42 53.26 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.543 -0.723 . . . . 0.0 110.14 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.522 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -76.99 -29.64 55.58 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.627 -0.671 . . . . 0.0 109.93 179.771 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.08 -29.37 54.94 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.66 -0.65 . . . . 0.0 110.026 179.914 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.11 -29.05 54.62 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.547 -0.72 . . . . 0.0 109.971 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.723 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.3 t -76.04 -29.32 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.582 -0.699 . . . . 0.0 109.792 179.701 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -74.69 -28.64 60.91 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.608 -0.682 . . . . 0.0 110.176 179.89 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -29.2 60.82 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.609 -0.682 . . . . 0.0 110.026 179.925 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 182' ' ' GLU . . . . . 0.54 ' O ' HG23 ' B' ' 186' ' ' VAL . 8.1 tt0 -76.6 -36.18 57.66 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.61 -0.681 . . . . 0.0 110.058 179.833 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.764 ' HA ' HD23 ' A' ' 79' ' ' LEU . 87.6 mt -73.77 -27.88 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.715 -0.616 . . . . 0.0 109.762 179.604 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 29.5 m -73.98 -33.02 63.69 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.502 -0.748 . . . . 0.0 109.769 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 2.9 tpt -76.6 -36.75 57.31 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.626 -0.671 . . . . 0.0 109.585 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 186' ' ' VAL . . . . . 0.54 HG23 ' O ' ' B' ' 182' ' ' GLU . 73.1 t -75.15 -31.17 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.689 -0.632 . . . . 0.0 109.455 179.343 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -74.74 -29.17 61.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.644 -0.66 . . . . 0.0 109.847 179.678 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -73.72 -29.55 62.32 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.621 -0.674 . . . . 0.0 109.937 179.726 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -71.53 -35.43 70.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.706 -0.621 . . . . 0.0 109.819 179.798 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.728 HG12 HD22 ' A' ' 72' ' ' LEU . 79.0 mt -68.74 -37.89 78.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.576 -0.703 . . . . 0.0 109.849 179.832 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 56.1 p -66.9 -35.07 79.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.629 -0.67 . . . . 0.0 109.446 179.442 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 6.2 mmmm -75.86 -36.05 59.71 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.316 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.66 HD23 ' HE2' ' B' ' 196' ' ' LYS . 0.3 OUTLIER -75.81 -14.61 60.3 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.682 -0.636 . . . . 0.0 110.458 179.358 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.9 tppt? -87.08 -29.25 22.03 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.238 -0.914 . . . . 0.0 109.355 179.334 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -76.53 -35.15 58.46 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 120.192 -0.603 . . . . 0.0 109.88 179.475 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.66 ' HE2' HD23 ' B' ' 193' ' ' LEU . 0.0 OUTLIER -69.77 -28.04 65.42 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 119.769 -0.773 . . . . 0.0 109.555 179.41 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 197' ' ' GLN . . . . . 0.447 HE21 HD12 ' A' ' 69' ' ' ILE . 4.9 tp60 -72.04 -30.28 65.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.597 -0.689 . . . . 0.0 109.223 179.032 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -35.79 80.55 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.73 -0.606 . . . . 0.0 109.786 179.637 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.06 -44.24 94.85 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.523 -0.736 . . . . 0.0 109.045 179.096 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.923 HD23 HD12 ' A' ' 62' ' ' LEU . 18.0 tp -68.02 -29.06 67.97 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.355 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -32.99 74.76 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.72 -0.613 . . . . 0.0 109.872 179.505 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -75.72 -30.07 59.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 110.046 179.928 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.03 -30.11 43.98 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.618 -0.676 . . . . 0.0 109.985 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -81.06 -27.68 35.61 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.672 -0.642 . . . . 0.0 110.025 179.718 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -96.11 -26.56 15.44 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.562 -0.711 . . . . 0.0 110.307 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 18.4 mmtm 52.86 69.42 2.36 Favored Pre-proline 0 N--CA 1.501 2.084 0 O-C-N 121.412 -0.805 . . . . 0.0 110.692 179.948 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 C--N 1.317 -1.117 0 O-C-N 123.35 1.184 . . . . 0.0 110.343 -179.983 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 33.2 mttp . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.071 0.462 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -130.99 178.02 7.0 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.534 -0.729 . . . . 0.0 110.19 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 52.14 25.96 3.59 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.484 -0.76 . . . . 0.0 110.886 179.975 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.6 mtm -160.48 -43.88 0.05 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.54 -0.725 . . . . 0.0 110.08 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -68.33 -28.39 67.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.62 -0.675 . . . . 0.0 110.096 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -75.24 -29.66 60.29 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.544 -0.722 . . . . 0.0 110.026 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.3 mtt85 -74.27 -30.54 62.16 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.594 -0.691 . . . . 0.0 109.959 179.881 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.7 mtt -71.49 -30.16 65.65 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.672 -0.642 . . . . 0.0 109.768 179.693 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 5.1 p -67.5 -29.51 68.95 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.601 -0.687 . . . . 0.0 109.912 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.531 HD21 ' HG2' ' B' ' 201' ' ' GLU . 0.9 OUTLIER -65.1 -30.27 71.2 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.597 -0.69 . . . . 0.0 109.95 179.795 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -76.05 -31.98 59.08 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.655 -0.653 . . . . 0.0 109.933 179.82 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.28 -34.71 59.1 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.716 -0.615 . . . . 0.0 109.675 179.565 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.1 m -74.82 -34.17 62.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.651 -0.656 . . . . 0.0 109.454 179.4 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.529 ' HA ' HD12 ' A' ' 69' ' ' ILE . 26.4 mttt -69.68 -27.78 65.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.686 -0.634 . . . . 0.0 109.746 179.405 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -67.19 -34.55 77.75 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.513 -0.742 . . . . 0.0 109.912 179.726 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -76.24 -32.44 58.88 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.661 -0.649 . . . . 0.0 109.557 179.544 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.778 HG12 HD22 ' B' ' 193' ' ' LEU . 75.1 mt -72.66 -28.3 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.719 -0.613 . . . . 0.0 109.557 179.335 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 tt -69.27 -38.4 78.37 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.621 -0.674 . . . . 0.0 109.846 179.659 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.2 tmtm? -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.592 -0.693 . . . . 0.0 109.846 179.728 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.641 HD12 ' CG1' ' B' ' 190' ' ' ILE . 1.7 mm? -64.55 -32.84 74.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.711 -0.618 . . . . 0.0 109.912 179.79 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -38.89 91.71 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.594 -0.691 . . . . 0.0 109.83 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.34 -32.07 64.34 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.642 -0.662 . . . . 0.0 109.518 179.455 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.3 tptm -73.19 -33.63 65.52 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.717 -0.614 . . . . 0.0 109.659 179.577 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 20.8 tp -76.02 -32.09 59.2 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.671 -0.643 . . . . 0.0 109.587 179.491 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -76.73 -34.48 58.11 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.747 -0.596 . . . . 0.0 109.558 179.396 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.42 -29.14 62.38 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.708 -0.62 . . . . 0.0 109.79 179.472 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.738 HD23 ' HA ' ' B' ' 183' ' ' ILE . 8.1 tp -75.8 -36.6 59.69 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.662 -0.649 . . . . 0.0 109.817 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.403 ' HA ' ' HG2' ' A' ' 83' ' ' LYS . 20.1 tt0 -76.2 -23.09 54.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.68 -0.637 . . . . 0.0 110.138 179.439 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -81.32 -26.75 35.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.455 -0.778 . . . . 0.0 109.573 179.187 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -76.43 -41.46 47.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.577 -0.702 . . . . 0.0 110.003 179.632 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.403 ' HG2' ' HA ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -68.28 -24.84 64.92 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.627 179.339 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -66.29 -31.04 71.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.552 -0.717 . . . . 0.0 109.446 179.184 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.01 -31.46 72.6 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.616 -0.677 . . . . 0.0 109.595 179.465 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.437 HD21 HD23 ' B' ' 172' ' ' LEU . 0.3 OUTLIER -68.07 -34.96 77.41 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.672 -0.643 . . . . 0.0 109.755 179.548 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -61.87 -36.36 81.02 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.596 -0.69 . . . . 0.0 109.975 179.684 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 tp -64.16 -29.86 70.95 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.677 -0.64 . . . . 0.0 109.95 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -82.41 -13.1 57.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.652 -0.655 . . . . 0.0 110.799 179.822 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.847 HD13 ' HE3' ' B' ' 176' ' ' MET . 38.5 tp . . . . . 0 N--CA 1.501 2.098 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.598 -179.946 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 166' ' ' GLY . . . . . 0.552 ' HA2' HD12 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.784 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.1 OUTLIER -118.98 -63.13 1.44 Allowed 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.583 -0.951 . . . . 0.0 108.946 -179.957 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.6 t -152.83 33.55 0.49 Allowed 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.277 0.56 . . . . 0.0 109.543 179.684 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 9.6 tptm 51.34 26.73 3.22 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.515 -0.741 . . . . 0.0 110.072 -179.065 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -149.03 -43.21 0.14 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.633 -0.667 . . . . 0.0 110.339 -179.785 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.706 ' HB3' HD22 ' B' ' 167' ' ' LEU . 0.2 OUTLIER -62.0 -40.83 96.98 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.667 179.77 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.784 ' HG ' HD11 ' B' ' 167' ' ' LEU . 1.4 mt -76.18 -28.53 57.33 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.464 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.8 mm -67.5 -31.06 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.328 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -75.53 -32.73 60.58 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.714 179.766 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -73.78 -35.0 64.89 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.67 -0.644 . . . . 0.0 109.566 179.45 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.847 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.8 OUTLIER -67.44 -29.54 69.04 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.729 -0.607 . . . . 0.0 109.966 179.628 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -77.17 -25.34 51.8 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.625 -0.672 . . . . 0.0 110.132 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -77.86 -31.5 51.45 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.562 -0.711 . . . . 0.0 110.194 179.961 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.535 HG22 ' O ' ' B' ' 176' ' ' MET . 34.5 m -77.21 -24.53 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.573 -0.705 . . . . 0.0 110.294 179.966 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -82.44 -29.71 30.5 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.405 -0.809 . . . . 0.0 109.836 179.653 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -77.49 -27.93 52.03 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.696 -0.627 . . . . 0.0 109.842 179.576 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -77.54 -34.54 53.86 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.537 -0.727 . . . . 0.0 110.021 179.705 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.738 ' HA ' HD23 ' A' ' 79' ' ' LEU . 76.9 mt -74.26 -27.0 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.551 -0.718 . . . . 0.0 109.692 179.574 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 28.1 m -71.61 -31.43 66.89 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.525 -0.735 . . . . 0.0 109.552 179.256 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.26 -44.37 53.17 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.61 -0.681 . . . . 0.0 109.497 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 70.5 t -71.45 -31.83 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.679 -0.638 . . . . 0.0 109.289 179.331 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -72.99 -29.06 62.75 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.704 -0.623 . . . . 0.0 109.797 179.565 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -72.43 -32.17 66.09 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.677 -0.639 . . . . 0.0 109.918 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.46 -29.85 67.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.715 -0.616 . . . . 0.0 109.983 179.803 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.641 ' CG1' HD12 ' A' ' 72' ' ' LEU . 79.7 mt -73.95 -30.27 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.602 -0.686 . . . . 0.0 109.762 179.775 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 97.7 p -71.73 -40.28 69.53 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.627 -0.671 . . . . 0.0 109.519 179.315 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 9.8 mtpp -71.35 -30.19 65.87 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.589 -0.695 . . . . 0.0 109.455 179.341 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.778 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -71.19 -37.65 72.13 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.668 -0.645 . . . . 0.0 109.341 179.366 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.93 -42.37 97.39 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.625 -0.672 . . . . 0.0 109.486 179.453 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.04 -30.64 71.2 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.46 179.337 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.574 ' HE2' HD23 ' B' ' 193' ' ' LEU . 28.5 ttpt -64.35 -34.31 77.85 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.686 -0.634 . . . . 0.0 109.33 179.296 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 197' ' ' GLN . . . . . 0.478 ' HG2' HD11 ' A' ' 69' ' ' ILE . 4.0 mm-40 -64.49 -31.35 72.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.77 -0.581 . . . . 0.0 109.465 179.38 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -60.22 -40.47 90.27 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.655 -0.653 . . . . 0.0 109.894 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -62.03 -39.64 93.0 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 120.286 -0.566 . . . . 0.0 109.793 179.605 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.78 -31.88 65.2 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.689 -0.632 . . . . 0.0 109.59 179.575 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.531 ' HG2' HD21 ' A' ' 62' ' ' LEU . 4.8 mm-40 -77.41 -34.61 54.7 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.623 -0.673 . . . . 0.0 109.753 179.645 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -77.64 -30.19 52.06 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.738 -0.602 . . . . 0.0 109.606 179.447 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -77.23 -27.92 53.51 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.622 -0.674 . . . . 0.0 109.897 179.513 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.4 -24.8 50.43 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.586 -0.696 . . . . 0.0 110.318 179.773 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -85.21 -28.18 25.59 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.498 -0.751 . . . . 0.0 110.063 179.882 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 17.9 mmtt -61.82 166.27 6.37 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.562 -0.711 . . . . 0.0 110.125 -179.98 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.316 -1.147 0 O-C-N 123.388 1.204 . . . . 0.0 110.361 -179.985 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.107 0.479 . . . . 0.0 110.26 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 19.9 mtpt -62.37 169.39 2.93 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.575 -0.703 . . . . 0.0 110.169 179.909 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -88.71 11.9 16.33 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.541 -0.724 . . . . 0.0 110.923 179.967 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 8.0 mtt -116.64 -30.86 5.69 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.255 -0.903 . . . . 0.0 110.439 179.961 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -66.52 -43.04 86.34 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.518 -0.739 . . . . 0.0 110.161 -179.966 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -61.66 -28.0 69.08 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.642 -0.661 . . . . 0.0 110.296 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.8 mtt-85 -69.58 -27.91 65.51 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.593 -0.692 . . . . 0.0 110.293 179.9 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.3 mmm -70.51 -29.44 65.94 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.599 -0.688 . . . . 0.0 110.145 179.883 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.11 -29.07 65.93 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.627 -0.671 . . . . 0.0 110.09 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tp -69.39 -28.03 65.83 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.67 -0.644 . . . . 0.0 110.161 179.903 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.1 tp10 -70.46 -30.16 66.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.563 -0.711 . . . . 0.0 110.111 179.985 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -73.55 -43.1 60.72 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.637 -0.664 . . . . 0.0 109.84 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.488 HG22 HD11 ' A' ' 69' ' ' ILE . 73.8 m -67.45 -30.55 70.3 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.701 -0.625 . . . . 0.0 109.596 179.503 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -67.6 -27.9 67.29 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.628 -0.67 . . . . 0.0 109.909 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.84 -40.6 91.92 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.507 -0.745 . . . . 0.0 110.119 179.872 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -73.75 -36.99 65.2 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.609 -0.682 . . . . 0.0 109.579 179.64 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.552 HG12 HD22 ' B' ' 193' ' ' LEU . 75.7 mt -73.02 -27.98 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.707 -0.62 . . . . 0.0 109.399 179.261 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.58 -34.91 72.7 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.61 -0.681 . . . . 0.0 109.764 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -62.96 -36.13 82.43 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.557 -0.714 . . . . 0.0 109.753 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.581 HD22 HG12 ' B' ' 190' ' ' ILE . 15.5 mt -63.05 -28.61 70.21 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.61 -0.681 . . . . 0.0 109.919 179.696 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.02 -41.16 99.47 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.575 -0.703 . . . . 0.0 110.002 179.822 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.46 -32.19 66.06 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.683 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -77.17 -33.97 56.4 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.728 -0.607 . . . . 0.0 109.631 179.635 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.4 tp -75.72 -29.67 59.0 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.651 -0.656 . . . . 0.0 109.706 179.454 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tt -76.27 -34.77 59.14 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.716 -0.615 . . . . 0.0 109.649 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.31 -29.69 65.32 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.634 -0.666 . . . . 0.0 109.792 179.49 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.588 HD12 ' CG1' ' B' ' 183' ' ' ILE . 0.4 OUTLIER -71.83 -40.19 69.26 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.63 -0.669 . . . . 0.0 109.725 179.736 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.45 -30.39 68.29 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.579 -0.7 . . . . 0.0 109.696 179.605 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -69.02 -29.5 67.67 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.738 -0.601 . . . . 0.0 109.769 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -65.75 -41.62 91.91 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.642 -0.661 . . . . 0.0 109.826 179.879 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -67.9 -29.69 68.84 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.59 -0.694 . . . . 0.0 109.791 179.623 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -68.29 -31.42 70.85 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.687 -0.633 . . . . 0.0 109.861 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 51.6 tp60 -68.15 -35.83 78.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.594 -0.691 . . . . 0.0 109.731 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.601 HD13 ' HA ' ' B' ' 176' ' ' MET . 2.8 mt -63.43 -32.2 73.58 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.661 -0.649 . . . . 0.0 109.851 179.702 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -61.5 -38.85 88.81 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.555 -0.716 . . . . 0.0 109.789 179.73 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 44.4 mt -73.73 -30.66 62.96 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.709 -0.619 . . . . 0.0 109.663 179.492 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -86.9 -16.99 34.32 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.59 -0.694 . . . . 0.0 110.688 179.65 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.465 HD11 ' CD1' ' B' ' 173' ' ' ILE . 53.4 tp . . . . . 0 N--CA 1.5 2.061 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.646 179.996 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.737 HD12 ' N ' ' B' ' 168' ' ' SER . 2.9 pp -139.54 -44.59 0.45 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.617 -0.931 . . . . 0.0 110.54 -179.911 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.737 ' N ' HD12 ' B' ' 167' ' ' LEU . 20.5 t -153.85 15.16 0.49 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.407 -0.808 . . . . 0.0 111.299 -179.99 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.9 tptm 49.51 26.44 1.7 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.095 -1.003 . . . . 0.0 111.059 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.63 -46.77 0.1 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.695 -0.628 . . . . 0.0 110.064 179.991 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.563 ' CB ' HD11 ' B' ' 167' ' ' LEU . 2.6 mm-40 -73.49 -37.29 65.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.575 -0.703 . . . . 0.0 109.119 179.483 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.466 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.3 tt -74.39 -27.59 60.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.746 -0.597 . . . . 0.0 109.408 178.821 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.465 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.3 mm -69.53 -33.68 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.591 -0.693 . . . . 0.0 109.277 179.388 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -70.7 -30.56 67.15 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.711 -0.618 . . . . 0.0 109.722 179.538 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -70.03 -41.37 74.37 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.68 -0.637 . . . . 0.0 109.86 179.594 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.601 ' HA ' HD13 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -62.35 -32.63 73.44 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.704 -0.623 . . . . 0.0 109.888 179.669 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -73.07 -29.41 62.93 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.71 -0.619 . . . . 0.0 109.969 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -73.03 -33.13 65.53 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.627 -0.671 . . . . 0.0 109.966 179.863 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.568 HG21 ' CD1' ' A' ' 86' ' ' LEU . 61.3 t -71.23 -30.68 41.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.622 -0.674 . . . . 0.0 109.668 179.788 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.26 -30.45 68.57 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 120.123 -0.631 . . . . 0.0 109.891 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -76.16 -28.35 57.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.678 -0.639 . . . . 0.0 109.941 179.585 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -76.35 -34.16 58.96 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.564 -0.71 . . . . 0.0 110.016 179.771 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.588 ' CG1' HD12 ' A' ' 79' ' ' LEU . 85.1 mt -74.34 -29.97 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.673 -0.642 . . . . 0.0 109.653 179.676 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 26.3 m -72.52 -30.75 64.75 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.549 -0.72 . . . . 0.0 109.778 179.479 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.4 mtp -73.64 -44.64 56.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.625 -0.672 . . . . 0.0 109.688 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -72.08 -30.84 37.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.585 -0.697 . . . . 0.0 109.399 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -74.4 -29.33 61.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.625 -0.672 . . . . 0.0 109.747 179.358 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.23 -30.95 68.15 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.695 -0.628 . . . . 0.0 109.81 179.609 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -36.04 68.9 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.632 -0.667 . . . . 0.0 109.824 179.638 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.581 HG12 HD22 ' A' ' 72' ' ' LEU . 75.7 mt -71.57 -31.05 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.687 -0.633 . . . . 0.0 109.439 179.704 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 11.5 m -68.41 -37.89 80.75 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.633 -0.667 . . . . 0.0 109.474 179.519 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 39.2 mttm -74.85 -36.25 62.35 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 120.098 -0.641 . . . . 0.0 109.37 179.349 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.552 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -72.18 -31.32 65.81 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.167 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? -67.56 -39.75 84.92 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.664 -0.648 . . . . 0.0 109.489 179.407 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -31.74 73.0 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.689 -0.632 . . . . 0.0 109.317 179.284 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -63.48 -37.03 85.75 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.71 -0.619 . . . . 0.0 109.411 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -62.05 -29.8 70.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.775 -0.578 . . . . 0.0 109.66 179.458 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -61.69 -46.28 90.39 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.683 -0.635 . . . . 0.0 109.906 179.662 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -63.87 -40.8 97.4 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.752 -0.592 . . . . 0.0 109.863 179.751 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 21.9 tp -71.71 -32.68 68.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.632 -0.668 . . . . 0.0 109.814 179.692 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -76.22 -32.49 58.95 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.569 -0.707 . . . . 0.0 109.814 179.718 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -75.07 -30.41 60.96 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.643 -0.661 . . . . 0.0 109.599 179.525 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -69.86 -30.41 67.87 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.624 -0.673 . . . . 0.0 109.571 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -63.03 -30.01 71.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.643 -0.661 . . . . 0.0 109.732 179.5 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -105.98 24.91 11.61 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.661 -0.649 . . . . 0.0 110.345 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 11.9 mttm -129.3 74.24 81.12 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.489 -0.757 . . . . 0.0 110.173 179.904 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.317 -1.08 0 O-C-N 123.31 1.163 . . . . 0.0 110.407 179.962 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.8 mttt . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.089 0.471 . . . . 0.0 110.3 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -94.04 -168.51 1.88 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.633 -0.667 . . . . 0.0 110.206 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -81.76 -27.8 33.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.615 -0.678 . . . . 0.0 110.336 179.959 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.4 mmm -70.83 -28.54 64.68 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.533 -0.729 . . . . 0.0 110.163 -179.984 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.38 -29.62 59.9 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.604 -0.685 . . . . 0.0 110.06 179.946 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -74.53 -29.08 61.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.645 -0.659 . . . . 0.0 109.984 179.814 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -73.37 -28.71 62.18 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.565 -0.709 . . . . 0.0 110.047 179.82 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.6 mtt -71.72 -29.84 64.99 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.539 -0.726 . . . . 0.0 109.972 179.824 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.0 m -68.8 -30.09 68.59 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.706 -0.621 . . . . 0.0 109.907 179.747 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.734 HD12 HD23 ' B' ' 200' ' ' LEU . 1.7 tp -65.55 -28.88 69.48 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.659 -0.651 . . . . 0.0 109.965 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -63.62 -32.19 73.59 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.653 -0.654 . . . . 0.0 110.081 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -67.8 -52.0 42.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.61 -0.681 . . . . 0.0 109.946 179.667 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.2 m -62.95 -31.92 73.12 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.701 -0.624 . . . . 0.0 109.484 179.504 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -65.46 -28.38 69.17 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.647 -0.658 . . . . 0.0 109.773 179.415 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -62.21 -42.41 99.27 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.572 -0.705 . . . . 0.0 109.935 179.814 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -75.5 -33.26 60.75 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.584 -0.698 . . . . 0.0 109.403 179.417 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -75.63 -26.52 18.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.212 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.8 tp -72.2 -34.04 68.08 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.576 -0.703 . . . . 0.0 109.825 179.657 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -66.21 -37.48 85.65 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.525 -0.735 . . . . 0.0 109.808 179.696 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.65 HD22 HG12 ' B' ' 190' ' ' ILE . 8.0 mt -64.88 -29.19 70.13 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.695 -0.628 . . . . 0.0 109.92 179.737 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.435 ' O ' HD13 ' A' ' 77' ' ' LEU . 14.3 mt-10 -66.52 -34.37 77.76 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.58 -0.7 . . . . 0.0 109.897 179.837 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -76.61 -31.83 57.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.707 -0.621 . . . . 0.0 109.558 179.589 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -76.2 -30.32 57.95 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.811 -0.555 . . . . 0.0 109.716 179.712 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.928 HD13 HD12 ' B' ' 190' ' ' ILE . 6.1 tp -77.11 -31.99 56.21 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.628 -0.67 . . . . 0.0 109.661 179.581 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.435 HD13 ' O ' ' A' ' 73' ' ' GLU . 0.7 OUTLIER -74.98 -34.6 62.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.622 -0.674 . . . . 0.0 109.558 179.502 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.85 -29.99 67.36 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.784 179.452 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.767 HD12 HG12 ' B' ' 183' ' ' ILE . 0.3 OUTLIER -71.03 -44.27 66.19 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.636 -0.665 . . . . 0.0 109.609 179.575 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -66.81 -30.85 71.14 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.588 -0.695 . . . . 0.0 109.664 179.445 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.8 -30.2 69.57 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.772 -0.58 . . . . 0.0 109.802 179.593 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.68 -44.26 86.79 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.643 -0.661 . . . . 0.0 109.805 179.765 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -62.83 -33.06 74.44 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.574 -0.704 . . . . 0.0 109.619 179.556 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -62.66 -31.26 72.1 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.703 -0.623 . . . . 0.0 109.962 179.772 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -70.9 -35.95 72.51 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.712 -0.617 . . . . 0.0 109.785 179.689 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.648 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.2 OUTLIER -64.89 -30.52 71.52 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.684 -0.635 . . . . 0.0 109.671 179.611 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -62.43 -36.46 82.47 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.661 -0.649 . . . . 0.0 109.8 179.726 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.437 HD12 ' N ' ' A' ' 88' ' ' LEU . 8.6 mp -73.07 -29.51 63.01 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.756 -0.59 . . . . 0.0 109.965 179.656 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -85.86 -23.86 26.93 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.67 -0.644 . . . . 0.0 110.345 179.829 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.522 HD22 ' CE ' ' B' ' 176' ' ' MET . 53.2 tp . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.471 -179.977 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 166' ' ' GLY . . . . . 0.441 ' HA2' HD13 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.734 HD12 ' N ' ' B' ' 168' ' ' SER . 3.0 pp -140.76 -43.65 0.39 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.607 -0.937 . . . . 0.0 110.597 -179.77 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.734 ' N ' HD12 ' B' ' 167' ' ' LEU . 33.3 t -153.21 16.55 0.55 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.344 -0.848 . . . . 0.0 111.141 179.851 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 169' ' ' LYS . . . . . 0.462 ' C ' HD13 ' B' ' 173' ' ' ILE . 10.6 tptm 49.84 26.37 1.9 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.133 -0.979 . . . . 0.0 111.12 179.982 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -154.58 -45.86 0.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.628 -0.67 . . . . 0.0 110.331 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.632 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.6 OUTLIER -74.21 -31.04 62.47 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.436 179.8 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.562 HD12 HD23 ' B' ' 167' ' ' LEU . 1.5 tt -79.69 -29.77 40.88 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.671 -0.643 . . . . 0.0 109.606 179.182 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.638 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.3 mp -75.83 -34.33 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 179.322 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -65.09 -32.73 74.58 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.858 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.748 ' O ' HG23 ' B' ' 179' ' ' VAL . 76.8 m-20 -75.56 -33.43 60.64 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.03 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.648 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -70.14 -35.89 74.39 Favored 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.54 179.549 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -72.86 -30.5 64.04 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.651 -0.656 . . . . 0.0 109.81 179.708 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -29.63 64.47 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.641 -0.662 . . . . 0.0 109.888 179.7 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.748 HG23 ' O ' ' B' ' 175' ' ' ASN . 65.5 t -69.76 -29.91 42.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.589 -0.694 . . . . 0.0 109.805 179.728 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -68.72 -30.4 69.03 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.61 -0.681 . . . . 0.0 109.841 179.819 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.04 -29.49 61.93 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.643 -0.661 . . . . 0.0 109.897 179.783 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -74.81 -37.45 62.32 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.685 -0.634 . . . . 0.0 109.949 179.699 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.767 HG12 HD12 ' A' ' 79' ' ' LEU . 85.9 mt -72.08 -29.25 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.698 -0.626 . . . . 0.0 109.674 179.606 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 25.2 m -72.49 -31.76 65.64 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.56 -0.713 . . . . 0.0 109.847 179.555 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -42.52 65.74 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.592 -0.693 . . . . 0.0 109.796 179.631 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.69 -31.44 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.695 -0.628 . . . . 0.0 109.457 179.584 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -72.13 -29.75 64.37 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.63 -0.669 . . . . 0.0 109.818 179.579 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -68.78 -30.86 69.54 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.569 -0.707 . . . . 0.0 109.803 179.739 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -75.59 -35.16 60.63 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.666 -0.646 . . . . 0.0 109.766 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.928 HD12 HD13 ' A' ' 76' ' ' LEU . 79.1 mt -73.39 -31.55 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.58 -0.7 . . . . 0.0 109.43 179.616 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.9 m -70.02 -35.94 74.7 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.7 -0.625 . . . . 0.0 109.327 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -75.2 -37.22 61.24 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.594 -0.691 . . . . 0.0 109.283 179.299 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.75 -30.96 66.16 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.677 -0.639 . . . . 0.0 109.436 179.196 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -68.83 -36.93 78.79 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.697 -0.627 . . . . 0.0 109.753 179.587 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -62.8 -30.28 71.35 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.584 -0.698 . . . . 0.0 109.628 179.571 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -39.33 94.45 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.692 -0.63 . . . . 0.0 109.621 179.443 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -62.69 -29.19 70.47 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.716 -0.615 . . . . 0.0 109.704 179.494 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -61.75 -38.12 86.8 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.665 -0.647 . . . . 0.0 109.771 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -68.01 -39.68 83.13 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.707 -0.62 . . . . 0.0 109.727 179.635 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.734 HD23 HD12 ' A' ' 62' ' ' LEU . 11.0 tp -74.07 -30.75 62.53 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.632 -0.667 . . . . 0.0 109.685 179.552 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.613 ' HG2' HD11 ' A' ' 62' ' ' LEU . 3.8 mm-40 -77.24 -29.5 54.05 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.604 -0.685 . . . . 0.0 109.852 179.544 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -76.35 -29.21 57.12 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.6 -0.688 . . . . 0.0 109.926 179.647 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.0 -28.03 57.64 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.613 -0.679 . . . . 0.0 110.044 179.778 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.15 -25.96 52.53 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.565 -0.709 . . . . 0.0 110.362 179.87 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -89.7 -27.51 20.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.507 -0.746 . . . . 0.0 110.211 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -78.46 158.95 75.7 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.504 -0.748 . . . . 0.0 110.245 179.964 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 C--N 1.317 -1.112 0 O-C-N 123.388 1.204 . . . . 0.0 110.37 -179.965 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.121 0.486 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -98.44 -174.27 2.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.58 -0.7 . . . . 0.0 110.207 179.965 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 52.85 26.71 4.8 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.508 -0.745 . . . . 0.0 110.858 -179.968 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.5 tmm? -144.0 -46.05 0.27 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.583 -0.698 . . . . 0.0 110.22 179.836 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -66.8 -30.01 70.1 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.643 -0.661 . . . . 0.0 109.92 179.903 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.44 -28.37 61.93 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.652 -0.655 . . . . 0.0 109.946 179.752 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -72.09 -28.58 63.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.565 -0.709 . . . . 0.0 110.06 179.817 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 13.0 mtp -70.33 -34.91 73.24 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.559 -0.713 . . . . 0.0 109.942 179.887 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 t -64.55 -30.14 71.16 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.626 -0.671 . . . . 0.0 109.858 179.727 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.491 ' HG ' HD23 ' B' ' 200' ' ' LEU . 1.5 tt -63.17 -29.36 70.72 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.68 -0.638 . . . . 0.0 109.953 179.673 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -61.78 -33.25 73.77 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.546 -0.721 . . . . 0.0 110.063 179.911 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.29 -48.84 63.9 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.615 -0.678 . . . . 0.0 109.796 179.782 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.4 m -63.04 -33.53 75.63 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 120.266 -0.573 . . . . 0.0 109.599 179.523 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.89 -28.74 69.75 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.66 -0.65 . . . . 0.0 109.819 179.651 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -63.21 -36.78 84.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.601 -0.687 . . . . 0.0 110.056 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -75.0 -35.85 62.0 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.66 -0.65 . . . . 0.0 109.65 179.656 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.57 ' CD1' HD22 ' B' ' 193' ' ' LEU . 50.8 mm -72.82 -28.46 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.679 -0.638 . . . . 0.0 109.545 179.434 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.5 tp -73.18 -40.16 65.02 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.555 -0.716 . . . . 0.0 109.875 179.516 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.6 ttpp -69.36 -32.57 71.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.622 -0.674 . . . . 0.0 109.597 179.54 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.78 HD12 HG12 ' B' ' 190' ' ' ILE . 1.5 mm? -69.42 -36.28 76.55 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.721 -0.612 . . . . 0.0 109.719 179.55 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -64.54 -33.46 75.96 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.629 -0.67 . . . . 0.0 109.727 179.712 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -74.38 -31.74 62.48 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.673 -0.642 . . . . 0.0 109.448 179.505 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -68.62 -30.47 69.2 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.768 -0.582 . . . . 0.0 109.747 179.599 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.501 HD13 HD12 ' B' ' 190' ' ' ILE . 14.2 tp -73.0 -34.36 66.35 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.56 -0.713 . . . . 0.0 109.696 179.664 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.82 -36.71 64.99 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.253 -0.579 . . . . 0.0 109.611 179.51 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.54 -29.98 67.7 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.708 -0.62 . . . . 0.0 109.723 179.565 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.568 HD12 HG12 ' B' ' 183' ' ' ILE . 0.3 OUTLIER -73.64 -44.01 58.02 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.67 -0.644 . . . . 0.0 109.624 179.607 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -68.68 -30.79 69.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.619 -0.675 . . . . 0.0 109.538 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.56 -29.56 68.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.602 -0.686 . . . . 0.0 109.703 179.527 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -67.42 -45.91 74.74 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.693 -0.629 . . . . 0.0 109.88 179.703 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.2 tttm -62.86 -29.98 71.16 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.529 -0.732 . . . . 0.0 109.682 179.466 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -64.18 -29.41 70.52 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.669 -0.644 . . . . 0.0 109.863 179.595 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.97 -39.22 79.58 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.521 -0.737 . . . . 0.0 109.797 179.74 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.478 HD23 HD21 ' B' ' 172' ' ' LEU . 2.6 mt -61.86 -31.06 71.3 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.544 -0.722 . . . . 0.0 109.873 179.727 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -61.84 -40.41 95.2 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.535 -0.728 . . . . 0.0 109.78 179.748 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.4 mt -72.5 -31.38 65.31 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.684 -0.635 . . . . 0.0 109.486 179.392 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -86.15 -14.76 43.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.756 -0.59 . . . . 0.0 110.634 179.533 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.425 HD11 HD11 ' B' ' 173' ' ' ILE . 50.7 tp . . . . . 0 N--CA 1.5 2.062 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.572 -179.895 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.353 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.75 HD12 ' N ' ' B' ' 168' ' ' SER . 2.6 pp -139.83 -45.98 0.44 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.614 -0.933 . . . . 0.0 110.458 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.75 ' N ' HD12 ' B' ' 167' ' ' LEU . 37.4 t -156.82 12.38 0.25 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.343 -0.848 . . . . 0.0 111.931 -179.945 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 39.5 tptt 49.24 26.48 1.53 Allowed 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.085 -1.01 . . . . 0.0 111.197 -179.826 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -152.23 -47.77 0.1 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.761 -0.587 . . . . 0.0 109.647 179.995 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.406 ' HB2' ' CD1' ' B' ' 167' ' ' LEU . 3.5 mm-40 -74.29 -34.0 63.41 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.374 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.565 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.7 tt -75.18 -27.91 59.85 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.798 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.425 HD11 HD11 ' A' ' 90' ' ' LEU . 50.6 mm -68.54 -31.5 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.6 -0.688 . . . . 0.0 109.374 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -68.52 -30.11 68.84 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.746 -0.596 . . . . 0.0 109.789 179.657 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -74.94 -29.26 60.89 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.63 -0.669 . . . . 0.0 109.924 179.808 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.03 -24.34 55.19 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.641 -0.662 . . . . 0.0 110.243 179.889 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.75 -27.05 31.33 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.451 -0.781 . . . . 0.0 109.691 179.464 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -37.82 37.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.564 -0.71 . . . . 0.0 109.868 179.729 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 11.3 p -73.92 -25.62 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 C-N-CA 119.88 -0.728 . . . . 0.0 109.831 179.508 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -73.97 -30.5 62.55 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.564 -0.71 . . . . 0.0 109.688 179.462 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 12.3 mtp180 -72.73 -29.91 63.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.618 -0.676 . . . . 0.0 109.784 179.62 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 182' ' ' GLU . . . . . 0.464 ' O ' HG23 ' B' ' 186' ' ' VAL . 0.6 OUTLIER -69.09 -31.0 69.42 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.598 -0.689 . . . . 0.0 109.872 179.705 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.568 HG12 HD12 ' A' ' 79' ' ' LEU . 82.9 mt -70.39 -31.39 46.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.696 -0.628 . . . . 0.0 109.629 179.695 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.33 -38.09 71.69 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.678 -0.639 . . . . 0.0 109.708 179.582 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 7.2 ttm -67.66 -39.34 84.54 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.612 -0.68 . . . . 0.0 109.746 179.621 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 186' ' ' VAL . . . . . 0.464 HG23 ' O ' ' B' ' 182' ' ' GLU . 70.1 t -72.34 -30.86 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.604 -0.685 . . . . 0.0 109.543 179.622 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -73.13 -28.44 62.25 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.654 -0.654 . . . . 0.0 109.977 179.664 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -72.66 -32.29 65.74 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.638 -0.664 . . . . 0.0 109.998 179.855 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -73.88 -38.88 64.26 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.715 -0.615 . . . . 0.0 109.823 179.807 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.78 HG12 HD12 ' A' ' 72' ' ' LEU . 79.4 mt -71.52 -31.52 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.468 179.577 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.0 m -67.91 -35.36 78.32 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.662 -0.649 . . . . 0.0 109.256 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.3 mmtp -77.92 -33.0 52.0 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 179.181 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.57 HD22 ' CD1' ' A' ' 69' ' ' ILE . 0.9 OUTLIER -74.85 -31.5 61.67 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.135 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 194' ' ' LYS . . . . . 0.427 ' HE3' HG21 ' A' ' 69' ' ' ILE . 0.0 OUTLIER -69.54 -40.94 76.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.692 -0.63 . . . . 0.0 109.425 179.4 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -31.0 71.47 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.248 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.417 ' HE2' HD23 ' B' ' 193' ' ' LEU . 24.8 ttpt -63.68 -36.5 84.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.666 -0.646 . . . . 0.0 109.375 179.245 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 31.8 tp60 -62.82 -30.45 71.49 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.793 -0.567 . . . . 0.0 109.692 179.504 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -61.28 -42.75 99.17 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.711 -0.618 . . . . 0.0 109.898 179.685 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -62.3 -43.02 99.8 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.707 -0.621 . . . . 0.0 109.84 179.719 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.491 HD23 ' HG ' ' A' ' 62' ' ' LEU . 14.0 tp -72.66 -30.27 64.13 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.659 -0.651 . . . . 0.0 109.656 179.46 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -77.75 -30.71 51.71 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.608 -0.683 . . . . 0.0 109.889 179.548 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -77.59 -29.09 51.83 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.634 -0.667 . . . . 0.0 109.94 179.726 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -78.69 -28.74 45.25 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.62 -0.675 . . . . 0.0 109.941 179.646 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.92 -25.7 43.71 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.661 -0.649 . . . . 0.0 110.259 179.738 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.36 -25.43 29.16 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.54 -0.725 . . . . 0.0 110.244 179.913 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 13.8 mmtt -57.46 110.34 2.4 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.524 -0.735 . . . . 0.0 110.362 -179.954 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 C--N 1.319 -0.993 0 O-C-N 123.231 1.122 . . . . 0.0 110.427 -179.893 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.13 0.49 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -89.73 -169.82 2.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.6 -0.688 . . . . 0.0 110.191 179.955 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 52.89 27.61 5.67 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.48 -0.763 . . . . 0.0 110.844 179.952 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.13 -42.44 1.71 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.562 -0.712 . . . . 0.0 110.242 179.96 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.48 -27.62 69.4 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.68 -0.637 . . . . 0.0 110.205 179.872 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -71.29 -28.63 64.26 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.593 -0.692 . . . . 0.0 110.264 -179.981 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.16 -32.16 69.99 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.553 -0.717 . . . . 0.0 110.05 179.879 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -30.49 70.95 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.632 -0.667 . . . . 0.0 109.939 179.813 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.1 m -65.04 -29.04 69.9 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.672 -0.642 . . . . 0.0 110.044 179.807 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.555 ' HG ' HD23 ' B' ' 200' ' ' LEU . 0.6 OUTLIER -64.83 -28.4 69.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.655 -0.653 . . . . 0.0 110.223 179.93 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -75.42 -36.72 60.76 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.573 -0.705 . . . . 0.0 110.113 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -74.49 -30.54 61.86 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.691 -0.63 . . . . 0.0 109.922 179.735 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 70.4 m -74.81 -29.26 61.03 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.617 -0.677 . . . . 0.0 109.832 179.505 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.0 mmtt -72.47 -26.9 61.98 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.612 -0.68 . . . . 0.0 110.219 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.27 -31.89 64.34 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.521 -0.737 . . . . 0.0 110.305 179.986 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.9 tp60 -75.91 -33.36 59.9 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.525 -0.734 . . . . 0.0 109.877 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.659 HG12 HD23 ' B' ' 193' ' ' LEU . 88.3 mt -74.16 -26.87 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.663 -0.648 . . . . 0.0 109.8 179.706 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.573 ' O ' HD23 ' A' ' 70' ' ' LEU . 6.6 tt -74.93 -37.42 62.04 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.487 -0.758 . . . . 0.0 109.499 179.331 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -62.6 -29.91 70.95 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.646 -0.659 . . . . 0.0 109.521 179.202 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.615 HD22 HG12 ' B' ' 190' ' ' ILE . 12.5 mt -60.72 -30.01 69.71 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.616 -0.678 . . . . 0.0 109.935 179.654 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -61.99 -38.17 87.58 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.647 -0.658 . . . . 0.0 109.776 179.763 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.96 -31.85 56.87 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.217 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.482 ' O ' HD23 ' A' ' 79' ' ' LEU . 4.8 tttm -75.43 -31.56 60.39 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.82 -0.55 . . . . 0.0 109.781 179.561 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 46.9 tp -76.03 -33.36 59.64 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.592 -0.692 . . . . 0.0 109.709 179.633 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.2 tt -75.35 -35.37 61.15 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.728 -0.607 . . . . 0.0 109.473 179.314 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.51 68.19 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 120.228 -0.589 . . . . 0.0 109.656 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.482 HD23 ' O ' ' A' ' 75' ' ' LYS . 1.0 OUTLIER -68.75 -43.92 74.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.616 -0.678 . . . . 0.0 109.828 179.73 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -66.86 -31.12 71.52 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.586 -0.697 . . . . 0.0 109.623 179.586 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -68.05 -28.4 67.35 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.671 -0.643 . . . . 0.0 109.819 179.546 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.5 -43.27 85.76 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.57 -0.706 . . . . 0.0 109.954 179.858 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.51 ' HA ' HG11 ' B' ' 179' ' ' VAL . 8.8 ttpp -62.62 -30.13 71.12 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.593 -0.692 . . . . 0.0 109.822 179.818 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -64.48 -38.6 91.58 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.564 -0.71 . . . . 0.0 109.75 179.799 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -64.7 -29.43 70.42 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.707 -0.621 . . . . 0.0 109.708 179.59 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.442 HD12 ' HG3' ' B' ' 176' ' ' MET . 0.3 OUTLIER -65.1 -31.74 73.1 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.68 -0.637 . . . . 0.0 109.793 179.822 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -66.48 -45.68 78.85 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.663 -0.648 . . . . 0.0 110.143 179.998 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.8 mp -62.21 -32.71 73.4 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.69 -0.631 . . . . 0.0 109.899 179.777 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.416 ' O ' HD13 ' B' ' 172' ' ' LEU . 6.8 mt-30 -86.71 -22.04 26.28 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.732 -0.605 . . . . 0.0 110.372 179.714 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.789 HD11 ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.957 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.634 -179.907 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.734 HD12 ' N ' ' B' ' 168' ' ' SER . 2.8 pp -140.16 -44.92 0.42 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.59 -0.947 . . . . 0.0 110.582 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.734 ' N ' HD12 ' B' ' 167' ' ' LEU . 10.5 t -153.81 15.12 0.49 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.354 -0.841 . . . . 0.0 111.35 -179.99 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.0 tptt 49.64 26.41 1.78 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.091 -1.006 . . . . 0.0 111.048 -179.835 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -152.5 -46.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.697 -0.627 . . . . 0.0 110.052 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.549 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.7 OUTLIER -74.44 -34.62 63.24 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.215 179.45 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.563 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.5 tt -75.92 -27.32 57.57 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.864 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.789 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.8 mm -68.76 -32.02 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.627 -0.671 . . . . 0.0 109.336 179.331 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -72.98 -28.51 62.44 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.725 -0.609 . . . . 0.0 109.891 179.542 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.805 ' O ' HG23 ' B' ' 179' ' ' VAL . 78.7 m-20 -71.48 -29.52 64.92 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.682 -0.636 . . . . 0.0 109.994 179.818 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.637 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -69.28 -30.73 68.88 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.583 -0.698 . . . . 0.0 109.871 179.923 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -77.03 -31.41 56.27 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.707 -0.621 . . . . 0.0 109.718 179.67 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 5.2 tpm_? -74.51 -30.26 61.73 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.675 -0.641 . . . . 0.0 109.784 179.57 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.805 HG23 ' O ' ' B' ' 175' ' ' ASN . 65.4 t -71.79 -29.78 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.685 -0.635 . . . . 0.0 109.735 179.66 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -78.26 -23.46 47.27 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.614 -0.679 . . . . 0.0 110.306 179.751 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.48 -28.41 37.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.437 -0.789 . . . . 0.0 109.087 179.448 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -72.0 -29.4 64.17 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.49 -0.756 . . . . 0.0 109.952 179.613 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 84.8 mt -73.83 -29.66 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.647 -0.658 . . . . 0.0 109.826 179.808 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 12.9 m -72.86 -30.14 63.74 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.622 -0.674 . . . . 0.0 109.96 179.787 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.7 mtt -73.99 -40.71 62.77 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.673 -0.642 . . . . 0.0 109.906 179.767 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.4 t -71.48 -30.37 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.621 -0.674 . . . . 0.0 109.577 179.718 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -73.34 -28.81 62.27 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.616 -0.677 . . . . 0.0 109.991 179.638 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -72.39 -28.51 63.04 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.575 -0.703 . . . . 0.0 110.085 179.806 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -30.66 58.54 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.565 -0.71 . . . . 0.0 110.082 179.969 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.615 HG12 HD22 ' A' ' 72' ' ' LEU . 76.4 mt -76.79 -31.13 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.583 -0.698 . . . . 0.0 109.789 179.834 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 14.7 m -73.78 -31.27 63.22 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.744 -0.597 . . . . 0.0 109.609 179.37 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 26.1 mmtm -76.63 -34.73 58.31 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.416 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.659 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -70.17 -34.63 73.23 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.307 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -63.96 -45.15 90.42 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.331 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -71.31 -31.11 67.05 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.023 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -69.98 -35.03 74.11 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.222 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.11 -30.1 71.19 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.678 -0.639 . . . . 0.0 109.602 179.464 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -61.41 -43.05 99.53 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.742 -0.598 . . . . 0.0 109.92 179.695 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -61.97 -38.62 89.23 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.673 -0.642 . . . . 0.0 109.908 179.836 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.555 HD23 ' HG ' ' A' ' 62' ' ' LEU . 0.4 OUTLIER -75.08 -29.79 60.75 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.607 -0.683 . . . . 0.0 109.766 179.554 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.414 ' HA ' HD11 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -78.5 -29.45 46.63 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.634 -0.666 . . . . 0.0 109.802 179.676 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -79.12 -29.66 43.32 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.506 -0.746 . . . . 0.0 109.828 179.706 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -78.51 -28.15 46.22 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.573 -0.704 . . . . 0.0 109.87 179.618 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.69 -24.17 45.21 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.581 -0.699 . . . . 0.0 110.338 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.36 -25.54 29.07 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.38 -0.825 . . . . 0.0 110.268 179.875 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.7 149.85 69.8 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.481 -0.762 . . . . 0.0 110.32 179.993 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 C--N 1.318 -1.072 0 O-C-N 123.339 1.179 . . . . 0.0 110.414 -179.974 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.7 mptt . . . . . 0 N--CA 1.493 1.714 0 CA-C-O 121.161 0.505 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -115.34 -166.37 1.12 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.503 -0.748 . . . . 0.0 110.161 -179.948 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 53.32 26.11 5.01 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.329 -0.857 . . . . 0.0 110.788 -179.969 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.01 -29.34 15.27 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.615 -0.678 . . . . 0.0 110.0 179.804 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.78 -27.52 68.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.589 -0.694 . . . . 0.0 110.266 179.989 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -75.17 -29.08 60.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.572 -0.705 . . . . 0.0 110.108 179.934 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.2 ttm105 -76.3 -31.61 58.3 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.556 -0.715 . . . . 0.0 110.094 179.843 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.0 mtm -75.88 -30.36 58.83 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.6 -0.688 . . . . 0.0 109.886 179.716 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.4 p -75.49 -29.05 59.43 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.61 -0.681 . . . . 0.0 109.946 179.632 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.703 HD11 ' CG ' ' B' ' 201' ' ' GLU . 0.9 OUTLIER -74.06 -29.01 61.68 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.647 -0.658 . . . . 0.0 110.025 179.642 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -72.57 -34.62 67.59 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.552 -0.718 . . . . 0.0 109.917 179.798 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -76.46 -33.54 58.73 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.675 -0.641 . . . . 0.0 109.562 179.521 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.9 m -74.2 -30.8 62.37 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.732 -0.605 . . . . 0.0 109.428 179.351 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -69.76 -27.9 65.32 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.705 -0.622 . . . . 0.0 109.987 179.663 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.94 -37.69 75.93 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.473 -0.767 . . . . 0.0 110.15 179.982 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.13 -40.79 64.64 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.593 -0.692 . . . . 0.0 109.634 179.644 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.699 HG12 HD23 ' B' ' 193' ' ' LEU . 94.7 mt -68.29 -26.92 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.746 -0.596 . . . . 0.0 109.433 179.367 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.4 mt -67.09 -38.55 85.9 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.455 -0.778 . . . . 0.0 109.635 179.433 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -31.15 65.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.532 -0.73 . . . . 0.0 109.614 179.386 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.46 HD12 HD22 ' B' ' 193' ' ' LEU . 8.6 mt -71.69 -34.24 69.47 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.684 -0.635 . . . . 0.0 109.725 179.516 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -67.89 -30.83 70.27 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.587 -0.696 . . . . 0.0 109.746 179.652 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.31 -30.16 57.62 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.678 -0.639 . . . . 0.0 109.674 179.556 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -72.47 -29.15 63.39 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.712 -0.617 . . . . 0.0 109.884 179.667 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.1 tp -70.88 -35.56 72.41 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.515 -0.741 . . . . 0.0 109.838 179.817 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 87.9 mt -75.3 -32.73 61.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.696 -0.628 . . . . 0.0 109.664 179.606 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.83 -30.0 62.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.722 -0.611 . . . . 0.0 109.642 179.444 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.406 ' HA ' HD13 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -71.89 -39.7 69.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.677 -0.64 . . . . 0.0 109.694 179.65 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -71.82 -32.17 67.3 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.559 -0.713 . . . . 0.0 109.452 179.404 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -68.15 -29.77 68.74 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.79 -0.569 . . . . 0.0 109.544 179.348 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -62.84 -43.03 99.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.685 -0.635 . . . . 0.0 109.707 179.639 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -66.29 -32.27 73.57 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.554 -0.716 . . . . 0.0 109.484 179.48 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -63.74 -31.61 72.84 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.695 -0.628 . . . . 0.0 109.754 179.459 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -71.08 -35.11 71.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.642 -0.661 . . . . 0.0 109.619 179.566 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.716 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.2 OUTLIER -64.84 -30.18 71.17 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.568 -0.707 . . . . 0.0 109.637 179.559 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -61.93 -40.16 94.56 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.69 -0.631 . . . . 0.0 109.766 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.81 -30.71 71.68 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.704 -0.623 . . . . 0.0 109.738 179.64 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -84.14 -17.41 40.16 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.634 -0.666 . . . . 0.0 110.572 179.696 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.685 HD13 ' HE3' ' B' ' 176' ' ' MET . 53.1 tp . . . . . 0 N--CA 1.501 2.097 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.531 -179.939 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 166' ' ' GLY . . . . . 0.503 ' HA2' HD13 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 . . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.727 HD12 ' N ' ' B' ' 168' ' ' SER . 2.9 pp -139.54 -44.2 0.45 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.647 -0.913 . . . . 0.0 110.534 -179.917 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.727 ' N ' HD12 ' B' ' 167' ' ' LEU . 69.4 m -153.66 15.82 0.51 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.35 -0.843 . . . . 0.0 111.248 179.834 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 8.3 tptt 49.34 26.48 1.6 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.104 -0.998 . . . . 0.0 110.984 -179.789 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -151.65 -46.44 0.11 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.658 -0.651 . . . . 0.0 110.151 -179.926 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.611 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -73.58 -36.55 65.59 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.177 179.609 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.581 HD21 HD23 ' A' ' 86' ' ' LEU . 1.9 tt -74.22 -28.17 61.13 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.894 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.432 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.0 mm -66.89 -34.58 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.264 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -72.57 -29.07 63.21 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.611 179.257 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -70.63 -40.38 73.12 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.685 -0.634 . . . . 0.0 109.958 179.634 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.716 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -62.94 -30.77 71.82 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.655 -0.653 . . . . 0.0 109.749 179.87 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -75.45 -28.73 59.42 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.606 -0.684 . . . . 0.0 109.87 179.535 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -73.52 -31.31 63.62 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.563 -0.71 . . . . 0.0 110.139 179.893 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.557 HG21 ' CD1' ' A' ' 86' ' ' LEU . 57.6 t -72.26 -29.58 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.621 -0.674 . . . . 0.0 109.807 179.784 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 180' ' ' ASP . . . . . 0.45 ' HA ' HD12 ' B' ' 183' ' ' ILE . 4.0 t70 -72.55 -30.25 64.28 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.55 -0.719 . . . . 0.0 109.928 179.713 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 1.3 tpt85 -74.68 -28.99 61.06 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.757 -0.589 . . . . 0.0 109.913 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -73.96 -33.01 63.73 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.612 -0.68 . . . . 0.0 110.018 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.45 HD12 ' HA ' ' B' ' 180' ' ' ASP . 67.5 mt -71.17 -29.23 35.5 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 O-C-N 121.644 -0.66 . . . . 0.0 109.727 179.742 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -34.58 75.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.621 -0.674 . . . . 0.0 109.783 179.651 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.0 ttt -67.99 -46.28 71.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.68 -0.638 . . . . 0.0 109.815 179.674 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 61.3 t -68.54 -30.27 46.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.552 -0.717 . . . . 0.0 109.573 179.66 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -73.7 -29.44 62.28 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.669 -0.644 . . . . 0.0 109.916 179.659 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -72.04 -30.58 65.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.638 -0.664 . . . . 0.0 109.987 179.819 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -40.25 61.99 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.652 -0.655 . . . . 0.0 109.694 179.662 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.455 HG12 HD22 ' A' ' 72' ' ' LEU . 79.7 mt -70.5 -29.78 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.677 -0.639 . . . . 0.0 109.656 179.572 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -34.59 73.79 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.619 -0.675 . . . . 0.0 109.553 179.515 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 55.7 mmtt -75.86 -35.86 59.78 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.677 -0.64 . . . . 0.0 109.654 179.666 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.699 HD23 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -77.14 -19.72 56.52 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.694 -0.628 . . . . 0.0 110.257 179.466 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 22.3 mmtt -84.73 -28.43 26.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.279 -0.888 . . . . 0.0 109.455 179.316 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.4 mmtm -78.61 -36.25 44.42 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.733 -0.604 . . . . 0.0 109.734 179.48 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' B' ' 193' ' ' LEU . 0.0 OUTLIER -71.74 -28.06 63.41 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.494 179.41 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -68.64 -29.22 67.66 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.613 -0.679 . . . . 0.0 109.466 179.253 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.86 -46.69 88.36 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.68 -0.638 . . . . 0.0 109.599 179.525 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -61.38 -35.89 78.75 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.738 -0.601 . . . . 0.0 109.881 179.669 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.675 HD23 HD12 ' A' ' 62' ' ' LEU . 6.8 tp -77.65 -31.86 52.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.574 -0.704 . . . . 0.0 109.601 179.412 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.703 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.3 mt-10 -79.59 -31.1 41.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.717 -0.615 . . . . 0.0 109.681 179.447 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -78.42 -29.01 46.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.593 -0.692 . . . . 0.0 109.662 179.453 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -75.94 -28.09 57.82 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.56 -0.713 . . . . 0.0 109.84 179.446 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -73.99 -24.87 59.66 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.574 -0.704 . . . . 0.0 110.29 179.779 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -89.09 -27.92 20.45 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.524 -0.735 . . . . 0.0 110.053 179.859 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -87.42 150.49 49.09 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.616 -0.678 . . . . 0.0 110.234 179.998 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo . . . . . 0 C--N 1.316 -1.137 0 O-C-N 123.376 1.198 . . . . 0.0 110.363 -179.94 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.6 mmmt . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.086 0.47 . . . . 0.0 110.238 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -95.94 -174.65 3.18 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.604 -0.685 . . . . 0.0 110.214 -179.935 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -101.87 -28.28 12.51 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.571 -0.706 . . . . 0.0 110.276 -179.989 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.78 -28.62 40.29 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.603 -0.686 . . . . 0.0 110.26 179.968 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -69.35 -28.38 66.16 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.636 -0.665 . . . . 0.0 110.162 179.885 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -71.28 -28.07 63.88 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.556 -0.715 . . . . 0.0 110.217 179.971 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.72 -31.09 67.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.626 -0.671 . . . . 0.0 110.123 179.918 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 mmt -73.06 -30.11 63.47 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.645 -0.659 . . . . 0.0 109.958 179.857 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.17 -28.59 64.36 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.655 -0.653 . . . . 0.0 109.942 179.664 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.8 tt -68.97 -29.24 67.43 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.621 -0.674 . . . . 0.0 110.026 179.854 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -67.58 -39.46 84.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.568 -0.708 . . . . 0.0 110.022 179.959 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -73.41 -30.82 63.5 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.675 -0.641 . . . . 0.0 109.753 179.624 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.2 m -74.44 -29.59 61.54 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.632 -0.667 . . . . 0.0 109.714 179.551 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -71.32 -28.12 63.87 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.655 -0.653 . . . . 0.0 110.047 179.711 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -70.21 -33.63 71.91 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.636 -0.665 . . . . 0.0 110.145 179.911 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -76.46 -34.36 58.7 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.651 -0.655 . . . . 0.0 109.857 179.669 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.739 HG12 HD22 ' B' ' 193' ' ' LEU . 74.5 mt -74.85 -27.87 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.667 -0.645 . . . . 0.0 109.683 179.498 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.467 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.3 tt -74.12 -29.72 61.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.587 -0.696 . . . . 0.0 109.982 179.666 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -74.74 -38.89 62.13 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.517 -0.739 . . . . 0.0 109.931 179.748 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.728 HD22 ' CD1' ' B' ' 193' ' ' LEU . 2.7 tp -70.9 -27.42 63.78 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.603 -0.686 . . . . 0.0 109.922 179.573 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -71.76 -33.25 68.49 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.541 -0.724 . . . . 0.0 109.553 179.371 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -74.31 -30.34 62.01 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.787 -0.571 . . . . 0.0 109.577 179.496 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.8 tttt -72.15 -37.7 69.33 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.586 -0.696 . . . . 0.0 109.824 179.685 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.579 HD13 ' HA ' ' B' ' 187' ' ' GLU . 24.1 tp -66.91 -31.16 71.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.56 -0.712 . . . . 0.0 109.967 179.703 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 tp -76.61 -34.14 58.39 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.683 -0.636 . . . . 0.0 109.849 179.75 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.65 -28.17 60.75 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 120.254 -0.578 . . . . 0.0 109.932 179.558 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.418 HD12 ' CG1' ' B' ' 183' ' ' ILE . 0.3 OUTLIER -76.07 -36.12 59.11 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.581 -0.699 . . . . 0.0 109.81 179.751 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -72.78 -29.06 62.98 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.576 -0.702 . . . . 0.0 109.886 179.618 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -72.36 -28.25 62.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.658 -0.651 . . . . 0.0 109.965 179.564 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.24 -41.21 70.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.673 -0.642 . . . . 0.0 110.033 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 tttm -65.19 -29.52 70.34 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.511 -0.743 . . . . 0.0 109.753 179.742 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -64.79 -33.4 75.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.599 -0.688 . . . . 0.0 109.83 179.662 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -69.27 -29.87 67.85 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.649 -0.657 . . . . 0.0 109.784 179.687 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.608 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.3 OUTLIER -67.15 -37.04 83.09 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.695 -0.628 . . . . 0.0 109.893 179.738 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -61.52 -33.49 73.91 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.585 -0.697 . . . . 0.0 109.97 179.921 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.3 mp -77.99 -29.37 49.6 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.602 -0.686 . . . . 0.0 109.804 179.686 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -88.7 -21.01 24.11 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.655 -0.653 . . . . 0.0 110.545 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.497 ' HA ' HD22 ' B' ' 172' ' ' LEU . 54.1 tp . . . . . 0 N--CA 1.5 2.049 0 CA-C-O 118.014 -0.994 . . . . 0.0 110.545 -179.931 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 166' ' ' GLY . . . . . 0.637 ' HA3' HD13 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.76 HD11 ' CB ' ' B' ' 171' ' ' GLU . 3.2 pp -143.08 -42.24 0.3 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.687 -0.89 . . . . 0.0 110.761 -179.527 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.734 ' N ' HD12 ' B' ' 167' ' ' LEU . 53.1 m -153.07 17.85 0.57 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.32 -0.863 . . . . 0.0 111.039 179.999 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 169' ' ' LYS . . . . . 0.461 ' C ' HD13 ' B' ' 173' ' ' ILE . 4.8 tptm 49.73 26.63 1.92 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.244 -0.91 . . . . 0.0 110.884 -179.729 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -151.79 -46.77 0.11 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.7 -0.625 . . . . 0.0 110.133 -179.996 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.76 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -74.48 -30.79 61.98 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.798 -0.761 . . . . 0.0 109.294 179.512 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.637 HD13 ' HA3' ' B' ' 166' ' ' GLY . 2.9 tt -78.31 -30.43 48.27 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.727 -0.608 . . . . 0.0 109.583 179.176 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.616 ' N ' HD12 ' B' ' 173' ' ' ILE . 1.9 mp -73.03 -33.97 44.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.409 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.23 -32.55 72.82 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.955 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.763 ' O ' HG23 ' B' ' 179' ' ' VAL . 84.7 m-20 -73.02 -38.57 66.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.715 -0.615 . . . . 0.0 109.427 179.222 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.608 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -64.79 -30.63 71.65 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.696 -0.628 . . . . 0.0 109.645 179.637 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -78.89 -30.95 45.2 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.655 -0.653 . . . . 0.0 109.831 179.738 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.37 -29.89 47.68 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.744 -0.597 . . . . 0.0 109.684 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.763 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.4 t -76.3 -29.73 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.72 -0.613 . . . . 0.0 109.58 179.57 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -73.43 -30.59 63.32 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.523 -0.735 . . . . 0.0 109.915 179.833 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.21 -29.3 60.27 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.674 -0.642 . . . . 0.0 109.942 179.714 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 182' ' ' GLU . . . . . 0.664 ' O ' HG23 ' B' ' 186' ' ' VAL . 6.5 tt0 -75.93 -36.7 59.27 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.634 -0.666 . . . . 0.0 109.914 179.831 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.418 ' CG1' HD12 ' A' ' 79' ' ' LEU . 72.8 mt -71.28 -29.92 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.705 -0.622 . . . . 0.0 109.511 179.663 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 86.0 m -72.21 -39.32 68.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.61 -0.681 . . . . 0.0 109.743 179.594 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 mtp -72.53 -37.7 68.26 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.635 -0.665 . . . . 0.0 109.495 179.525 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 186' ' ' VAL . . . . . 0.664 HG23 ' O ' ' B' ' 182' ' ' GLU . 66.5 t -72.56 -34.79 49.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 179.283 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 187' ' ' GLU . . . . . 0.579 ' HA ' HD13 ' A' ' 76' ' ' LEU . 21.3 tt0 -64.87 -33.27 75.61 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.748 -0.595 . . . . 0.0 109.526 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -67.39 -26.1 66.28 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.677 -0.639 . . . . 0.0 109.933 179.562 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -76.31 -25.34 54.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.52 -0.737 . . . . 0.0 110.361 179.871 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.606 HD13 HD23 ' A' ' 72' ' ' LEU . 25.6 mm -80.38 -35.95 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.484 -0.76 . . . . 0.0 109.398 -179.945 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 14.9 m -76.01 -29.38 58.12 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.755 -0.591 . . . . 0.0 109.839 179.595 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 7.3 mmmt -77.51 -31.58 53.56 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.624 -0.672 . . . . 0.0 109.786 179.708 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.739 HD22 HG12 ' A' ' 69' ' ' ILE . 0.4 OUTLIER -75.68 -29.71 59.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.546 -0.721 . . . . 0.0 109.49 179.491 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -34.52 71.07 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.63 -0.669 . . . . 0.0 109.762 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -71.78 -31.23 66.39 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.676 -0.64 . . . . 0.0 109.71 179.561 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -68.4 -31.51 70.91 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.674 -0.641 . . . . 0.0 109.576 179.509 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -66.7 -30.43 70.67 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.69 -0.631 . . . . 0.0 109.734 179.533 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -62.65 -40.79 98.13 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.651 -0.656 . . . . 0.0 109.794 179.706 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -62.25 -39.73 93.83 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.779 179.681 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 8.7 tp -73.59 -33.21 64.51 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.563 -0.71 . . . . 0.0 109.71 179.473 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.84 -29.94 56.1 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.72 -0.612 . . . . 0.0 109.753 179.553 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -77.55 -29.05 52.02 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.609 -0.682 . . . . 0.0 109.953 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -78.06 -28.26 48.86 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.524 -0.735 . . . . 0.0 110.081 179.71 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -80.07 -26.23 39.72 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.585 -0.697 . . . . 0.0 110.289 179.868 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -89.32 -27.39 20.55 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.415 -0.803 . . . . 0.0 110.258 179.93 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -72.65 148.55 90.18 Favored Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.55 -0.719 . . . . 0.0 110.154 179.943 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo . . . . . 0 C--N 1.317 -1.085 0 O-C-N 123.402 1.211 . . . . 0.0 110.42 179.948 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.1 mttt . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.074 0.464 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -144.71 166.0 26.44 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.639 -0.663 . . . . 0.0 110.241 -179.921 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -94.27 -27.2 16.26 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.581 -0.699 . . . . 0.0 110.371 -179.963 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.7 ttt -74.81 -27.92 60.49 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.494 -0.754 . . . . 0.0 110.332 -179.983 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -66.75 -33.65 76.09 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.531 -0.73 . . . . 0.0 110.141 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -67.97 -29.88 69.02 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.613 -0.68 . . . . 0.0 109.916 179.735 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -66.07 -29.98 70.41 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.656 -0.653 . . . . 0.0 109.898 179.823 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -43.01 98.09 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.681 -0.637 . . . . 0.0 109.892 179.831 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 5.3 p -68.09 -30.82 70.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.655 -0.653 . . . . 0.0 109.78 179.686 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.677 HD11 ' HG2' ' B' ' 201' ' ' GLU . 0.4 OUTLIER -68.86 -29.07 67.3 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.813 179.617 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.92 -32.65 74.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.594 -0.691 . . . . 0.0 109.934 179.81 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -75.48 -36.98 60.52 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.598 -0.689 . . . . 0.0 109.771 179.68 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.47 HG23 ' NZ ' ' B' ' 196' ' ' LYS . 32.3 m -72.91 -30.57 64.02 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.694 -0.628 . . . . 0.0 109.557 179.438 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.488 ' O ' HD23 ' A' ' 70' ' ' LEU . 0.6 OUTLIER -70.04 -28.2 65.28 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.689 -0.632 . . . . 0.0 109.803 179.514 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -66.65 -37.92 85.8 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.585 -0.697 . . . . 0.0 110.081 179.926 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.46 -40.33 67.07 Favored 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.64 179.605 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.835 HG12 HD23 ' B' ' 193' ' ' LEU . 49.1 mt -68.41 -26.84 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.793 -0.567 . . . . 0.0 109.502 179.457 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.488 HD23 ' O ' ' A' ' 66' ' ' LYS . 0.7 OUTLIER -68.67 -37.42 79.6 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.533 -0.729 . . . . 0.0 109.796 179.563 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -68.39 -31.6 71.07 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.588 -0.695 . . . . 0.0 109.846 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.573 HD22 HG12 ' B' ' 190' ' ' ILE . 8.9 mt -68.65 -29.37 67.84 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.655 -0.653 . . . . 0.0 110.039 179.84 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -70.88 -31.16 67.74 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.595 -0.691 . . . . 0.0 109.958 179.824 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -78.12 -31.35 49.89 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.554 -0.716 . . . . 0.0 109.712 179.572 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -74.72 -29.45 61.19 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.707 -0.621 . . . . 0.0 109.771 179.506 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.549 HD13 HD12 ' B' ' 190' ' ' ILE . 14.8 tp -72.29 -34.77 68.41 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.626 -0.671 . . . . 0.0 109.883 179.756 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.8 mt -75.18 -36.45 61.47 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.643 -0.66 . . . . 0.0 109.426 179.513 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.12 -28.45 67.33 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.082 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' B' ' 183' ' ' ILE . 6.1 tp -67.9 -48.16 66.79 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.72 -0.613 . . . . 0.0 110.054 179.698 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -63.06 -25.91 68.6 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.612 -0.68 . . . . 0.0 110.366 179.868 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.57 -29.96 63.99 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.426 -0.796 . . . . 0.0 110.148 179.88 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -76.76 -46.9 23.41 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.591 -0.693 . . . . 0.0 109.603 179.555 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.667 ' HG3' HD11 ' B' ' 183' ' ' ILE . 11.3 mmtt -65.67 -24.34 66.99 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.647 -0.821 . . . . 0.0 108.815 178.686 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -60.82 -26.57 67.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.428 -0.795 . . . . 0.0 109.266 178.403 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.3 tp60 -59.15 -38.92 80.84 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.512 -0.743 . . . . 0.0 109.733 179.191 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.561 HD21 ' HB3' ' B' ' 175' ' ' ASN . 0.2 OUTLIER -67.69 -34.33 76.69 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 179.137 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -61.84 -29.82 70.43 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.741 -0.599 . . . . 0.0 109.818 179.524 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.07 -28.08 65.14 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.657 -0.652 . . . . 0.0 109.993 179.673 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -95.02 -7.24 40.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.623 -0.673 . . . . 0.0 111.063 179.946 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.017 HD23 ' HE3' ' B' ' 176' ' ' MET . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.034 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.418 -179.969 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.541 HD11 ' CB ' ' B' ' 171' ' ' GLU . 1.3 pp -50.92 -47.14 61.01 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.848 -0.795 . . . . 0.0 111.594 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.518 ' N ' HD12 ' B' ' 167' ' ' LEU . 7.6 t -152.96 15.99 0.56 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.228 -0.92 . . . . 0.0 111.278 179.982 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 6.9 tptm 49.7 26.33 1.8 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.179 -0.951 . . . . 0.0 110.985 -179.893 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -151.71 -46.83 0.11 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.659 -0.65 . . . . 0.0 109.974 -179.944 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.541 ' CB ' HD11 ' B' ' 167' ' ' LEU . 1.9 mt-10 -75.08 -32.21 61.41 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 119.881 -0.728 . . . . 0.0 109.182 179.407 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.569 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.5 tt -78.45 -28.23 46.54 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 178.886 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.723 HD13 HD21 ' A' ' 90' ' ' LEU . 49.6 mm -71.69 -32.28 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.655 -0.653 . . . . 0.0 109.433 179.52 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 65.5 mm-40 -68.2 -32.79 73.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.655 -0.653 . . . . 0.0 109.671 179.541 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.676 ' O ' HG23 ' B' ' 179' ' ' VAL . 43.0 m-20 -63.52 -46.04 87.9 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.482 179.384 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 176' ' ' MET . . . . . 1.017 ' HE3' HD23 ' A' ' 90' ' ' LEU . 8.2 mtt -52.85 -31.86 41.56 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.665 -0.647 . . . . 0.0 110.73 179.765 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -68.8 -52.95 24.67 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.683 -0.635 . . . . 0.0 109.75 179.839 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -28.19 67.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.736 -0.603 . . . . 0.0 109.78 179.48 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.676 HG23 ' O ' ' B' ' 175' ' ' ASN . 94.3 t -77.88 -32.08 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.636 -0.665 . . . . 0.0 109.752 179.703 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -74.92 -31.38 61.52 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.562 -0.711 . . . . 0.0 109.64 179.553 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -25.27 64.18 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.724 -0.61 . . . . 0.0 109.86 179.345 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -68.62 -42.25 78.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.534 -0.729 . . . . 0.0 110.419 179.994 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.667 HD11 ' HG3' ' A' ' 83' ' ' LYS . 69.7 mt -66.94 -28.91 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.429 179.697 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 24.5 m -63.55 -32.05 73.39 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.608 -0.682 . . . . 0.0 109.623 179.43 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 1.2 ttt -68.52 -51.02 47.71 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.59 -0.694 . . . . 0.0 109.783 179.62 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.8 t -68.73 -31.61 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.546 -0.721 . . . . 0.0 109.425 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -75.3 -28.34 59.66 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.735 -0.603 . . . . 0.0 109.895 179.584 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -74.6 -27.87 60.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.605 -0.685 . . . . 0.0 110.085 179.76 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -74.23 -33.28 63.31 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.597 -0.689 . . . . 0.0 109.967 179.852 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.573 HG12 HD22 ' A' ' 72' ' ' LEU . 72.1 mt -73.26 -31.08 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.647 -0.658 . . . . 0.0 109.495 179.769 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.23 -31.81 71.57 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.716 -0.615 . . . . 0.0 109.48 179.377 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 23.7 mmtt -77.25 -34.1 55.87 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.678 -0.639 . . . . 0.0 109.511 179.381 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.835 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -72.72 -31.49 65.01 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.294 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.9 tptp -66.5 -40.83 89.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.623 -0.673 . . . . 0.0 109.372 179.323 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.92 -30.41 70.55 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.224 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 196' ' ' LYS . . . . . 0.47 ' NZ ' HG23 ' A' ' 65' ' ' THR . 24.8 ttpt -63.35 -36.93 85.34 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.319 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -63.24 -30.64 71.75 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.692 -0.63 . . . . 0.0 109.519 179.464 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -61.32 -38.52 87.18 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.725 -0.609 . . . . 0.0 109.785 179.684 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.85 -39.83 93.21 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.719 -0.613 . . . . 0.0 109.862 179.772 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.8 tp -72.76 -30.7 64.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.658 -0.651 . . . . 0.0 109.831 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 201' ' ' GLU . . . . . 0.677 ' HG2' HD11 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -77.15 -30.22 54.97 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.61 -0.682 . . . . 0.0 109.782 179.639 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -75.86 -28.72 58.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.645 -0.659 . . . . 0.0 109.994 179.732 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.88 -27.85 57.9 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.559 -0.713 . . . . 0.0 110.184 179.752 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.75 -27.82 50.52 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.501 -0.749 . . . . 0.0 110.268 179.936 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -91.08 -28.11 18.15 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.627 -0.671 . . . . 0.0 110.28 179.991 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 15.2 mmtt -73.63 150.61 88.93 Favored Pre-proline 0 N--CA 1.496 1.832 0 O-C-N 121.518 -0.739 . . . . 0.0 110.18 -179.947 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.317 -1.113 0 O-C-N 123.334 1.176 . . . . 0.0 110.408 179.981 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.09 0.472 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -127.09 178.61 5.9 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.536 -0.727 . . . . 0.0 110.208 -179.986 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 52.93 29.01 7.18 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.434 -0.792 . . . . 0.0 110.84 -179.928 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.7 mtt -148.26 -45.45 0.16 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.588 -0.695 . . . . 0.0 110.222 -179.983 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -62.46 -27.69 69.3 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.706 -0.621 . . . . 0.0 110.352 -179.99 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -72.56 -27.92 62.5 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.534 -0.729 . . . . 0.0 110.359 -179.973 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -74.77 -28.7 60.85 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.54 -0.725 . . . . 0.0 110.218 179.956 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.3 mtt -73.99 -30.15 62.33 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.597 -0.69 . . . . 0.0 110.011 179.766 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.2 m -70.14 -29.07 65.9 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.639 -0.663 . . . . 0.0 109.942 179.606 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.906 HD12 HD23 ' B' ' 200' ' ' LEU . 7.4 tp -67.27 -28.79 68.32 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.621 -0.674 . . . . 0.0 110.066 179.725 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -66.27 -29.49 69.73 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.575 -0.703 . . . . 0.0 110.162 179.997 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -72.72 -44.61 61.48 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.589 -0.694 . . . . 0.0 109.886 179.786 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.499 HG22 HD11 ' A' ' 69' ' ' ILE . 51.6 m -65.27 -30.27 71.12 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.646 -0.659 . . . . 0.0 109.648 179.51 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -66.4 -28.22 68.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.704 -0.623 . . . . 0.0 109.945 179.608 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.15 -44.01 89.98 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.614 -0.679 . . . . 0.0 110.101 179.938 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -39.05 72.7 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.651 -0.656 . . . . 0.0 109.642 179.739 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.546 HG12 HD22 ' B' ' 193' ' ' LEU . 81.5 mt -71.03 -25.89 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.719 -0.613 . . . . 0.0 109.634 179.42 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.454 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.2 tt -72.32 -34.42 68.06 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.534 -0.728 . . . . 0.0 110.001 179.755 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp -67.3 -36.63 81.9 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.491 -0.755 . . . . 0.0 109.91 179.806 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.667 HD22 ' CG1' ' B' ' 190' ' ' ILE . 7.3 mt -64.74 -28.29 69.49 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.669 -0.645 . . . . 0.0 109.944 179.748 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -66.08 -38.3 87.95 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.593 -0.692 . . . . 0.0 110.13 179.962 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.96 -31.08 61.39 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.611 -0.681 . . . . 0.0 109.743 179.654 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -77.9 -30.41 50.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.618 -0.676 . . . . 0.0 109.635 179.691 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -78.78 -30.87 45.82 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.62 -0.675 . . . . 0.0 109.725 179.604 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.5 mt -77.28 -30.54 54.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.642 -0.661 . . . . 0.0 109.753 179.584 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.01 -28.4 60.51 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.667 -0.646 . . . . 0.0 110.032 179.638 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.584 HD12 HG12 ' B' ' 183' ' ' ILE . 0.5 OUTLIER -76.65 -36.06 57.61 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.596 -0.69 . . . . 0.0 109.875 179.796 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -74.72 -27.38 60.35 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.616 -0.677 . . . . 0.0 109.993 179.731 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -76.53 -27.7 56.05 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.565 -0.709 . . . . 0.0 109.782 179.597 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.71 -41.95 59.24 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.663 -0.648 . . . . 0.0 109.886 179.63 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.41 ' HB3' HG11 ' B' ' 179' ' ' VAL . 11.4 ptmt -65.65 -26.31 67.74 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.758 -0.777 . . . . 0.0 109.672 179.362 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -63.8 -29.42 70.63 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.572 -0.705 . . . . 0.0 109.621 179.258 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -63.97 -35.43 80.67 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.6 -0.687 . . . . 0.0 109.877 179.717 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.55 HD22 ' HG2' ' B' ' 176' ' ' MET . 0.5 OUTLIER -66.01 -33.11 75.05 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.6 -0.688 . . . . 0.0 109.605 179.723 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.44 ' HA ' ' HE2' ' B' ' 176' ' ' MET . 6.7 m-85 -62.77 -29.27 70.57 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.609 -0.682 . . . . 0.0 110.049 179.782 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.35 -29.09 59.83 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.589 -0.695 . . . . 0.0 110.14 179.834 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -87.57 -26.66 23.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.653 -0.654 . . . . 0.0 110.371 179.894 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.494 HD22 ' HE3' ' B' ' 176' ' ' MET . 45.4 tp . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.21 -179.978 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' B' B ' 167' ' ' LEU . . . . . 0.718 HD12 ' N ' ' B' ' 168' ' ' SER . 3.0 pp -141.46 -42.94 0.36 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.567 -0.961 . . . . 0.0 110.724 -179.735 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 168' ' ' SER . . . . . 0.718 ' N ' HD12 ' B' ' 167' ' ' LEU . 48.1 t -153.34 16.97 0.54 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.317 -0.864 . . . . 0.0 111.234 179.934 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 169' ' ' LYS . . . . . 0.469 ' C ' HD13 ' B' ' 173' ' ' ILE . 34.3 tptt 50.03 26.26 1.99 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.099 -1.001 . . . . 0.0 111.084 -179.954 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -154.3 -45.52 0.09 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.6 -0.687 . . . . 0.0 110.409 179.982 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.673 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -74.48 -30.75 61.97 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.899 -0.72 . . . . 0.0 109.434 179.691 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' B' B ' 172' ' ' LEU . . . . . 0.495 HD21 HD23 ' A' ' 86' ' ' LEU . 3.3 tt -79.29 -29.56 42.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.733 -0.605 . . . . 0.0 109.601 179.18 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 173' ' ' ILE . . . . . 0.643 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.5 mp -77.56 -34.55 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.405 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -65.27 -33.61 76.39 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.832 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 175' ' ' ASN . . . . . 0.749 ' O ' HG23 ' B' ' 179' ' ' VAL . 81.4 m-20 -75.58 -36.21 60.4 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.976 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 176' ' ' MET . . . . . 0.55 ' HG2' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -68.05 -30.71 69.99 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.678 -0.638 . . . . 0.0 109.804 179.437 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -75.34 -34.51 61.2 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.644 -0.66 . . . . 0.0 109.677 179.655 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -30.05 67.99 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.689 -0.632 . . . . 0.0 109.63 179.488 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 179' ' ' VAL . . . . . 0.749 HG23 ' O ' ' B' ' 175' ' ' ASN . 82.4 t -66.28 -32.14 56.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.695 -0.628 . . . . 0.0 109.699 179.711 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.56 -43.18 90.63 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.7 -0.625 . . . . 0.0 109.93 179.882 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -34.07 75.59 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.733 -0.605 . . . . 0.0 109.97 179.8 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -71.16 -45.91 62.51 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.521 -0.737 . . . . 0.0 109.855 179.842 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 183' ' ' ILE . . . . . 0.584 HG12 HD12 ' A' ' 79' ' ' LEU . 78.0 mt -69.73 -29.45 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.649 -0.657 . . . . 0.0 109.38 179.513 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 87.7 m -70.22 -32.49 70.4 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.633 -0.667 . . . . 0.0 109.43 179.343 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.4 ttm -70.22 -48.33 57.49 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.623 -0.673 . . . . 0.0 109.754 179.511 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.8 t -69.84 -31.32 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.551 -0.718 . . . . 0.0 109.376 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -73.99 -29.79 62.14 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.705 -0.622 . . . . 0.0 109.757 179.522 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.24 -30.7 67.83 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.625 -0.672 . . . . 0.0 109.827 179.54 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -37.65 67.64 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.673 -0.642 . . . . 0.0 109.621 179.652 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 190' ' ' ILE . . . . . 0.667 ' CG1' HD22 ' A' ' 72' ' ' LEU . 82.1 mt -69.26 -31.43 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.623 -0.673 . . . . 0.0 109.495 179.542 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.13 -41.59 85.88 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.659 -0.651 . . . . 0.0 109.617 179.55 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -70.69 -35.87 72.99 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.635 -0.665 . . . . 0.0 109.583 179.528 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 193' ' ' LEU . . . . . 0.546 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -70.71 -31.32 68.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.673 -0.642 . . . . 0.0 109.501 179.399 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.4 tptp -69.14 -41.13 77.72 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.637 -0.664 . . . . 0.0 109.699 179.482 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -62.79 -31.69 72.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.665 -0.647 . . . . 0.0 109.508 179.518 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -37.16 86.17 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.696 -0.628 . . . . 0.0 109.382 179.256 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -62.72 -29.6 70.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.734 -0.604 . . . . 0.0 109.642 179.496 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.76 -43.61 98.52 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.632 -0.667 . . . . 0.0 109.741 179.695 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -63.09 -44.71 94.96 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.712 -0.618 . . . . 0.0 109.853 179.796 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.906 HD23 HD12 ' A' ' 62' ' ' LEU . 18.4 tp -71.6 -31.28 66.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.589 -0.694 . . . . 0.0 109.809 179.59 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -78.26 -29.92 48.32 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.622 -0.674 . . . . 0.0 109.834 179.595 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -78.07 -29.11 49.03 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.537 -0.727 . . . . 0.0 109.86 179.701 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.91 -28.11 49.65 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.66 -0.65 . . . . 0.0 110.034 179.596 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -79.3 -24.8 42.61 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.621 -0.674 . . . . 0.0 110.394 179.874 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -86.33 -27.97 23.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.42 -0.8 . . . . 0.0 110.132 179.88 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 5.0 mtmt -65.85 156.1 84.54 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.622 -0.674 . . . . 0.0 110.141 -179.992 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 C--N 1.316 -1.154 0 O-C-N 123.391 1.206 . . . . 0.0 110.394 -179.927 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.722 HD11 ' HG2' ' B' ' 201' ' ' GLU . 6.3 tt . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 121.155 0.502 . . . . 0.0 109.882 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -67.47 -29.93 69.5 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.544 -0.722 . . . . 0.0 109.955 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -74.94 -35.59 62.15 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.651 -0.656 . . . . 0.0 109.943 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 88.3 m -71.29 -30.81 66.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.763 -0.586 . . . . 0.0 109.682 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -68.74 -28.71 67.06 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.618 -0.676 . . . . 0.0 109.899 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -66.86 -32.36 73.58 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.585 -0.697 . . . . 0.0 110.022 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -78.18 -31.34 49.53 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.644 -0.66 . . . . 0.0 109.695 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.672 HG12 HD22 ' B' ' 193' ' ' LEU . 85.4 mt -77.28 -29.67 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.663 -0.648 . . . . 0.0 109.539 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.97 -33.35 63.82 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.639 -0.663 . . . . 0.0 109.651 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.9 tptt -66.31 -30.7 71.16 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.655 -0.653 . . . . 0.0 109.563 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.65 HD11 HD13 ' B' ' 193' ' ' LEU . 10.4 mt -62.38 -31.24 71.87 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.669 -0.644 . . . . 0.0 109.856 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -63.01 -36.59 84.06 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.57 -0.707 . . . . 0.0 109.787 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -76.36 -31.52 58.11 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.694 -0.629 . . . . 0.0 109.576 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -77.07 -30.49 55.52 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.702 -0.624 . . . . 0.0 109.671 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 41.5 tp -77.91 -32.8 51.94 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.614 -0.679 . . . . 0.0 109.633 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.3 mt -75.18 -31.63 61.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.706 -0.621 . . . . 0.0 109.565 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.66 -30.41 67.01 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.645 -0.66 . . . . 0.0 109.731 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.484 HD12 HG12 ' B' ' 183' ' ' ILE . 0.6 OUTLIER -68.16 -41.81 80.98 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.72 -0.613 . . . . 0.0 109.641 179.649 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -68.15 -31.14 70.49 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.609 -0.682 . . . . 0.0 109.674 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.91 -30.53 69.88 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.657 -0.652 . . . . 0.0 109.62 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.07 -45.84 83.62 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.672 -0.642 . . . . 0.0 109.749 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.3 tttm -64.34 -32.2 73.71 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.568 -0.707 . . . . 0.0 109.45 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.78 -30.13 71.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.722 -0.611 . . . . 0.0 109.844 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.7 tm0? -65.99 -33.58 76.13 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.601 -0.687 . . . . 0.0 109.736 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.8 mt -65.76 -32.32 73.79 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.631 -0.668 . . . . 0.0 109.661 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -61.28 -35.83 78.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.654 -0.654 . . . . 0.0 109.83 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' A' ' 88' ' ' LEU . 1.1 mm? -61.73 -29.94 70.45 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.74 -0.6 . . . . 0.0 109.832 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -101.71 -19.6 15.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.676 -0.64 . . . . 0.0 110.553 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.789 HD11 ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.047 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.552 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.755 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.1 OUTLIER -144.88 -67.47 0.32 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.61 -0.935 . . . . 0.0 110.751 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 11.0 t -145.39 16.68 1.5 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.145 -0.972 . . . . 0.0 110.919 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.3 tptt 50.68 25.76 2.21 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.171 -0.955 . . . . 0.0 110.684 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -148.93 -46.77 0.14 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.655 -0.653 . . . . 0.0 109.472 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.574 ' HB2' HD12 ' B' ' 167' ' ' LEU . 2.1 mm-40 -68.9 -33.17 73.32 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 119.95 -0.7 . . . . 0.0 109.262 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.755 ' N ' HD11 ' B' ' 167' ' ' LEU . 1.5 tt -77.87 -27.75 49.81 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.789 ' CD1' HD11 ' A' ' 90' ' ' LEU . 49.1 mm -71.14 -31.08 43.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.632 -0.667 . . . . 0.0 109.399 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -70.35 -29.49 66.18 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.689 -0.632 . . . . 0.0 109.984 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.564 ' O ' HG23 ' B' ' 179' ' ' VAL . 82.0 m-20 -69.29 -29.08 66.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.605 -0.684 . . . . 0.0 110.081 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.787 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -71.46 -29.34 64.73 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.527 -0.733 . . . . 0.0 110.045 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -75.6 -29.96 59.44 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.603 -0.686 . . . . 0.0 110.168 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.4 ttp180 -76.11 -32.21 59.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.619 -0.675 . . . . 0.0 109.95 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.564 HG23 ' O ' ' B' ' 175' ' ' ASN . 72.1 t -74.08 -29.86 26.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.684 -0.635 . . . . 0.0 109.652 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -71.76 -28.59 63.75 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.667 -0.645 . . . . 0.0 110.022 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 19.4 mtp180 -74.15 -28.39 61.29 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.568 -0.708 . . . . 0.0 110.077 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -73.82 -29.12 61.97 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.588 -0.695 . . . . 0.0 110.128 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.484 HG12 HD12 ' A' ' 79' ' ' LEU . 85.0 mt -72.53 -27.81 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.587 -0.696 . . . . 0.0 109.894 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.2 m -71.2 -31.01 67.09 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.56 -0.712 . . . . 0.0 109.937 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.3 ttp -71.7 -44.08 64.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.637 -0.664 . . . . 0.0 109.934 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.0 t -71.28 -31.24 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.615 -0.678 . . . . 0.0 109.554 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -75.21 -29.11 60.21 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.717 -0.614 . . . . 0.0 109.779 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . 0.4 ' O ' ' OG ' ' B' ' 191' ' ' SER . 11.5 tp-100 -73.27 -28.5 62.16 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.654 -0.654 . . . . 0.0 110.068 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -32.49 64.13 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.572 -0.705 . . . . 0.0 109.962 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.638 HG12 HD22 ' A' ' 72' ' ' LEU . 77.0 mt -73.41 -31.67 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.677 -0.64 . . . . 0.0 109.776 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . 0.4 ' OG ' ' O ' ' B' ' 188' ' ' GLN . 19.0 p -69.9 -35.61 74.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.649 -0.657 . . . . 0.0 109.636 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -76.91 -32.28 57.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.659 -0.651 . . . . 0.0 109.431 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.672 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -73.89 -30.8 62.81 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.685 -0.634 . . . . 0.0 109.374 179.277 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -67.76 -40.32 84.09 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.647 -0.658 . . . . 0.0 109.514 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -68.48 -33.11 73.58 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.634 -0.666 . . . . 0.0 109.344 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 1.5 ttpp -63.91 -34.54 78.2 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -29.87 71.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.753 -0.592 . . . . 0.0 109.469 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -47.65 85.36 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.652 -0.655 . . . . 0.0 109.74 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -62.41 -41.49 98.73 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.198 -0.601 . . . . 0.0 109.925 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.58 -36.31 68.15 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.619 -0.676 . . . . 0.0 109.733 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.722 ' HG2' HD11 ' A' ' 62' ' ' LEU . 55.9 mt-10 . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.642 -0.661 . . . . 0.0 109.826 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.4 HD11 ' OE2' ' B' ' 201' ' ' GLU . 4.8 tp . . . . . 0 N--CA 1.497 1.892 0 CA-C-O 121.099 0.476 . . . . 0.0 109.987 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -76.64 -32.69 58.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.605 -0.684 . . . . 0.0 110.089 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -76.83 -30.7 56.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.598 -0.689 . . . . 0.0 109.771 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.3 m -74.53 -29.98 61.59 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.727 -0.608 . . . . 0.0 109.704 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -70.41 -27.04 63.98 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.611 -0.681 . . . . 0.0 109.997 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -69.37 -33.22 72.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.581 -0.7 . . . . 0.0 110.189 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -76.11 -36.05 59.05 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.581 -0.699 . . . . 0.0 109.711 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.42 HD12 ' OE1' ' B' ' 197' ' ' GLN . 82.5 mt -71.79 -27.19 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.737 -0.602 . . . . 0.0 109.533 179.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.4 -37.37 77.46 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.599 -0.688 . . . . 0.0 109.717 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -71.06 -30.38 66.51 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.594 -0.691 . . . . 0.0 109.781 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.937 HD13 HD13 ' B' ' 193' ' ' LEU . 0.4 OUTLIER -72.32 -27.08 62.2 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.639 -0.663 . . . . 0.0 110.067 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -74.16 -32.82 63.27 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.493 -0.754 . . . . 0.0 109.622 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.91 -31.69 63.22 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.733 -0.604 . . . . 0.0 109.392 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -67.82 -30.8 70.29 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.734 -0.604 . . . . 0.0 109.666 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.1 tp -74.38 -30.02 61.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.633 -0.667 . . . . 0.0 109.851 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.89 -33.41 62.05 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.625 -0.672 . . . . 0.0 109.739 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.4 -29.43 66.06 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.709 -0.619 . . . . 0.0 109.858 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.476 HD12 HG12 ' B' ' 183' ' ' ILE . 0.3 OUTLIER -71.78 -42.41 67.17 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.715 -0.616 . . . . 0.0 109.761 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -66.88 -30.52 70.71 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.567 -0.708 . . . . 0.0 109.696 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -67.17 -29.42 69.1 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.706 -0.621 . . . . 0.0 109.803 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -47.64 71.05 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.598 -0.688 . . . . 0.0 109.614 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -62.78 -28.92 70.32 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.558 -0.714 . . . . 0.0 109.67 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -65.14 -29.54 70.39 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.654 -0.654 . . . . 0.0 109.996 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -65.36 -41.46 93.8 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.612 -0.68 . . . . 0.0 109.693 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.513 HD23 HD21 ' B' ' 172' ' ' LEU . 3.5 mt -61.77 -29.22 69.99 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.609 -0.682 . . . . 0.0 109.868 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.22 -35.72 79.78 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.594 -0.691 . . . . 0.0 109.636 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.4 mt -77.46 -29.59 52.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.739 -0.601 . . . . 0.0 109.789 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.574 ' HG2' HD11 ' B' ' 172' ' ' LEU . 10.8 tt0 -90.04 -14.52 33.7 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.671 -0.643 . . . . 0.0 110.807 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.461 HD11 HD11 ' B' ' 173' ' ' ILE . 52.0 tp . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.515 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.929 HD21 HD12 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -145.75 -75.52 0.21 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.621 -0.929 . . . . 0.0 110.492 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 3.9 t -138.0 19.51 2.82 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.124 -0.985 . . . . 0.0 110.924 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . 0.459 ' C ' HD13 ' B' ' 173' ' ' ILE . 18.5 tptm 50.82 25.91 2.36 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.134 -0.979 . . . . 0.0 110.67 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -150.73 -45.84 0.12 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.715 -0.615 . . . . 0.0 109.661 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.629 ' HB2' HD12 ' B' ' 167' ' ' LEU . 1.4 mp0 -68.23 -30.26 69.28 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.671 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.929 HD12 HD21 ' B' ' 167' ' ' LEU . 2.0 tt -81.51 -30.46 33.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.648 -0.657 . . . . 0.0 109.483 179.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.617 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.1 mp -74.13 -30.88 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -63.97 -32.73 74.37 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.488 ' O ' HG23 ' B' ' 179' ' ' VAL . 80.6 m-20 -76.18 -31.3 58.44 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.447 ' HE2' ' C ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -69.11 -29.01 67.0 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.664 -0.647 . . . . 0.0 109.83 179.547 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -75.04 -29.65 60.84 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.568 -0.708 . . . . 0.0 110.243 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -75.25 -29.73 60.28 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.59 -0.694 . . . . 0.0 110.043 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.488 HG23 ' O ' ' B' ' 175' ' ' ASN . 60.7 t -76.19 -28.63 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.629 -0.669 . . . . 0.0 109.837 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . 0.404 ' HA ' HD12 ' B' ' 183' ' ' ILE . 37.5 t70 -75.77 -28.63 58.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.631 -0.668 . . . . 0.0 110.07 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -28.49 59.89 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.588 -0.695 . . . . 0.0 110.117 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.7 -30.66 61.62 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.618 -0.676 . . . . 0.0 110.138 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.476 HG12 HD12 ' A' ' 79' ' ' LEU . 75.7 mt -73.42 -30.11 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.633 -0.667 . . . . 0.0 109.749 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.9 -32.45 69.41 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.669 -0.645 . . . . 0.0 109.713 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 5.5 mtp -71.99 -46.09 58.58 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.617 -0.677 . . . . 0.0 109.693 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -66.97 -31.31 52.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 119.989 -0.685 . . . . 0.0 109.286 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -66.24 -33.99 77.0 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.756 -0.59 . . . . 0.0 110.027 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 65.8 mm-40 -66.58 -27.53 67.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.582 -0.699 . . . . 0.0 110.0 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -23.32 57.7 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.586 -0.696 . . . . 0.0 110.408 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.624 HD13 HD22 ' A' ' 72' ' ' LEU . 33.8 mm -79.79 -36.8 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.369 -0.832 . . . . 0.0 109.55 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -30.53 63.95 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.735 -0.603 . . . . 0.0 109.736 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -75.33 -38.75 60.05 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.649 -0.657 . . . . 0.0 109.783 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.937 HD13 HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -72.0 -30.23 65.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.578 -0.701 . . . . 0.0 109.348 179.351 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -67.03 -37.69 84.56 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.351 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 24.4 tptt -66.43 -30.96 71.44 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.63 -0.669 . . . . 0.0 109.361 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -62.96 -37.57 87.61 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.702 -0.624 . . . . 0.0 109.464 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . 0.42 ' OE1' HD12 ' A' ' 69' ' ' ILE . 9.5 tp60 -62.49 -30.65 71.42 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.78 -0.575 . . . . 0.0 109.609 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -61.3 -41.31 96.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.705 -0.622 . . . . 0.0 110.016 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -63.28 -39.93 95.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.735 -0.603 . . . . 0.0 109.891 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.3 tp -72.83 -30.76 64.28 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.639 -0.663 . . . . 0.0 109.833 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.4 ' OE2' HD11 ' A' ' 62' ' ' LEU . 7.7 mm-40 . . . . . 0 N--CA 1.493 1.722 0 O-C-N 121.586 -0.696 . . . . 0.0 109.879 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.751 HD12 HD23 ' B' ' 200' ' ' LEU . 30.1 tp . . . . . 0 N--CA 1.495 1.783 0 CA-C-O 121.157 0.504 . . . . 0.0 110.015 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.24 -29.56 64.04 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.602 -0.686 . . . . 0.0 110.049 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -75.4 -33.27 60.96 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.592 -0.693 . . . . 0.0 109.892 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.7 m -71.18 -30.49 66.49 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.649 -0.657 . . . . 0.0 109.713 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -68.2 -29.14 67.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.607 -0.683 . . . . 0.0 109.978 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -66.58 -32.55 73.96 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.541 -0.725 . . . . 0.0 110.05 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -76.7 -32.82 58.12 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.643 -0.66 . . . . 0.0 109.853 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.69 HG12 HD22 ' B' ' 193' ' ' LEU . 83.9 mt -75.66 -28.96 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.719 -0.613 . . . . 0.0 109.597 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.7 tp -74.4 -33.6 63.06 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.662 -0.649 . . . . 0.0 109.845 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.63 -35.76 70.53 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.639 -0.663 . . . . 0.0 109.808 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.895 HD23 HD13 ' B' ' 190' ' ' ILE . 2.0 tp -68.67 -27.87 66.36 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.608 -0.683 . . . . 0.0 109.849 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -67.4 -35.51 79.45 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.544 -0.722 . . . . 0.0 109.493 179.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.19 -31.44 60.95 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -71.06 -30.79 67.04 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.753 -0.592 . . . . 0.0 109.712 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' B' ' 187' ' ' GLU . 13.1 tp -72.08 -31.31 65.96 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.592 -0.693 . . . . 0.0 109.689 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.09 -32.8 56.9 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.655 -0.653 . . . . 0.0 109.677 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.41 -31.24 63.74 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 120.121 -0.631 . . . . 0.0 109.376 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.709 HD23 ' HA ' ' B' ' 183' ' ' ILE . 3.3 tp -65.06 -33.85 77.03 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.663 -0.648 . . . . 0.0 109.425 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.406 ' NE2' HG21 ' B' ' 183' ' ' ILE . 0.0 OUTLIER -72.27 -31.32 65.66 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.697 -0.627 . . . . 0.0 109.49 179.266 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -67.98 -30.09 69.28 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.691 -0.63 . . . . 0.0 109.735 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -66.27 -44.96 82.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.646 -0.659 . . . . 0.0 109.914 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -66.91 -30.15 70.23 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.597 -0.69 . . . . 0.0 109.863 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -70.32 -29.27 65.94 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.713 -0.617 . . . . 0.0 109.894 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -67.4 -32.21 72.95 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.629 -0.67 . . . . 0.0 109.866 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.71 -30.55 69.22 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.593 -0.692 . . . . 0.0 109.969 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -68.54 -27.89 66.5 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.597 -0.689 . . . . 0.0 110.187 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.5 -28.66 64.07 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.524 -0.735 . . . . 0.0 110.025 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -117.82 25.6 10.26 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.627 -0.67 . . . . 0.0 110.532 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.1 HD23 ' HE3' ' B' ' 176' ' ' MET . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.061 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.928 HD21 HD13 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -139.78 -82.75 0.26 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.554 -0.968 . . . . 0.0 110.536 -179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 88.6 p -130.49 20.81 5.17 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.246 -0.909 . . . . 0.0 110.94 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.1 tptt 50.92 25.62 2.29 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.234 -0.916 . . . . 0.0 110.729 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -150.64 -46.09 0.12 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.724 -0.61 . . . . 0.0 109.643 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.626 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.4 OUTLIER -66.38 -29.88 70.14 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.982 -0.687 . . . . 0.0 109.447 179.418 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.928 HD13 HD21 ' B' ' 167' ' ' LEU . 14.8 tp -81.49 -33.2 32.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.704 -0.622 . . . . 0.0 109.386 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.62 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.1 mp -74.76 -31.37 26.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -64.06 -32.14 73.59 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.82 ' O ' HG23 ' B' ' 179' ' ' VAL . 78.4 m-20 -75.38 -32.72 60.89 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 1.1 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -66.45 -33.13 75.02 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.172 -0.611 . . . . 0.0 109.555 179.47 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -76.33 -31.59 58.21 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.639 -0.663 . . . . 0.0 109.751 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -74.31 -29.58 61.68 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.701 -0.624 . . . . 0.0 109.864 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.82 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.8 t -73.43 -29.57 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.658 -0.651 . . . . 0.0 109.763 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -75.37 -32.83 60.96 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.568 -0.707 . . . . 0.0 110.04 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -73.02 -29.43 63.0 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.71 -0.619 . . . . 0.0 109.864 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -73.42 -39.66 64.86 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.616 -0.677 . . . . 0.0 109.925 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.709 ' HA ' HD23 ' A' ' 79' ' ' LEU . 96.3 mt -66.81 -28.49 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.67 -0.644 . . . . 0.0 109.723 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 79.0 m -67.95 -37.07 81.14 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.609 -0.682 . . . . 0.0 109.672 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 19.9 tpp -70.73 -44.4 66.91 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.64 -0.662 . . . . 0.0 109.485 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 68.3 t -66.85 -35.79 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . 0.417 ' HA ' HD13 ' A' ' 76' ' ' LEU . 12.2 tt0 -63.7 -34.23 77.4 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.726 -0.609 . . . . 0.0 109.815 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.88 -24.88 62.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.681 -0.637 . . . . 0.0 110.033 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -24.83 57.33 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.547 -0.72 . . . . 0.0 110.458 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.895 HD13 HD23 ' A' ' 72' ' ' LEU . 32.8 mm -79.16 -34.86 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.354 -0.842 . . . . 0.0 109.601 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.1 m -75.55 -30.8 59.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.729 -0.607 . . . . 0.0 109.684 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 39.0 mmtt -74.68 -32.59 62.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.689 -0.632 . . . . 0.0 109.678 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.69 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -71.61 -35.83 70.6 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.566 -0.709 . . . . 0.0 109.424 179.459 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.2 -40.8 94.68 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.64 -0.663 . . . . 0.0 109.407 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -70.83 -32.05 68.96 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.687 -0.633 . . . . 0.0 109.378 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.451 ' HE2' HD23 ' B' ' 193' ' ' LEU . 16.8 ttpt -67.64 -31.88 72.19 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -65.46 -30.67 71.48 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.726 -0.608 . . . . 0.0 109.676 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -62.2 -43.47 98.76 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.713 -0.617 . . . . 0.0 109.829 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -61.54 -40.73 95.74 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.777 -0.577 . . . . 0.0 109.842 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.751 HD23 HD12 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -73.93 -32.53 63.55 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.533 -0.729 . . . . 0.0 109.558 179.502 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.499 ' HG2' HD21 ' A' ' 62' ' ' LEU . 4.8 mt-10 . . . . . 0 N--CA 1.492 1.671 0 O-C-N 121.791 -0.568 . . . . 0.0 109.747 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' B' ' 201' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 121.085 0.469 . . . . 0.0 110.021 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -75.22 -37.46 61.09 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.61 -0.681 . . . . 0.0 109.91 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -74.01 -30.55 62.51 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.733 -0.604 . . . . 0.0 109.672 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.506 HG21 ' NZ ' ' B' ' 196' ' ' LYS . 79.0 m -72.71 -29.94 63.79 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.677 -0.639 . . . . 0.0 109.71 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -68.94 -27.74 66.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.647 -0.658 . . . . 0.0 110.051 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -68.24 -33.21 73.96 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.45 -0.781 . . . . 0.0 110.14 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -75.65 -33.86 60.47 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.678 -0.639 . . . . 0.0 109.722 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.7 mt -71.82 -28.25 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.768 -0.583 . . . . 0.0 109.617 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.23 -38.27 78.43 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.558 -0.714 . . . . 0.0 109.796 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.3 tptp -68.74 -29.89 68.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.584 -0.697 . . . . 0.0 109.766 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.805 HD22 HG12 ' B' ' 190' ' ' ILE . 8.4 mt -68.58 -32.17 71.88 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.69 -0.631 . . . . 0.0 110.023 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -68.29 -33.46 74.39 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.64 -0.663 . . . . 0.0 109.829 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -75.34 -30.07 60.14 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.655 -0.653 . . . . 0.0 109.814 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -74.61 -30.12 61.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.698 -0.626 . . . . 0.0 109.905 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.407 HD13 HD12 ' B' ' 190' ' ' ILE . 28.8 tp -74.94 -34.01 62.04 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.661 -0.649 . . . . 0.0 109.901 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 22.0 mt -74.97 -32.31 61.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.674 -0.641 . . . . 0.0 109.743 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.68 -29.75 62.48 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.71 -0.618 . . . . 0.0 109.767 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.45 -41.13 56.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.712 -0.617 . . . . 0.0 109.614 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -71.05 -29.19 65.02 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.65 -0.656 . . . . 0.0 109.743 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -71.11 -29.65 65.53 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.593 -0.692 . . . . 0.0 109.716 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -68.03 -42.23 80.94 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.678 -0.639 . . . . 0.0 109.867 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -66.91 -28.96 68.73 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.546 -0.721 . . . . 0.0 109.864 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -68.76 -30.94 69.65 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.644 -0.66 . . . . 0.0 109.95 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -65.04 -38.07 89.65 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.606 -0.684 . . . . 0.0 109.784 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.426 ' C ' ' HE2' ' B' ' 176' ' ' MET . 2.0 mt -61.25 -33.84 74.18 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.707 -0.621 . . . . 0.0 109.98 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -63.35 -46.06 88.33 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.511 -0.743 . . . . 0.0 109.905 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 42.4 mt -69.31 -28.63 66.43 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.734 -0.604 . . . . 0.0 109.862 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -100.52 7.95 43.79 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.673 -0.642 . . . . 0.0 110.997 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.786 HD12 HD22 ' B' ' 172' ' ' LEU . 53.0 tp . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.304 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.938 HD21 HD12 ' B' ' 172' ' ' LEU . 0.1 OUTLIER -141.86 -84.08 0.19 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.51 -0.994 . . . . 0.0 110.454 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 66.7 m -127.84 19.35 6.62 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.064 -1.022 . . . . 0.0 110.819 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 16.7 tptt 50.71 25.92 2.29 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.237 -0.915 . . . . 0.0 110.652 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -148.96 -46.74 0.14 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.643 -0.661 . . . . 0.0 109.453 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.586 ' HB2' HD12 ' B' ' 167' ' ' LEU . 1.1 mt-10 -66.3 -34.75 78.7 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.248 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.938 HD12 HD21 ' B' ' 167' ' ' LEU . 5.5 tt -77.63 -29.35 51.75 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.492 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.5 mm -68.56 -31.07 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.702 -0.624 . . . . 0.0 109.358 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -76.29 -30.31 57.73 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.672 -0.643 . . . . 0.0 109.835 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.784 ' O ' HG23 ' B' ' 179' ' ' VAL . 76.2 m-20 -75.05 -30.1 60.92 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.718 -0.614 . . . . 0.0 109.847 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.452 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -72.05 -31.19 65.91 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.636 -0.665 . . . . 0.0 109.848 179.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.72 -29.97 56.44 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.956 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -76.81 -30.1 56.26 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.608 -0.683 . . . . 0.0 109.829 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.784 HG23 ' O ' ' B' ' 175' ' ' ASN . 71.1 t -74.48 -29.69 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.616 -0.677 . . . . 0.0 109.687 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -71.63 -28.8 64.02 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.583 -0.698 . . . . 0.0 109.99 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 22.1 mtp180 -74.88 -29.49 61.03 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.591 -0.693 . . . . 0.0 110.031 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . 0.501 ' O ' HG23 ' B' ' 186' ' ' VAL . 3.0 tp10 -74.64 -34.44 62.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.725 -0.609 . . . . 0.0 110.039 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 78.3 mt -71.18 -28.77 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.715 -0.616 . . . . 0.0 109.768 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.6 m -72.17 -33.59 67.82 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.59 -0.694 . . . . 0.0 109.803 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 11.2 ttt -75.46 -36.86 60.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.62 -0.675 . . . . 0.0 109.733 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . 0.501 HG23 ' O ' ' B' ' 182' ' ' GLU . 58.5 t -74.88 -30.58 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.7 -0.625 . . . . 0.0 109.528 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -75.48 -28.77 59.34 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.716 -0.615 . . . . 0.0 109.915 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -74.44 -28.98 61.29 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.648 -0.657 . . . . 0.0 109.992 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.27 -36.71 63.84 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.637 -0.665 . . . . 0.0 109.952 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.805 HG12 HD22 ' A' ' 72' ' ' LEU . 82.0 mt -72.1 -31.55 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.621 -0.674 . . . . 0.0 109.607 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 3.7 m -71.36 -35.85 71.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.698 -0.626 . . . . 0.0 109.571 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 14.7 mmtt -75.52 -32.47 60.49 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.517 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.691 HD13 HD11 ' A' ' 72' ' ' LEU . 0.3 OUTLIER -77.0 -17.65 58.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.695 -0.628 . . . . 0.0 110.426 179.49 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 7.3 tptt -85.53 -27.0 25.87 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.349 -0.844 . . . . 0.0 109.545 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -76.45 -32.84 58.66 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.624 -0.673 . . . . 0.0 110.006 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.506 ' NZ ' HG21 ' A' ' 65' ' ' THR . 0.0 OUTLIER -70.56 -25.07 62.92 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.495 -0.753 . . . . 0.0 109.896 179.533 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -70.39 -30.07 66.88 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.509 -0.744 . . . . 0.0 109.591 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.61 -46.69 87.1 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.596 -0.69 . . . . 0.0 109.513 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -61.74 -36.94 82.44 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.738 -0.601 . . . . 0.0 109.899 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 19.6 tp -75.47 -35.32 60.89 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.603 -0.686 . . . . 0.0 109.658 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.585 ' HA ' HD11 ' A' ' 62' ' ' LEU . 13.5 mt-10 . . . . . 0 N--CA 1.493 1.716 0 O-C-N 121.66 -0.65 . . . . 0.0 109.641 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.717 ' HG ' HD23 ' B' ' 200' ' ' LEU . 2.0 mp . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 121.094 0.473 . . . . 0.0 109.97 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -67.23 -30.63 70.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.543 -0.723 . . . . 0.0 110.007 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -75.03 -39.23 61.18 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.608 -0.682 . . . . 0.0 109.87 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 47.3 m -72.21 -30.75 65.23 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.655 -0.653 . . . . 0.0 109.638 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -71.72 -27.47 63.02 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.647 -0.658 . . . . 0.0 109.967 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -69.64 -34.84 74.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.626 -0.671 . . . . 0.0 110.175 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 -75.67 -35.27 60.42 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.612 -0.68 . . . . 0.0 109.652 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.3 mt -72.34 -27.52 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.781 -0.574 . . . . 0.0 109.554 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.405 HD23 ' C ' ' A' ' 70' ' ' LEU . 9.6 tt -71.13 -38.88 72.27 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.635 -0.666 . . . . 0.0 109.915 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -35.02 79.51 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.596 -0.69 . . . . 0.0 109.676 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.614 ' CD1' HD13 ' B' ' 193' ' ' LEU . 5.5 mt -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.719 -0.613 . . . . 0.0 109.825 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.9 -36.13 83.38 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.607 -0.683 . . . . 0.0 109.977 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -76.1 -30.98 58.48 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.634 -0.666 . . . . 0.0 109.724 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tttm -77.19 -31.71 55.55 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.715 -0.616 . . . . 0.0 109.774 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 36.4 tp -77.74 -30.65 51.73 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.624 -0.672 . . . . 0.0 109.681 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.79 -30.94 56.66 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.678 -0.639 . . . . 0.0 109.639 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.32 -29.99 61.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.593 -0.692 . . . . 0.0 109.956 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.405 HD12 HG12 ' B' ' 183' ' ' ILE . 0.4 OUTLIER -76.34 -38.2 56.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.639 -0.663 . . . . 0.0 109.631 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -71.69 -29.07 64.17 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.589 -0.694 . . . . 0.0 109.748 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -71.4 -29.47 64.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.581 -0.7 . . . . 0.0 109.866 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -70.8 -43.57 68.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.619 -0.676 . . . . 0.0 109.852 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -62.96 -29.31 70.71 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.587 -0.696 . . . . 0.0 109.748 179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -63.44 -31.14 72.21 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.622 -0.674 . . . . 0.0 109.848 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -62.8 -32.82 74.08 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.672 -0.643 . . . . 0.0 109.852 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.487 HD13 ' HG2' ' B' ' 176' ' ' MET . 0.4 OUTLIER -68.39 -35.93 78.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.647 -0.658 . . . . 0.0 109.81 179.692 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -64.18 -29.24 70.36 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.682 -0.636 . . . . 0.0 110.052 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 tp -65.85 -30.12 70.68 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.58 -0.7 . . . . 0.0 110.004 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.58 27.38 9.23 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.601 -0.687 . . . . 0.0 110.289 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.772 HD11 ' CD1' ' B' ' 173' ' ' ILE . 51.2 tp . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 118.045 -0.978 . . . . 0.0 110.168 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.882 HD21 HD13 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -140.84 -84.07 0.21 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.578 -0.954 . . . . 0.0 110.561 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -128.64 19.66 6.16 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.143 -0.973 . . . . 0.0 110.9 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 7.6 tptm 50.76 26.09 2.4 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.21 -0.931 . . . . 0.0 110.604 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -149.33 -45.87 0.14 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.627 -0.67 . . . . 0.0 109.694 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.599 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.1 OUTLIER -66.45 -35.85 81.33 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.804 -0.759 . . . . 0.0 109.292 179.498 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.882 HD13 HD21 ' B' ' 167' ' ' LEU . 10.2 tp -76.9 -28.79 55.45 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 178.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.772 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.7 mm -66.59 -31.38 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.616 -0.677 . . . . 0.0 109.196 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -74.98 -31.08 61.35 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.124 -0.63 . . . . 0.0 109.775 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.596 ' O ' HG23 ' B' ' 179' ' ' VAL . 83.7 m-20 -75.03 -34.72 61.91 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.681 -0.637 . . . . 0.0 109.77 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.574 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -70.01 -30.67 68.03 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.743 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -67.15 -35.26 79.33 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.666 -0.647 . . . . 0.0 109.727 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.51 -30.73 59.92 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.72 -0.612 . . . . 0.0 109.686 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.596 HG23 ' O ' ' B' ' 175' ' ' ASN . 69.3 t -76.67 -30.96 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.702 -0.624 . . . . 0.0 109.569 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -75.24 -29.72 60.31 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.728 -0.608 . . . . 0.0 109.907 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -73.47 -30.16 62.99 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.691 -0.631 . . . . 0.0 109.851 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -72.53 -36.91 68.41 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.652 -0.655 . . . . 0.0 109.965 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.405 HG12 HD12 ' A' ' 79' ' ' LEU . 82.0 mt -70.02 -30.52 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.705 -0.622 . . . . 0.0 109.652 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.8 m -68.58 -35.04 76.82 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.673 -0.642 . . . . 0.0 109.652 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -46.63 74.79 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.582 -0.699 . . . . 0.0 109.659 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 60.5 t -70.57 -33.03 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.634 -0.666 . . . . 0.0 109.307 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -72.86 -29.95 63.6 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.775 -0.578 . . . . 0.0 109.675 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 37.5 mm-40 -68.89 -30.27 68.73 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.636 -0.665 . . . . 0.0 109.781 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.55 -36.83 63.11 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.594 -0.691 . . . . 0.0 109.841 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.609 ' CG1' HD22 ' A' ' 72' ' ' LEU . 79.4 mt -69.54 -30.58 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.627 -0.671 . . . . 0.0 109.523 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 20.4 m -66.67 -40.29 88.53 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.701 -0.624 . . . . 0.0 109.612 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -72.32 -31.53 65.75 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 120.087 -0.645 . . . . 0.0 109.495 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.614 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.4 OUTLIER -72.39 -35.41 68.41 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.756 -0.59 . . . . 0.0 109.418 179.364 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -68.5 -43.09 77.6 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.693 -0.63 . . . . 0.0 109.497 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -67.3 -32.0 72.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.667 -0.646 . . . . 0.0 109.327 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -34.89 79.25 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -63.01 -30.37 71.55 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.795 -0.566 . . . . 0.0 109.637 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.42 -46.24 90.93 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.705 -0.622 . . . . 0.0 109.743 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -62.09 -46.2 90.11 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.714 -0.617 . . . . 0.0 109.843 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.717 HD23 ' HG ' ' A' ' 62' ' ' LEU . 4.9 tp -69.48 -34.34 74.19 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.623 -0.673 . . . . 0.0 109.822 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.649 -0.657 . . . . 0.0 109.811 179.507 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.665 HD11 ' HG2' ' B' ' 201' ' ' GLU . 6.1 tp . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 121.115 0.483 . . . . 0.0 110.131 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -76.29 -31.71 58.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.579 -0.701 . . . . 0.0 110.082 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -76.78 -30.8 56.63 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.596 -0.69 . . . . 0.0 109.798 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.459 HG22 HD11 ' A' ' 69' ' ' ILE . 5.9 m -75.16 -30.04 60.62 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.686 -0.634 . . . . 0.0 109.755 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.1 mmtt -72.33 -27.21 62.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.624 -0.672 . . . . 0.0 110.137 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -72.86 -35.32 67.18 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.562 -0.711 . . . . 0.0 110.206 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.1 tp60 -76.07 -35.09 59.56 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.502 -0.748 . . . . 0.0 109.706 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.806 HG12 HD23 ' B' ' 193' ' ' LEU . 67.6 mt -75.39 -28.62 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.771 -0.58 . . . . 0.0 109.503 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.469 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.3 tt -75.19 -36.93 61.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.625 -0.672 . . . . 0.0 109.601 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -66.31 -29.45 69.65 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.469 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.629 HD22 HG12 ' B' ' 190' ' ' ILE . 6.6 mt -62.04 -33.03 73.62 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.695 -0.628 . . . . 0.0 109.899 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -61.6 -36.04 79.56 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.523 -0.736 . . . . 0.0 109.888 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -77.31 -31.46 54.66 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.71 -0.618 . . . . 0.0 109.353 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.596 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -74.3 -30.67 62.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.705 -0.622 . . . . 0.0 109.621 179.517 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -74.01 -34.89 64.32 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.667 -0.646 . . . . 0.0 109.647 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tp -71.83 -36.71 70.3 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.693 -0.629 . . . . 0.0 109.61 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.69 -30.38 71.06 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.745 -0.597 . . . . 0.0 109.481 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' B' ' 183' ' ' ILE . 2.8 mp -61.6 -41.88 98.08 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.707 -0.621 . . . . 0.0 109.828 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -67.58 -30.26 69.84 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.614 -0.679 . . . . 0.0 109.753 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -30.18 69.42 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.688 -0.632 . . . . 0.0 109.765 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.33 -49.29 57.09 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.657 -0.652 . . . . 0.0 109.782 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.9 ttpt -66.96 -31.27 71.73 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.578 -0.701 . . . . 0.0 109.494 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -70.12 -30.24 67.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.753 -0.592 . . . . 0.0 109.775 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -67.43 -29.72 69.28 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.571 -0.706 . . . . 0.0 109.886 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.59 HD23 HD21 ' B' ' 172' ' ' LEU . 0.7 OUTLIER -66.47 -39.55 88.85 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.579 -0.701 . . . . 0.0 109.922 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -61.14 -29.26 69.67 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.546 -0.721 . . . . 0.0 110.14 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.9 tp -70.32 -27.65 64.54 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.628 -0.67 . . . . 0.0 110.199 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -119.84 26.99 8.96 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.528 -0.733 . . . . 0.0 110.412 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.71 HD13 ' CE ' ' B' ' 176' ' ' MET . 29.2 tp . . . . . 0 N--CA 1.496 1.861 0 CA-C-O 117.933 -1.032 . . . . 0.0 109.989 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.779 HD21 HD12 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -142.43 -77.59 0.25 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.553 -0.969 . . . . 0.0 110.536 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 18.1 t -136.48 18.62 3.12 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.105 -0.997 . . . . 0.0 110.876 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 40.6 tptt 50.67 25.95 2.28 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.238 -0.914 . . . . 0.0 110.562 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -148.23 -46.66 0.16 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.692 -0.63 . . . . 0.0 109.386 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.598 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.4 OUTLIER -68.18 -32.56 72.88 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.21 179.331 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.779 HD12 HD21 ' B' ' 167' ' ' LEU . 3.9 tt -78.96 -29.28 43.88 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.531 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.8 mm -68.61 -30.55 47.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.721 -0.612 . . . . 0.0 109.4 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -72.67 -30.55 64.36 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.6 -0.688 . . . . 0.0 109.803 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.793 ' O ' HG23 ' B' ' 179' ' ' VAL . 96.9 m-20 -74.67 -31.7 62.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.619 -0.676 . . . . 0.0 109.701 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.71 ' CE ' HD13 ' A' ' 90' ' ' LEU . 1.6 mtt -70.16 -30.83 68.08 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.763 -0.586 . . . . 0.0 109.869 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -76.95 -30.94 56.25 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.635 -0.666 . . . . 0.0 109.886 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -29.84 57.37 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.661 -0.649 . . . . 0.0 109.735 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.793 HG23 ' O ' ' B' ' 175' ' ' ASN . 73.9 t -74.39 -28.45 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.6 -0.688 . . . . 0.0 109.81 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -74.65 -36.72 62.86 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.613 -0.68 . . . . 0.0 110.047 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 15.3 mtt85 -70.09 -26.32 63.93 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.639 -0.663 . . . . 0.0 109.977 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -72.87 -36.1 67.31 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.515 -0.741 . . . . 0.0 110.142 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.752 ' HA ' HD23 ' A' ' 79' ' ' LEU . 87.3 mt -67.89 -27.94 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.57 -0.707 . . . . 0.0 109.874 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 7.8 m -67.97 -34.61 76.89 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.559 -0.713 . . . . 0.0 109.787 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 mtm -73.78 -37.71 64.9 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.6 -0.688 . . . . 0.0 109.742 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . 0.678 HG21 HD21 ' A' ' 79' ' ' LEU . 57.7 t -73.29 -30.42 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.642 -0.661 . . . . 0.0 109.616 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.56 -29.22 61.27 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.6 -0.688 . . . . 0.0 109.991 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -30.85 63.37 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.651 -0.655 . . . . 0.0 109.939 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -32.57 69.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.625 -0.672 . . . . 0.0 109.942 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.629 HG12 HD22 ' A' ' 72' ' ' LEU . 78.1 mt -75.3 -30.71 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.546 -0.721 . . . . 0.0 109.739 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 27.6 m -75.53 -35.86 60.62 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.632 -0.667 . . . . 0.0 109.654 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 28.5 mtmt -73.48 -34.19 65.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.662 -0.649 . . . . 0.0 109.538 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.806 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -69.28 -35.6 76.21 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -64.15 -47.32 80.37 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -67.43 -31.93 72.45 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -64.83 -34.18 77.77 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -63.41 -30.85 71.91 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 120.223 -0.591 . . . . 0.0 109.48 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -60.98 -45.89 92.96 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.655 -0.653 . . . . 0.0 109.885 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -61.82 -39.51 92.04 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.745 -0.597 . . . . 0.0 109.739 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 13.7 tp -74.89 -30.52 61.33 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.65 -0.656 . . . . 0.0 109.582 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.665 ' HG2' HD11 ' A' ' 62' ' ' LEU . 24.5 mt-10 . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.644 -0.66 . . . . 0.0 109.761 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.499 HD11 ' CG ' ' B' ' 201' ' ' GLU . 10.3 tt . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 121.112 0.482 . . . . 0.0 110.082 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -64.58 -31.41 72.61 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.626 -0.671 . . . . 0.0 110.067 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -72.25 -33.15 67.29 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.595 -0.69 . . . . 0.0 109.924 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.8 m -70.56 -38.51 74.15 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.689 -0.632 . . . . 0.0 109.76 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -63.99 -27.04 68.86 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.625 -0.672 . . . . 0.0 109.943 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -66.82 -39.58 87.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.532 -0.73 . . . . 0.0 110.204 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.0 tp60 -76.07 -31.48 58.8 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.608 -0.682 . . . . 0.0 109.624 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.816 HG12 HD23 ' B' ' 193' ' ' LEU . 90.8 mt -77.42 -28.12 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.743 -0.598 . . . . 0.0 109.533 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 24.5 tp -75.14 -38.12 61.14 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.585 -0.697 . . . . 0.0 109.536 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -65.54 -30.95 71.76 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.623 -0.673 . . . . 0.0 109.565 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.613 HD22 HG12 ' B' ' 190' ' ' ILE . 6.7 mt -62.64 -35.72 80.54 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.655 -0.653 . . . . 0.0 110.06 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.403 ' O ' HD13 ' A' ' 77' ' ' LEU . 3.1 tt0 -61.99 -35.69 79.24 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.598 -0.689 . . . . 0.0 110.033 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -76.16 -30.66 58.18 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.612 -0.68 . . . . 0.0 109.731 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.6 tttt -75.81 -28.95 58.51 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.658 -0.651 . . . . 0.0 109.888 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.7 tp -76.83 -32.37 57.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.676 -0.64 . . . . 0.0 109.984 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 73' ' ' GLU . 0.9 OUTLIER -76.64 -31.56 57.45 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.652 -0.655 . . . . 0.0 109.792 179.7 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.24 -27.71 59.6 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.699 -0.626 . . . . 0.0 110.068 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.761 HD23 ' HA ' ' B' ' 183' ' ' ILE . 7.1 tp -76.55 -31.66 57.72 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.543 -0.723 . . . . 0.0 110.086 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -75.07 -30.48 60.99 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.642 -0.661 . . . . 0.0 109.784 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -71.91 -28.13 63.29 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.689 -0.632 . . . . 0.0 109.81 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -68.76 -37.5 79.4 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.565 -0.709 . . . . 0.0 110.012 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -70.32 -29.65 66.42 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.474 -0.766 . . . . 0.0 109.923 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -69.67 -29.83 67.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.591 -0.693 . . . . 0.0 109.75 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.0 tm0? -64.85 -34.19 77.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.647 -0.658 . . . . 0.0 109.959 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.44 HD23 HD21 ' B' ' 172' ' ' LEU . 0.5 OUTLIER -64.24 -38.62 91.7 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.586 -0.696 . . . . 0.0 109.858 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.405 ' N ' ' HE2' ' B' ' 176' ' ' MET . 9.6 m-85 -60.76 -28.59 68.84 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.628 -0.67 . . . . 0.0 110.141 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 66.7 mt -72.85 -28.72 62.7 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.572 -0.705 . . . . 0.0 110.138 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -116.99 25.82 10.23 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.628 -0.67 . . . . 0.0 110.433 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.106 HD23 ' HE3' ' B' ' 176' ' ' MET . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.805 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.903 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.741 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.0 OUTLIER -149.66 -80.03 0.13 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.476 -1.014 . . . . 0.0 110.524 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 3.1 t -134.18 19.2 3.72 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.234 -0.916 . . . . 0.0 110.919 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 25.4 tptt 50.63 25.92 2.24 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.175 -0.953 . . . . 0.0 110.598 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -148.2 -46.66 0.16 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.722 -0.611 . . . . 0.0 109.354 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.626 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.8 mm-40 -67.77 -32.16 72.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.593 -0.692 . . . . 0.0 109.32 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.782 HD22 HD22 ' A' ' 90' ' ' LEU . 1.3 tt -78.95 -28.17 43.66 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.762 ' CD1' HD11 ' A' ' 90' ' ' LEU . 49.6 mm -70.6 -31.41 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.652 -0.655 . . . . 0.0 109.418 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 52.9 tp60 -71.07 -28.22 64.2 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.666 -0.646 . . . . 0.0 109.939 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.722 ' O ' HG23 ' B' ' 179' ' ' VAL . 70.7 m-20 -70.34 -28.62 65.28 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.622 -0.674 . . . . 0.0 110.151 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 1.106 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -75.27 -31.84 60.87 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.49 -0.757 . . . . 0.0 110.049 179.845 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -73.18 -30.02 63.25 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.614 -0.679 . . . . 0.0 109.967 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -77.69 -30.52 51.94 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.645 -0.659 . . . . 0.0 109.865 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.722 HG23 ' O ' ' B' ' 175' ' ' ASN . 65.7 t -76.8 -30.31 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.698 -0.626 . . . . 0.0 109.738 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -76.98 -29.64 55.61 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.7 -0.625 . . . . 0.0 109.989 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.5 -28.32 59.13 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.655 -0.653 . . . . 0.0 109.971 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -74.96 -33.85 61.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.613 -0.68 . . . . 0.0 110.052 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.761 ' HA ' HD23 ' A' ' 79' ' ' LEU . 89.1 mt -71.47 -28.23 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.589 -0.694 . . . . 0.0 109.817 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.7 m -71.51 -34.73 70.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.57 -0.706 . . . . 0.0 109.918 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -39.21 62.87 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.597 -0.689 . . . . 0.0 109.775 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 60.2 t -74.34 -29.89 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.569 -0.707 . . . . 0.0 109.564 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -76.34 -28.48 56.89 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.623 -0.673 . . . . 0.0 109.958 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -75.13 -28.06 60.04 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.539 -0.725 . . . . 0.0 110.11 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.89 -29.22 61.95 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.585 -0.697 . . . . 0.0 110.022 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.613 HG12 HD22 ' A' ' 72' ' ' LEU . 81.0 mt -76.04 -34.28 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.632 -0.667 . . . . 0.0 109.71 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 86.9 p -70.57 -30.95 67.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.74 -0.6 . . . . 0.0 109.501 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 25.2 mmtt -77.36 -33.86 55.2 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.638 -0.664 . . . . 0.0 109.591 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.816 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -72.5 -31.52 65.42 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.594 -0.691 . . . . 0.0 109.27 179.283 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -66.96 -41.27 87.18 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.614 -0.679 . . . . 0.0 109.476 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -71.32 -31.77 67.81 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.676 -0.64 . . . . 0.0 109.284 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 9.7 ttpt -67.88 -32.39 72.85 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -64.77 -30.07 71.06 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.706 -0.621 . . . . 0.0 109.485 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.77 -46.07 91.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.652 -0.655 . . . . 0.0 109.81 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -61.92 -37.72 85.71 Favored 'General case' 0 N--CA 1.496 1.842 0 C-N-CA 120.228 -0.589 . . . . 0.0 109.807 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.6 tp -73.59 -33.61 64.69 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.583 -0.698 . . . . 0.0 109.673 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.499 ' CG ' HD11 ' A' ' 62' ' ' LEU . 8.4 mt-10 . . . . . 0 N--CA 1.493 1.695 0 O-C-N 121.684 -0.635 . . . . 0.0 109.707 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.654 ' HG ' HD23 ' B' ' 200' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 121.044 0.45 . . . . 0.0 110.059 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -72.23 -34.29 68.2 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.035 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -75.06 -31.33 61.24 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.635 -0.665 . . . . 0.0 109.779 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 56.7 m -72.52 -29.79 63.91 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.717 -0.614 . . . . 0.0 109.76 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -69.15 -26.98 65.14 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.619 -0.676 . . . . 0.0 110.149 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -70.36 -31.89 69.35 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.586 -0.697 . . . . 0.0 110.328 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.1 tp60 -77.51 -34.25 54.12 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.492 -0.755 . . . . 0.0 109.847 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.762 HG12 HD22 ' B' ' 193' ' ' LEU . 81.1 mt -74.08 -26.98 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.721 -0.612 . . . . 0.0 109.56 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.9 mt -72.38 -37.27 68.8 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.5 -0.75 . . . . 0.0 109.882 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -65.26 -30.63 71.53 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.585 -0.697 . . . . 0.0 109.846 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.699 HD12 HG12 ' B' ' 190' ' ' ILE . 1.6 mm? -68.72 -29.27 67.65 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.65 -0.656 . . . . 0.0 110.049 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.514 ' O ' HD13 ' A' ' 77' ' ' LEU . 22.8 mt-10 -69.44 -33.74 73.39 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.546 -0.721 . . . . 0.0 110.033 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -30.0 58.56 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.646 -0.659 . . . . 0.0 109.87 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -76.19 -29.42 57.66 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.686 -0.634 . . . . 0.0 109.986 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.687 HD13 HD12 ' B' ' 190' ' ' ILE . 13.5 tp -76.76 -32.12 57.51 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.585 -0.697 . . . . 0.0 109.863 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 73' ' ' GLU . 5.6 mp -76.55 -32.56 58.27 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.747 -0.595 . . . . 0.0 109.782 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.1 -28.73 61.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.698 -0.626 . . . . 0.0 109.811 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.529 HD12 HG12 ' B' ' 183' ' ' ILE . 0.8 OUTLIER -74.0 -36.69 64.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.619 -0.676 . . . . 0.0 109.89 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -69.25 -28.37 66.27 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.593 -0.692 . . . . 0.0 110.014 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -70.94 -27.92 64.11 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.564 -0.71 . . . . 0.0 110.052 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -44.18 64.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.532 -0.73 . . . . 0.0 109.804 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.6 ttpp -62.78 -27.66 69.45 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.513 -0.742 . . . . 0.0 109.673 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -63.95 -32.95 74.66 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.565 -0.71 . . . . 0.0 110.023 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -64.49 -34.88 79.24 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.534 -0.729 . . . . 0.0 109.792 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' B' ' 176' ' ' MET . 0.6 OUTLIER -64.22 -35.22 80.1 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.599 -0.688 . . . . 0.0 109.896 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -60.75 -35.45 76.42 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.585 -0.697 . . . . 0.0 110.029 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mt -62.81 -30.31 71.38 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.637 -0.664 . . . . 0.0 109.674 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -96.77 -26.79 15.01 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.693 -0.63 . . . . 0.0 110.095 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.759 HD11 ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.005 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.494 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . 0.716 ' HA2' HD22 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.75 HD12 ' N ' ' B' ' 168' ' ' SER . 0.5 OUTLIER -119.5 -28.62 5.29 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.589 -0.947 . . . . 0.0 110.615 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.75 ' N ' HD12 ' B' ' 167' ' ' LEU . 8.3 t -165.84 18.12 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.349 -0.845 . . . . 0.0 111.62 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 48.66 26.58 1.26 Allowed 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.095 -1.003 . . . . 0.0 111.291 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -154.44 -46.56 0.09 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.723 -0.611 . . . . 0.0 110.109 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.465 ' HB2' HD13 ' B' ' 167' ' ' LEU . 5.2 mt-10 -74.12 -35.38 64.12 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.921 -0.712 . . . . 0.0 109.291 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.735 ' N ' HD11 ' B' ' 167' ' ' LEU . 19.3 tp -76.01 -26.48 56.71 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.759 ' CD1' HD11 ' A' ' 90' ' ' LEU . 49.1 mm -69.22 -32.85 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -70.44 -30.18 66.96 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.716 -0.615 . . . . 0.0 109.869 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.416 ' O ' HG23 ' B' ' 179' ' ' VAL . 89.8 m-20 -67.22 -32.24 73.16 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.612 -0.68 . . . . 0.0 109.858 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.562 ' HE1' ' HG ' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -71.14 -31.51 67.81 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.713 -0.617 . . . . 0.0 109.746 179.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.79 -30.27 63.96 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.707 -0.621 . . . . 0.0 109.856 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -39.94 61.96 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.619 -0.676 . . . . 0.0 109.926 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.416 HG23 ' O ' ' B' ' 175' ' ' ASN . 61.2 t -72.09 -30.97 38.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.675 -0.641 . . . . 0.0 109.458 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.73 -30.09 65.25 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.664 -0.648 . . . . 0.0 109.748 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -67.33 -32.75 73.92 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.645 -0.659 . . . . 0.0 109.768 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . 0.525 ' O ' HG23 ' B' ' 186' ' ' VAL . 16.4 tt0 -74.14 -35.87 64.1 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.58 -0.7 . . . . 0.0 109.942 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.529 HG12 HD12 ' A' ' 79' ' ' LEU . 82.5 mt -72.99 -29.76 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.703 -0.623 . . . . 0.0 109.705 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 53.7 m -74.15 -32.7 63.24 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.633 -0.667 . . . . 0.0 109.806 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.0 mtt -74.33 -39.27 62.94 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.669 -0.644 . . . . 0.0 109.705 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . 0.525 HG23 ' O ' ' B' ' 182' ' ' GLU . 57.3 t -72.33 -30.83 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.586 -0.696 . . . . 0.0 109.511 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -72.72 -29.7 63.58 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.711 -0.618 . . . . 0.0 109.905 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -29.89 66.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.641 -0.662 . . . . 0.0 109.899 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.06 -34.05 63.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.706 -0.621 . . . . 0.0 109.989 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.699 HG12 HD12 ' A' ' 72' ' ' LEU . 72.9 mt -73.86 -31.77 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.583 -0.698 . . . . 0.0 109.742 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 89.8 p -72.21 -34.88 68.69 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.615 -0.678 . . . . 0.0 109.462 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 4.0 mmmt -76.35 -32.51 58.69 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.366 179.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.762 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -71.08 -31.37 67.73 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 179.276 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.9 tptt -68.83 -46.68 67.94 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.592 -0.693 . . . . 0.0 109.651 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 3.2 tptp -66.58 -31.47 72.19 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.563 -0.71 . . . . 0.0 109.287 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -65.25 -34.87 79.37 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . 0.446 HE22 HD12 ' A' ' 69' ' ' ILE . 5.1 tt0 -65.3 -29.11 69.84 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.688 -0.633 . . . . 0.0 109.676 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -62.16 -40.19 95.16 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.629 -0.669 . . . . 0.0 109.76 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -62.49 -34.63 77.22 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.79 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.654 HD23 ' HG ' ' A' ' 62' ' ' LEU . 11.0 tp -76.88 -30.69 56.33 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.653 -0.655 . . . . 0.0 109.702 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.514 ' HG2' HD11 ' A' ' 62' ' ' LEU . 8.8 mt-10 . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.613 -0.68 . . . . 0.0 109.713 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.907 HD22 HD23 ' B' ' 200' ' ' LEU . 1.5 mm? . . . . . 0 N--CA 1.495 1.778 0 CA-C-O 121.028 0.442 . . . . 0.0 109.842 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -63.24 -41.82 99.13 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.666 -0.646 . . . . 0.0 109.997 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -72.16 -37.55 69.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.667 -0.646 . . . . 0.0 109.642 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.49 HG22 ' CD1' ' A' ' 69' ' ' ILE . 89.7 m -73.62 -30.9 63.25 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.757 -0.59 . . . . 0.0 109.413 179.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -69.9 -27.66 64.98 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 120.166 -0.614 . . . . 0.0 109.92 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.47 -38.54 81.16 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.587 -0.695 . . . . 0.0 110.084 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -75.99 -36.02 59.36 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.612 -0.68 . . . . 0.0 109.606 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.738 HG12 HD23 ' B' ' 193' ' ' LEU . 86.1 mt -75.61 -26.2 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.777 -0.577 . . . . 0.0 109.644 179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.419 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.0 tt -76.03 -33.89 59.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.549 -0.72 . . . . 0.0 109.812 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.9 mmtm -70.41 -32.97 70.82 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.601 -0.687 . . . . 0.0 109.655 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.704 HD22 HG12 ' B' ' 190' ' ' ILE . 6.9 mt -65.8 -29.96 70.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.679 -0.638 . . . . 0.0 109.707 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.11 -44.18 96.39 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.648 -0.658 . . . . 0.0 109.82 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.08 -32.5 72.87 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.693 -0.63 . . . . 0.0 109.428 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -67.53 -35.2 78.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.773 -0.579 . . . . 0.0 109.743 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -71.19 -31.64 67.88 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.719 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.65 -38.72 67.58 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.718 -0.614 . . . . 0.0 109.572 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.17 -30.57 71.08 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.714 -0.617 . . . . 0.0 109.742 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.418 ' HA ' HD13 ' A' ' 79' ' ' LEU . 1.1 mm? -70.33 -46.75 63.55 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.708 -0.62 . . . . 0.0 109.734 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -64.28 -31.04 72.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.633 -0.667 . . . . 0.0 109.602 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.75 -29.43 69.95 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.688 -0.633 . . . . 0.0 109.781 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -64.62 -47.65 77.78 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.656 -0.653 . . . . 0.0 109.669 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 tptm -63.1 -30.77 71.86 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.671 -0.643 . . . . 0.0 109.619 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.6 t60 -64.93 -34.31 78.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.744 -0.598 . . . . 0.0 109.832 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -70.52 -37.35 74.11 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.709 -0.619 . . . . 0.0 109.745 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.641 HD23 HD21 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -66.1 -29.42 69.74 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.711 -0.618 . . . . 0.0 109.763 179.557 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -29.53 69.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.57 -0.706 . . . . 0.0 109.829 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.0 mp -76.62 -28.83 56.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.702 -0.624 . . . . 0.0 110.044 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -95.72 1.61 53.51 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.578 -0.701 . . . . 0.0 111.071 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.533 HD11 ' CD1' ' B' ' 173' ' ' ILE . 55.1 tp . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.272 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.852 HD21 HD12 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -146.26 -79.48 0.16 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.561 -0.964 . . . . 0.0 110.471 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 35.5 t -134.35 18.85 3.66 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.19 -0.944 . . . . 0.0 110.799 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 7.4 tptm 50.76 25.9 2.32 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.222 -0.924 . . . . 0.0 110.558 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -148.44 -46.49 0.15 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.612 -0.68 . . . . 0.0 109.417 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.619 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.3 mm-40 -67.39 -33.08 74.44 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.286 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.852 HD12 HD21 ' B' ' 167' ' ' LEU . 1.2 tt -78.5 -28.42 46.33 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 178.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.533 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.7 mm -68.5 -30.82 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -71.76 -30.27 65.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.648 -0.658 . . . . 0.0 109.979 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.744 ' O ' HG23 ' B' ' 179' ' ' VAL . 96.6 m-20 -74.72 -32.9 62.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.636 -0.665 . . . . 0.0 109.716 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.456 ' CE ' HD13 ' A' ' 90' ' ' LEU . 1.4 mtt -70.13 -29.77 66.78 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.692 -0.63 . . . . 0.0 109.983 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -73.81 -35.12 64.83 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.584 -0.697 . . . . 0.0 110.044 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -75.55 -29.93 59.54 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.636 -0.665 . . . . 0.0 109.876 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.744 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.4 t -76.05 -29.88 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.608 -0.682 . . . . 0.0 109.653 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . 0.406 ' HA ' HD12 ' B' ' 183' ' ' ILE . 17.8 t70 -75.73 -35.93 60.09 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.653 -0.654 . . . . 0.0 109.834 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.4 mtt85 -71.46 -28.45 63.96 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.632 -0.668 . . . . 0.0 109.723 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -70.19 -32.96 71.14 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.531 -0.731 . . . . 0.0 109.953 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' B' ' 180' ' ' ASP . 76.0 mt -70.88 -29.05 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.568 -0.707 . . . . 0.0 109.766 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.9 m -71.34 -34.73 70.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.574 -0.704 . . . . 0.0 109.742 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.22 -43.85 66.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.615 -0.678 . . . . 0.0 109.731 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 73.4 t -71.95 -31.53 40.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.577 -0.702 . . . . 0.0 109.426 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.49 -30.18 59.79 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.659 -0.651 . . . . 0.0 109.704 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 12.0 tp-100 -73.03 -30.13 63.52 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.643 -0.66 . . . . 0.0 109.843 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -37.44 73.73 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.683 -0.636 . . . . 0.0 109.823 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.704 HG12 HD22 ' A' ' 72' ' ' LEU . 75.8 mt -71.26 -31.15 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.63 -0.668 . . . . 0.0 109.554 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 6.4 m -68.49 -35.0 76.9 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.679 -0.638 . . . . 0.0 109.517 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 3.5 mmmm -74.73 -37.05 62.64 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.702 -0.624 . . . . 0.0 109.393 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.738 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -70.92 -31.82 68.56 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.635 -0.665 . . . . 0.0 109.367 179.297 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.7 tptm -66.56 -40.25 88.92 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.724 -0.61 . . . . 0.0 109.446 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -64.37 -31.62 72.9 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.666 -0.646 . . . . 0.0 109.43 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -63.74 -36.39 83.73 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.671 -0.643 . . . . 0.0 109.462 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . 0.485 ' NE2' HD12 ' A' ' 69' ' ' ILE . 35.2 tt0 -62.83 -30.03 71.18 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.774 -0.579 . . . . 0.0 109.632 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.54 -44.24 97.41 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.646 -0.659 . . . . 0.0 109.894 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -63.55 -39.98 95.82 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.699 -0.626 . . . . 0.0 109.699 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.907 HD23 HD22 ' A' ' 62' ' ' LEU . 3.6 tp -70.8 -40.64 72.4 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.655 -0.653 . . . . 0.0 109.721 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 . . . . . 0 N--CA 1.494 1.73 0 O-C-N 121.656 -0.653 . . . . 0.0 109.668 179.472 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.0 tp . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.099 0.476 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.16 -32.38 61.28 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.534 -0.729 . . . . 0.0 110.127 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -75.89 -36.79 59.36 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.629 -0.669 . . . . 0.0 109.735 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.412 HG22 HD11 ' A' ' 69' ' ' ILE . 89.6 m -71.87 -30.51 65.5 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.734 -0.603 . . . . 0.0 109.446 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -67.1 -28.91 68.56 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.593 -0.692 . . . . 0.0 109.767 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -63.49 -40.17 96.38 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.623 -0.673 . . . . 0.0 110.058 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -74.22 -34.54 63.71 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.653 -0.654 . . . . 0.0 109.609 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.486 HG12 HD22 ' B' ' 193' ' ' LEU . 73.8 mt -74.63 -27.05 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.744 -0.598 . . . . 0.0 109.578 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.481 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.3 tt -73.01 -31.56 64.55 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.544 -0.723 . . . . 0.0 109.843 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -30.88 70.94 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.509 -0.744 . . . . 0.0 109.843 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.663 HD22 HG12 ' B' ' 190' ' ' ILE . 18.9 mt -65.02 -29.1 69.99 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.624 -0.673 . . . . 0.0 110.036 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.605 ' O ' HD13 ' A' ' 77' ' ' LEU . 2.6 tp10 -66.76 -35.32 79.83 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.653 -0.654 . . . . 0.0 110.076 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.5 -32.8 58.53 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.603 -0.686 . . . . 0.0 109.826 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.7 tmtm? -77.73 -30.19 51.53 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.729 -0.607 . . . . 0.0 109.586 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.552 HD13 HD12 ' B' ' 190' ' ' ILE . 27.8 tp -79.16 -30.19 43.42 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.665 -0.647 . . . . 0.0 109.78 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.605 HD13 ' O ' ' A' ' 73' ' ' GLU . 1.4 mp -77.68 -31.28 52.41 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.634 -0.666 . . . . 0.0 109.719 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.26 -28.66 59.9 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.655 -0.653 . . . . 0.0 109.875 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.75 HD23 ' HA ' ' B' ' 183' ' ' ILE . 4.6 tp -76.48 -36.24 57.94 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.603 -0.686 . . . . 0.0 109.893 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -73.04 -30.46 63.74 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.614 -0.679 . . . . 0.0 109.694 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -70.85 -27.95 64.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.677 -0.64 . . . . 0.0 109.875 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -39.67 81.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.571 -0.706 . . . . 0.0 109.935 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -68.99 -29.72 67.98 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.592 -0.693 . . . . 0.0 109.91 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -69.91 -29.75 67.01 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.7 -0.625 . . . . 0.0 109.943 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -67.15 -36.27 81.48 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.66 -0.65 . . . . 0.0 109.861 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.413 HD13 ' HG2' ' B' ' 176' ' ' MET . 3.7 mt -59.99 -36.59 77.51 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.659 -0.651 . . . . 0.0 110.01 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -63.6 -51.66 64.31 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.618 -0.676 . . . . 0.0 109.666 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.6 mt -62.14 -27.36 68.89 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.696 -0.627 . . . . 0.0 109.611 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -107.78 21.12 17.88 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.621 -0.674 . . . . 0.0 110.417 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.698 ' HA ' HD23 ' B' ' 172' ' ' LEU . 3.4 mt . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.445 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 1.022 HD21 HD13 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -49.67 -61.9 1.86 Allowed 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.545 -0.974 . . . . 0.0 111.596 -179.658 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 5.3 t -149.14 14.74 0.9 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.995 -1.065 . . . . 0.0 111.328 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 19.6 tptt 49.94 26.21 1.92 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.081 -1.012 . . . . 0.0 110.867 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -150.86 -46.48 0.12 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.695 -0.628 . . . . 0.0 109.753 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.76 -42.64 85.8 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.355 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 1.022 HD13 HD21 ' B' ' 167' ' ' LEU . 9.8 tp -71.44 -28.78 64.21 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.0 mm -66.35 -32.1 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -74.94 -31.17 61.43 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.734 -0.604 . . . . 0.0 109.637 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.797 ' O ' HG23 ' B' ' 179' ' ' VAL . 89.3 m-20 -71.64 -29.95 65.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.692 -0.63 . . . . 0.0 109.805 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.466 ' HE1' HD11 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -68.06 -32.31 72.57 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.657 -0.652 . . . . 0.0 109.938 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -72.65 -34.49 67.3 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.616 -0.677 . . . . 0.0 109.933 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.41 -29.68 61.62 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.823 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.797 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.6 t -74.44 -30.17 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.638 -0.664 . . . . 0.0 109.75 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -71.94 -30.84 65.73 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.671 -0.643 . . . . 0.0 110.045 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -28.8 61.31 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.635 -0.666 . . . . 0.0 109.933 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -74.63 -37.24 62.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.587 -0.696 . . . . 0.0 109.928 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.75 ' HA ' HD23 ' A' ' 79' ' ' LEU . 90.3 mt -71.19 -29.66 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.689 -0.632 . . . . 0.0 109.592 179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . 0.405 HG22 ' OE1' ' B' ' 188' ' ' GLN . 65.5 m -70.71 -33.79 71.23 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.664 -0.648 . . . . 0.0 109.664 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.0 mtt -70.18 -44.54 68.52 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.637 -0.664 . . . . 0.0 109.686 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 67.4 t -66.92 -30.98 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.676 -0.64 . . . . 0.0 109.563 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.88 -30.69 68.19 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.654 -0.653 . . . . 0.0 109.808 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . 0.405 ' OE1' HG22 ' B' ' 184' ' ' THR . 0.0 OUTLIER -67.97 -36.59 80.32 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.663 -0.648 . . . . 0.0 109.712 179.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -38.56 82.06 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.633 -0.667 . . . . 0.0 109.85 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.663 HG12 HD22 ' A' ' 72' ' ' LEU . 72.9 mt -70.62 -37.09 68.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.623 -0.673 . . . . 0.0 109.667 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 32.5 m -68.87 -33.39 73.72 Favored 'General case' 0 N--CA 1.496 1.842 0 C-N-CA 120.192 -0.603 . . . . 0.0 109.605 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -77.01 -33.03 57.51 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.629 -0.67 . . . . 0.0 109.488 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.65 HD13 HD11 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -73.31 -33.14 65.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.68 -0.638 . . . . 0.0 109.324 179.186 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 16.5 tptt -65.4 -38.69 90.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.567 -0.708 . . . . 0.0 109.394 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -67.57 -31.24 71.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.627 -0.67 . . . . 0.0 109.336 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -37.1 86.01 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.664 -0.648 . . . . 0.0 109.422 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -62.79 -30.35 71.4 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.702 -0.624 . . . . 0.0 109.691 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -61.52 -41.2 96.95 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.672 -0.643 . . . . 0.0 109.874 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -62.29 -41.83 98.83 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.24 -0.584 . . . . 0.0 109.849 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.3 tp -72.36 -30.66 64.91 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.69 -0.631 . . . . 0.0 109.765 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 . . . . . 0 N--CA 1.493 1.714 0 O-C-N 121.679 -0.638 . . . . 0.0 109.832 179.602 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.682 HD12 HD23 ' B' ' 200' ' ' LEU . 1.6 tp . . . . . 0 N--CA 1.495 1.81 0 CA-C-O 121.153 0.501 . . . . 0.0 109.923 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -65.75 -30.0 70.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.53 -0.731 . . . . 0.0 110.009 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -48.99 66.1 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.59 -0.694 . . . . 0.0 109.976 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.429 HG23 ' NZ ' ' B' ' 196' ' ' LYS . 26.6 m -67.02 -30.61 70.75 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.612 -0.68 . . . . 0.0 109.472 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -68.97 -28.12 66.34 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.681 -0.637 . . . . 0.0 109.883 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -65.19 -39.08 92.37 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.553 -0.717 . . . . 0.0 109.943 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.73 -41.09 65.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.615 -0.678 . . . . 0.0 109.42 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.439 HG12 HD23 ' B' ' 193' ' ' LEU . 87.4 mt -66.43 -27.21 39.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 mt -62.65 -41.32 98.99 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.588 -0.695 . . . . 0.0 109.629 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -65.14 -30.35 71.27 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.53 -0.731 . . . . 0.0 109.621 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.727 ' CD1' HD13 ' B' ' 193' ' ' LEU . 12.3 mt -73.05 -29.02 62.66 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.691 -0.63 . . . . 0.0 109.95 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.78 -34.71 72.07 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.599 -0.688 . . . . 0.0 109.881 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -74.03 -29.94 62.18 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.619 -0.676 . . . . 0.0 109.73 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -73.66 -30.02 62.67 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.637 -0.664 . . . . 0.0 109.916 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.945 HD13 HD12 ' B' ' 190' ' ' ILE . 13.0 tp -75.32 -32.51 60.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.638 -0.664 . . . . 0.0 109.935 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.54 -30.94 57.32 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.633 -0.667 . . . . 0.0 109.748 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.23 -28.84 60.06 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.688 -0.632 . . . . 0.0 109.845 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.432 ' HA ' HD13 ' A' ' 79' ' ' LEU . 1.1 mm? -75.08 -36.95 61.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.536 -0.728 . . . . 0.0 109.823 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -70.63 -29.85 66.34 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.538 -0.726 . . . . 0.0 109.802 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -69.78 -27.85 65.25 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.693 -0.629 . . . . 0.0 109.973 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -40.37 83.8 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.544 -0.723 . . . . 0.0 109.849 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -69.14 -30.46 68.72 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.474 -0.766 . . . . 0.0 109.627 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.4 t-80 -67.19 -29.62 69.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.655 -0.653 . . . . 0.0 109.826 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -63.06 -36.17 82.7 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.624 -0.672 . . . . 0.0 109.936 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.693 HD23 HD21 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -67.52 -32.56 73.44 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.582 -0.699 . . . . 0.0 109.887 179.814 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -66.9 -29.48 69.37 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.658 -0.651 . . . . 0.0 109.996 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.0 mt -66.86 -29.29 69.17 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.601 -0.687 . . . . 0.0 110.049 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -120.14 29.28 7.59 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.58 -0.7 . . . . 0.0 110.161 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.705 HD13 ' CE ' ' B' ' 176' ' ' MET . 27.7 tp . . . . . 0 N--CA 1.497 1.906 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.053 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.764 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.0 OUTLIER -141.74 -82.62 0.21 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.681 -0.893 . . . . 0.0 110.413 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 59.8 p -129.5 19.52 5.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.13 -0.981 . . . . 0.0 110.825 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 5.7 tptm 50.61 25.99 2.26 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.272 -0.893 . . . . 0.0 110.616 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -148.79 -46.0 0.15 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.648 -0.657 . . . . 0.0 109.605 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.604 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.8 OUTLIER -68.33 -33.16 73.79 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.92 -0.712 . . . . 0.0 109.322 179.467 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.764 ' N ' HD11 ' B' ' 167' ' ' LEU . 2.7 tt -78.11 -28.37 48.59 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 178.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.426 HD13 HD11 ' A' ' 90' ' ' LEU . 50.8 mm -67.54 -30.76 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.736 -0.602 . . . . 0.0 109.381 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -72.04 -29.73 64.46 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.668 -0.645 . . . . 0.0 109.926 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -75.44 -30.95 60.16 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.611 -0.681 . . . . 0.0 109.8 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.705 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.9 OUTLIER -71.92 -29.14 63.99 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.734 -0.604 . . . . 0.0 109.84 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -70.42 -29.96 66.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.592 -0.692 . . . . 0.0 110.027 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.9 ttp180 -71.99 -36.36 69.75 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.617 -0.677 . . . . 0.0 109.923 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 58.4 t -67.22 -29.82 47.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.707 -0.62 . . . . 0.0 109.881 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -69.12 -28.95 66.92 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.632 -0.667 . . . . 0.0 110.141 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.36 -30.0 63.01 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.654 -0.654 . . . . 0.0 110.066 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -74.63 -35.74 62.9 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.597 -0.689 . . . . 0.0 109.956 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.9 mt -71.82 -30.85 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.705 -0.622 . . . . 0.0 109.56 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.7 m -69.71 -35.14 74.78 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.63 -0.669 . . . . 0.0 109.617 179.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.7 ttp -66.61 -44.84 81.0 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.654 -0.654 . . . . 0.0 109.815 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 64.6 t -68.96 -30.65 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.628 -0.67 . . . . 0.0 109.476 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -70.18 -28.51 65.38 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.67 -0.644 . . . . 0.0 110.021 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -67.47 -32.86 73.99 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.582 -0.699 . . . . 0.0 110.041 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.05 -33.65 57.22 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.663 -0.648 . . . . 0.0 109.67 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.945 HD12 HD13 ' A' ' 76' ' ' LEU . 75.2 mt -76.01 -27.91 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.615 -0.678 . . . . 0.0 109.705 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.33 -30.48 63.38 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.632 -0.667 . . . . 0.0 109.572 179.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 19.8 mmtt -76.27 -37.11 58.0 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.596 -0.69 . . . . 0.0 109.749 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.727 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.1 OUTLIER -71.03 -30.79 67.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.615 -0.678 . . . . 0.0 109.428 179.355 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.1 tptm -67.56 -38.26 83.88 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.635 -0.665 . . . . 0.0 109.614 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.3 tptt -69.62 -30.28 67.98 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.575 -0.703 . . . . 0.0 109.533 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.429 ' NZ ' HG23 ' A' ' 65' ' ' THR . 31.2 ttpt -67.52 -32.77 73.8 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.603 -0.685 . . . . 0.0 109.606 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -65.27 -30.91 71.82 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.692 -0.63 . . . . 0.0 109.684 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -43.42 98.88 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.765 -0.584 . . . . 0.0 109.93 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -46.76 87.84 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.696 -0.627 . . . . 0.0 109.942 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.682 HD23 HD12 ' A' ' 62' ' ' LEU . 4.8 tp -70.27 -32.87 70.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.649 -0.657 . . . . 0.0 109.725 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.642 -0.661 . . . . 0.0 109.878 179.617 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.606 HD21 ' HG2' ' B' ' 201' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 121.091 0.472 . . . . 0.0 110.168 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -70.68 -29.32 65.6 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.55 -0.719 . . . . 0.0 110.184 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -74.74 -40.22 61.39 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.58 -0.7 . . . . 0.0 109.973 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.7 m -71.48 -29.75 65.19 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.729 -0.607 . . . . 0.0 109.723 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.421 ' HA ' HD12 ' A' ' 69' ' ' ILE . 3.5 mmtp -72.5 -28.48 62.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.649 -0.657 . . . . 0.0 109.925 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -34.6 73.12 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.59 -0.694 . . . . 0.0 109.979 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -37.17 65.64 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.668 -0.645 . . . . 0.0 109.706 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.518 HG22 ' OE2' ' A' ' 73' ' ' GLU . 66.5 mt -68.77 -27.77 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.714 -0.616 . . . . 0.0 109.619 179.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.22 -35.93 80.62 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.58 -0.7 . . . . 0.0 109.936 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.0 mttt -70.03 -30.18 67.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.6 -0.687 . . . . 0.0 109.96 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.705 HD12 HG12 ' B' ' 190' ' ' ILE . 2.9 mm? -70.86 -28.7 64.76 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.61 -0.681 . . . . 0.0 109.964 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.518 ' OE2' HG22 ' A' ' 69' ' ' ILE . 0.4 OUTLIER -69.34 -35.82 76.3 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.535 -0.728 . . . . 0.0 110.099 179.863 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -73.11 -31.7 64.49 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.716 -0.615 . . . . 0.0 109.827 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -75.04 -34.71 61.89 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.687 -0.633 . . . . 0.0 109.788 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.855 HD13 HD12 ' B' ' 190' ' ' ILE . 10.0 tp -74.19 -30.42 62.21 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.663 -0.648 . . . . 0.0 109.703 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.5 tp -74.8 -35.34 62.5 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.74 -0.6 . . . . 0.0 109.69 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.97 -29.82 68.12 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.707 -0.621 . . . . 0.0 109.758 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.75 HD23 ' HA ' ' B' ' 183' ' ' ILE . 2.8 mp -69.81 -43.1 72.76 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.767 -0.583 . . . . 0.0 109.813 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -66.64 -29.14 69.09 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.657 -0.652 . . . . 0.0 109.89 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -69.33 -30.46 68.51 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.557 -0.714 . . . . 0.0 109.826 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.4 -48.26 50.99 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.619 -0.676 . . . . 0.0 109.729 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.5 tttp -63.87 -29.52 70.7 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.587 -0.696 . . . . 0.0 109.568 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -66.08 -29.98 70.41 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.675 -0.641 . . . . 0.0 109.948 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -64.15 -40.62 96.52 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.638 -0.664 . . . . 0.0 109.86 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.835 HD23 HD21 ' B' ' 172' ' ' LEU . 2.8 mt -60.41 -33.5 72.58 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.557 -0.715 . . . . 0.0 110.066 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -63.8 -47.13 82.09 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.59 -0.694 . . . . 0.0 109.786 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.54 -28.63 68.69 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.722 -0.611 . . . . 0.0 109.678 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.48 13.06 36.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.679 -0.638 . . . . 0.0 110.81 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.52 HD11 ' CD1' ' B' ' 173' ' ' ILE . 27.7 tp . . . . . 0 N--CA 1.499 1.984 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.315 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.956 HD21 HD12 ' B' ' 172' ' ' LEU . 0.1 OUTLIER -144.64 -68.93 0.3 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.556 -0.967 . . . . 0.0 110.67 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 13.1 t -145.44 16.41 1.48 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.225 -0.922 . . . . 0.0 110.974 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.7 tptm 50.65 26.06 2.32 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.119 -0.988 . . . . 0.0 110.615 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -149.14 -46.58 0.14 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.606 -0.684 . . . . 0.0 109.491 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.607 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.8 mt-10 -66.26 -37.13 84.76 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.979 -0.688 . . . . 0.0 109.395 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.956 HD12 HD21 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -75.2 -28.66 60.08 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.859 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.52 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.5 mm -66.84 -30.49 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.67 -0.644 . . . . 0.0 109.341 179.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -74.56 -30.12 61.62 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.68 -0.638 . . . . 0.0 109.847 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.58 ' O ' HG23 ' B' ' 179' ' ' VAL . 83.7 m-20 -74.38 -29.3 61.49 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.639 -0.663 . . . . 0.0 109.979 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.456 ' HE2' ' C ' ' A' ' 86' ' ' LEU . 0.8 OUTLIER -72.49 -29.63 63.8 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.68 -0.638 . . . . 0.0 109.952 179.764 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -75.79 -28.96 58.58 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.657 -0.652 . . . . 0.0 110.138 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.91 -31.76 56.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.582 -0.699 . . . . 0.0 109.898 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.58 HG23 ' O ' ' B' ' 175' ' ' ASN . 66.4 t -74.93 -29.29 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.668 -0.645 . . . . 0.0 109.774 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . 0.403 ' O ' ' OG1' ' B' ' 184' ' ' THR . 14.6 t70 -73.7 -28.26 61.63 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.59 -0.694 . . . . 0.0 110.089 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.09 -31.38 64.32 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.625 -0.672 . . . . 0.0 110.101 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -73.53 -37.65 65.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.609 -0.682 . . . . 0.0 110.004 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.75 ' HA ' HD23 ' A' ' 79' ' ' LEU . 85.1 mt -68.57 -28.1 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.704 -0.623 . . . . 0.0 109.702 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 2.7 m -67.46 -34.54 77.39 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.492 -0.755 . . . . 0.0 109.85 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -48.26 69.41 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.552 -0.718 . . . . 0.0 109.833 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . 0.441 HG21 HD21 ' A' ' 79' ' ' LEU . 58.5 t -64.44 -28.93 45.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.61 -0.681 . . . . 0.0 109.816 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -70.81 -28.94 65.0 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.638 -0.664 . . . . 0.0 110.068 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -68.95 -31.31 70.09 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.548 -0.72 . . . . 0.0 110.047 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -40.53 65.48 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.703 -0.623 . . . . 0.0 109.893 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.855 HD12 HD13 ' A' ' 76' ' ' LEU . 77.2 mt -70.5 -28.51 35.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.687 -0.633 . . . . 0.0 109.819 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.0 m -73.85 -36.03 64.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.554 -0.716 . . . . 0.0 109.842 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -77.17 -31.08 55.22 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.615 -0.678 . . . . 0.0 109.611 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.474 HD23 ' HE2' ' B' ' 196' ' ' LYS . 0.2 OUTLIER -77.78 -21.76 51.18 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.576 -0.702 . . . . 0.0 110.159 179.411 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.8 tptm -81.35 -27.54 34.87 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.325 -0.86 . . . . 0.0 109.673 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 27.4 tptt -75.67 -35.3 60.42 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.54 -0.725 . . . . 0.0 109.94 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.474 ' HE2' HD23 ' B' ' 193' ' ' LEU . 13.8 pttt -69.04 -25.42 64.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.511 -0.743 . . . . 0.0 109.892 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -71.8 -29.96 65.01 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.521 -0.737 . . . . 0.0 109.603 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -62.38 -41.91 99.01 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.705 -0.622 . . . . 0.0 109.751 179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.75 -38.79 91.94 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.733 -0.604 . . . . 0.0 109.639 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.513 HD23 HD12 ' A' ' 62' ' ' LEU . 2.6 tp -75.7 -32.33 60.04 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.61 -0.681 . . . . 0.0 109.508 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.606 ' HG2' HD21 ' A' ' 62' ' ' LEU . 2.7 mm-40 . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.658 -0.651 . . . . 0.0 109.738 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.7 tp . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 121.182 0.515 . . . . 0.0 110.048 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -69.97 -48.65 57.43 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.479 -0.763 . . . . 0.0 109.982 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.92 -30.94 70.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.73 -0.606 . . . . 0.0 109.797 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.55 HG22 HD11 ' A' ' 69' ' ' ILE . 84.1 m -74.67 -30.71 61.68 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.69 -0.631 . . . . 0.0 109.742 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -71.41 -27.18 63.13 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.603 -0.686 . . . . 0.0 110.064 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -72.41 -35.1 68.3 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.598 -0.688 . . . . 0.0 110.22 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 -76.22 -35.07 59.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.69 -0.631 . . . . 0.0 109.792 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.55 HD11 HG22 ' A' ' 65' ' ' THR . 62.2 mt -75.2 -27.14 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.683 -0.636 . . . . 0.0 109.494 179.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.83 -34.55 62.35 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.58 -0.7 . . . . 0.0 109.887 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -71.41 -33.51 69.51 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.564 -0.71 . . . . 0.0 109.613 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.812 HD22 HG12 ' B' ' 190' ' ' ILE . 5.6 mt -66.92 -33.0 74.64 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.655 -0.653 . . . . 0.0 109.853 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -67.67 -36.85 81.47 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.613 -0.679 . . . . 0.0 109.878 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -71.21 -32.0 68.3 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.63 -0.669 . . . . 0.0 109.412 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -67.86 -36.05 79.61 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.701 -0.624 . . . . 0.0 109.825 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 21.4 tp -68.49 -30.09 68.85 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.644 -0.66 . . . . 0.0 109.844 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.5 mt -75.07 -38.84 61.17 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.643 -0.661 . . . . 0.0 109.771 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.75 -28.99 66.25 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.688 -0.633 . . . . 0.0 109.902 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.642 HD23 ' HA ' ' B' ' 183' ' ' ILE . 5.9 tp -72.88 -37.25 67.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.587 -0.696 . . . . 0.0 110.022 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -70.04 -30.65 67.98 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.558 -0.713 . . . . 0.0 109.689 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -28.42 67.46 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.738 -0.601 . . . . 0.0 109.839 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -45.04 80.3 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.641 -0.662 . . . . 0.0 109.778 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.05 -30.86 71.85 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.605 -0.684 . . . . 0.0 109.665 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -65.32 -30.93 71.82 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.723 -0.61 . . . . 0.0 109.823 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -65.27 -32.33 73.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.594 -0.691 . . . . 0.0 109.839 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.529 HD23 HD21 ' B' ' 172' ' ' LEU . 0.5 OUTLIER -66.28 -33.92 76.83 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.642 -0.661 . . . . 0.0 109.71 179.633 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -60.85 -34.8 75.14 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.642 -0.661 . . . . 0.0 109.862 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.7 mp -69.86 -29.38 66.6 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.732 -0.605 . . . . 0.0 109.775 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -95.09 -15.74 23.18 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.631 -0.668 . . . . 0.0 110.634 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.785 ' HA ' HD13 ' B' ' 172' ' ' LEU . 16.8 tp . . . . . 0 N--CA 1.501 2.094 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.746 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.371 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.568 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.6 OUTLIER -50.13 -52.17 37.32 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.581 -0.952 . . . . 0.0 111.746 -179.912 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 25.2 p -153.07 15.23 0.54 Allowed 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.119 -0.988 . . . . 0.0 111.532 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 27.3 tptt 49.78 26.19 1.81 Allowed 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.077 -1.014 . . . . 0.0 110.893 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -150.5 -47.56 0.12 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.674 -0.641 . . . . 0.0 109.739 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.401 ' HB2' ' CD1' ' B' ' 167' ' ' LEU . 1.9 mt-10 -74.54 -31.56 62.16 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.053 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.785 HD13 ' HA ' ' A' ' 90' ' ' LEU . 2.9 tt -76.47 -28.18 56.41 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.627 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.0 mm -68.49 -30.2 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.642 -0.661 . . . . 0.0 109.624 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -70.89 -29.43 65.51 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.67 -0.644 . . . . 0.0 109.984 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.755 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.8 m-20 -75.71 -29.66 59.04 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.674 -0.642 . . . . 0.0 110.065 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.47 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -75.53 -29.38 59.43 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.625 -0.672 . . . . 0.0 110.023 179.749 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.2 -31.29 58.38 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.617 -0.677 . . . . 0.0 110.05 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -28.51 58.67 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.67 -0.644 . . . . 0.0 110.001 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.755 HG23 ' O ' ' B' ' 175' ' ' ASN . 60.1 t -76.12 -31.94 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.62 -0.675 . . . . 0.0 109.723 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -73.54 -29.92 62.75 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.591 -0.693 . . . . 0.0 109.917 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.2 -29.77 63.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.724 -0.61 . . . . 0.0 109.894 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -72.72 -38.82 67.33 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.653 -0.655 . . . . 0.0 109.953 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.642 ' HA ' HD23 ' A' ' 79' ' ' LEU . 88.1 mt -66.74 -28.02 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.694 -0.629 . . . . 0.0 109.702 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.0 m -67.26 -35.78 80.24 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.601 -0.687 . . . . 0.0 109.889 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.8 ttt -72.13 -37.52 69.42 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.648 -0.658 . . . . 0.0 109.856 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . 0.408 HG21 ' CD2' ' A' ' 79' ' ' LEU . 59.3 t -73.0 -30.69 32.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.591 -0.693 . . . . 0.0 109.618 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -74.12 -28.62 61.44 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.726 -0.608 . . . . 0.0 110.077 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -29.33 61.77 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.603 -0.686 . . . . 0.0 110.044 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -37.63 61.15 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.7 -0.625 . . . . 0.0 109.94 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.812 HG12 HD22 ' A' ' 72' ' ' LEU . 81.4 mt -72.51 -30.52 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.602 -0.686 . . . . 0.0 109.635 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 17.8 m -71.65 -34.94 70.18 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.631 -0.668 . . . . 0.0 109.604 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.6 mmtp -75.34 -37.77 60.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.644 -0.66 . . . . 0.0 109.383 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.59 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -71.6 -30.26 65.6 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.743 -0.598 . . . . 0.0 109.455 179.27 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 17.1 tptt -70.29 -41.03 73.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.699 -0.626 . . . . 0.0 109.622 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.9 mmtm -67.14 -31.28 71.6 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.631 -0.668 . . . . 0.0 109.33 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -63.75 -36.15 82.94 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.681 -0.637 . . . . 0.0 109.293 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . 0.4 ' NE2' ' CD1' ' A' ' 69' ' ' ILE . 47.2 tt0 -63.07 -30.23 71.43 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.773 -0.58 . . . . 0.0 109.58 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -60.99 -41.95 97.47 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.691 -0.631 . . . . 0.0 109.911 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -61.75 -49.52 76.06 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.664 -0.647 . . . . 0.0 109.895 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 19.5 tp -68.27 -29.86 68.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.621 -0.675 . . . . 0.0 109.685 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 0.0 109.929 179.693 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.613 HD11 ' HG2' ' B' ' 201' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 121.113 0.482 . . . . 0.0 110.041 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -64.28 -31.54 72.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.641 -0.662 . . . . 0.0 110.001 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -70.44 -47.75 59.22 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.598 -0.689 . . . . 0.0 109.92 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.9 m -66.49 -31.36 72.05 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.739 -0.601 . . . . 0.0 109.538 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.92 -27.23 65.58 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.672 -0.642 . . . . 0.0 109.896 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -66.54 -36.02 81.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.498 -0.751 . . . . 0.0 109.988 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.0 tp60 -76.39 -34.56 58.85 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.567 -0.708 . . . . 0.0 109.563 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.9 mt -73.26 -27.51 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.691 -0.63 . . . . 0.0 109.491 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.1 tp -71.77 -38.78 70.29 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.556 -0.715 . . . . 0.0 109.953 179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.3 mmtt -65.64 -35.44 80.79 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.543 -0.723 . . . . 0.0 109.728 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.813 HD22 HG12 ' B' ' 190' ' ' ILE . 3.2 mt -69.54 -27.96 65.61 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.72 -0.612 . . . . 0.0 109.809 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -69.91 -38.91 76.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.579 -0.701 . . . . 0.0 109.975 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -67.38 -41.38 85.11 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.681 -0.637 . . . . 0.0 109.62 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.7 tptt -64.32 -35.23 80.18 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.77 -0.581 . . . . 0.0 109.713 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.546 HD13 HD12 ' B' ' 190' ' ' ILE . 18.5 tp -73.49 -31.41 63.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.679 -0.638 . . . . 0.0 109.529 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 tp -70.51 -34.83 72.76 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.693 -0.629 . . . . 0.0 109.702 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.04 -30.78 62.58 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.721 -0.612 . . . . 0.0 109.68 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.847 HD12 ' CG1' ' B' ' 183' ' ' ILE . 0.2 OUTLIER -76.16 -37.76 57.53 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.649 -0.657 . . . . 0.0 109.643 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -71.96 -29.75 64.59 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.617 -0.677 . . . . 0.0 109.686 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.5 -29.68 66.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 109.72 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -68.48 -43.67 76.41 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.612 -0.68 . . . . 0.0 109.744 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -64.7 -29.93 70.93 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.555 -0.716 . . . . 0.0 109.647 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -64.33 -32.56 74.22 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.699 -0.625 . . . . 0.0 109.829 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -73.57 -35.33 65.43 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.672 -0.642 . . . . 0.0 109.715 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.401 ' CD2' ' CD2' ' B' ' 172' ' ' LEU . 3.2 mt -70.87 -33.32 70.5 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.69 -0.631 . . . . 0.0 109.685 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.469 ' HA ' ' HE1' ' B' ' 176' ' ' MET . 0.2 OUTLIER -68.27 -33.12 73.79 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.715 -0.616 . . . . 0.0 109.718 179.848 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 tp -79.16 -30.0 43.31 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.643 -0.661 . . . . 0.0 109.764 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -89.11 -8.7 53.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.626 -0.672 . . . . 0.0 110.848 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.643 HD13 ' HE3' ' B' ' 176' ' ' MET . 56.4 tp . . . . . 0 N--CA 1.5 2.026 0 O-C-N 121.093 -1.004 . . . . 0.0 110.46 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.307 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.712 HD13 ' HB2' ' B' ' 171' ' ' GLU . 0.3 OUTLIER -117.75 -31.16 5.23 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.684 -0.892 . . . . 0.0 110.32 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.71 ' H ' HD12 ' B' ' 167' ' ' LEU . 1.4 m -167.53 18.08 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.375 -0.828 . . . . 0.0 111.808 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 24.4 tptt 48.3 26.98 1.21 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.04 -1.038 . . . . 0.0 110.99 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.32 -47.24 0.11 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.774 -0.579 . . . . 0.0 109.695 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.712 ' HB2' HD13 ' B' ' 167' ' ' LEU . 0.5 OUTLIER -69.79 -37.02 76.18 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.259 179.499 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.602 ' N ' HD11 ' B' ' 167' ' ' LEU . 3.2 mt -74.2 -28.14 61.13 Favored 'General case' 0 N--CA 1.493 1.679 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.443 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.1 mm -68.25 -31.84 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.687 -0.633 . . . . 0.0 109.404 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -74.43 -31.35 62.25 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.757 -0.589 . . . . 0.0 109.955 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -75.06 -34.21 61.79 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.62 -0.675 . . . . 0.0 109.885 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.643 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -71.42 -27.23 63.15 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.611 -0.681 . . . . 0.0 109.75 179.475 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.05 -31.71 69.47 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.553 -0.717 . . . . 0.0 110.104 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.58 -29.32 46.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.607 -0.683 . . . . 0.0 109.952 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.443 ' O ' HD12 ' B' ' 183' ' ' ILE . 76.0 t -79.29 -25.8 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.639 -0.663 . . . . 0.0 109.53 179.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -78.16 -38.7 43.0 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.463 -0.773 . . . . 0.0 110.073 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 10.3 ptt85 -73.09 -24.8 60.7 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 119.868 -0.733 . . . . 0.0 110.158 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . 0.503 ' O ' HG23 ' B' ' 186' ' ' VAL . 2.4 tp10 -80.78 -37.02 31.02 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.511 -0.743 . . . . 0.0 109.87 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.847 ' CG1' HD12 ' A' ' 79' ' ' LEU . 76.0 mt -76.52 -27.32 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.611 -0.681 . . . . 0.0 109.556 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 72.2 m -76.62 -30.98 57.12 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.496 -0.752 . . . . 0.0 109.676 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.5 mtp -76.07 -39.32 55.68 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.619 -0.676 . . . . 0.0 109.666 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 182' ' ' GLU . 59.3 t -72.98 -29.9 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.628 -0.67 . . . . 0.0 109.499 179.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -72.75 -28.15 62.45 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.539 -0.726 . . . . 0.0 109.984 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.94 -34.48 69.07 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.635 -0.666 . . . . 0.0 109.985 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -40.67 64.04 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.622 -0.674 . . . . 0.0 109.684 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.813 HG12 HD22 ' A' ' 72' ' ' LEU . 84.2 mt -71.04 -30.54 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.654 -0.654 . . . . 0.0 109.477 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 50.9 m -69.26 -35.57 76.21 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.688 -0.633 . . . . 0.0 109.41 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.9 mmmt -76.53 -36.4 57.72 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.451 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -71.75 -30.01 65.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.683 -0.636 . . . . 0.0 109.531 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -69.24 -37.75 78.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.613 -0.679 . . . . 0.0 109.764 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.6 -31.23 71.13 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.562 -0.711 . . . . 0.0 109.467 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -64.13 -36.49 84.2 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.659 -0.65 . . . . 0.0 109.742 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -63.77 -30.59 71.67 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.667 -0.646 . . . . 0.0 109.867 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.39 -38.61 90.28 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.59 -0.693 . . . . 0.0 109.897 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -62.22 -41.47 98.42 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.715 -0.615 . . . . 0.0 109.9 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.462 HD23 ' HG ' ' A' ' 62' ' ' LEU . 5.5 tp -73.14 -32.37 64.85 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.587 -0.695 . . . . 0.0 109.687 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.613 ' HG2' HD11 ' A' ' 62' ' ' LEU . 24.6 mt-10 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.685 -0.635 . . . . 0.0 109.812 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.751 HD11 ' HG2' ' B' ' 201' ' ' GLU . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.771 0 CA-C-O 121.161 0.505 . . . . 0.0 109.982 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -64.18 -30.0 71.08 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.66 -0.65 . . . . 0.0 109.954 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -68.45 -51.41 43.91 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.615 -0.678 . . . . 0.0 109.866 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 79.7 m -63.45 -32.08 73.42 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.637 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.41 -29.09 68.5 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.647 -0.658 . . . . 0.0 109.76 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.7 -36.7 84.72 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.66 -0.65 . . . . 0.0 109.956 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 36.6 tp60 -73.46 -35.75 65.76 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.652 -0.655 . . . . 0.0 109.708 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.5 mt -71.0 -28.31 32.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.656 -0.653 . . . . 0.0 109.553 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.418 HD23 ' C ' ' A' ' 70' ' ' LEU . 9.8 tt -68.71 -37.5 79.54 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.492 -0.755 . . . . 0.0 109.806 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -65.01 -37.96 89.35 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.66 -0.65 . . . . 0.0 109.701 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.627 HD22 HG12 ' B' ' 190' ' ' ILE . 12.3 mt -62.37 -29.55 70.55 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.689 -0.632 . . . . 0.0 109.939 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 tm-20 -63.3 -42.84 99.09 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.537 -0.727 . . . . 0.0 109.945 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.19 -34.48 74.97 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.671 -0.643 . . . . 0.0 109.559 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.01 -36.9 69.84 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.733 -0.605 . . . . 0.0 109.595 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.8 tp -75.11 -31.36 61.11 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.626 -0.671 . . . . 0.0 109.582 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tt -76.06 -32.2 59.16 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.738 -0.601 . . . . 0.0 109.604 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.411 ' HA ' ' HG2' ' A' ' 81' ' ' GLU . . . -73.26 -27.09 61.37 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.1 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.48 -27.07 41.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.46 -0.775 . . . . 0.0 109.813 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -76.34 -36.58 58.16 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.582 -0.699 . . . . 0.0 109.976 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.411 ' HG2' ' HA ' ' A' ' 78' ' ' ALA . 7.6 pt-20 -68.76 -24.62 64.46 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 119.889 -0.724 . . . . 0.0 109.822 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.05 -41.8 81.5 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.495 -0.753 . . . . 0.0 109.478 179.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.4 ttpm? -68.29 -31.05 70.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.593 -0.692 . . . . 0.0 109.435 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -65.5 -30.08 70.81 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.687 -0.633 . . . . 0.0 109.734 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -61.79 -34.72 76.41 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.63 -0.669 . . . . 0.0 109.726 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.866 HD23 HD21 ' B' ' 172' ' ' LEU . 0.8 OUTLIER -70.66 -30.31 66.88 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.635 -0.665 . . . . 0.0 109.81 179.571 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -69.79 -30.51 68.07 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.602 -0.686 . . . . 0.0 110.019 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.4 tp -67.5 -31.61 71.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.576 -0.703 . . . . 0.0 109.888 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -117.38 29.84 7.64 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.648 -0.657 . . . . 0.0 109.987 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.612 ' CD2' HD11 ' B' ' 173' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.498 1.945 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.305 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.369 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.784 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.0 OUTLIER -141.35 -82.6 0.22 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.556 -0.967 . . . . 0.0 110.453 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 8.4 t -129.48 20.74 5.64 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.946 . . . . 0.0 110.848 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . 0.459 ' C ' HD13 ' B' ' 173' ' ' ILE . 13.8 tptm 50.76 25.94 2.33 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.238 -0.914 . . . . 0.0 110.729 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -150.99 -45.58 0.12 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.694 -0.628 . . . . 0.0 109.724 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.617 ' HB2' HD12 ' B' ' 167' ' ' LEU . 1.4 mt-10 -67.7 -31.12 70.86 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 120.003 -0.679 . . . . 0.0 109.621 179.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.866 HD21 HD23 ' A' ' 86' ' ' LEU . 2.8 tt -80.94 -30.57 35.22 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.622 -0.674 . . . . 0.0 109.341 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.619 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.0 mp -72.53 -31.29 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -64.7 -32.62 74.38 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.524 ' O ' HG23 ' B' ' 179' ' ' VAL . 76.8 m-20 -74.16 -32.76 63.25 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -65.23 -29.46 70.26 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.785 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -72.12 -31.94 66.48 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.566 -0.709 . . . . 0.0 110.021 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.03 -30.17 58.36 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.617 -0.677 . . . . 0.0 109.838 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.524 HG23 ' O ' ' B' ' 175' ' ' ASN . 66.2 t -74.54 -29.57 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.673 -0.642 . . . . 0.0 109.689 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -72.64 -28.67 62.88 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.591 -0.693 . . . . 0.0 110.049 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -71.92 -29.52 64.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.591 -0.693 . . . . 0.0 110.02 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -72.85 -38.87 66.93 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.542 -0.724 . . . . 0.0 110.044 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 80.8 mt -68.53 -29.03 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 C-N-CA 120.172 -0.611 . . . . 0.0 109.678 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 24.6 m -68.72 -32.88 72.98 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.689 -0.632 . . . . 0.0 109.849 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.92 -47.81 60.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.556 -0.715 . . . . 0.0 109.724 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 65.6 t -70.42 -31.95 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.62 -0.675 . . . . 0.0 109.402 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -74.81 -28.89 60.9 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.771 -0.581 . . . . 0.0 109.715 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -72.59 -29.94 63.95 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.612 -0.68 . . . . 0.0 109.956 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -72.26 -34.72 68.45 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.639 -0.663 . . . . 0.0 109.841 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.627 HG12 HD22 ' A' ' 72' ' ' LEU . 80.5 mt -70.63 -31.3 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.666 -0.646 . . . . 0.0 109.511 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 4.8 m -67.31 -40.17 86.0 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.629 -0.67 . . . . 0.0 109.524 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -72.3 -34.37 68.08 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.678 -0.639 . . . . 0.0 109.337 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.543 HD23 ' HE2' ' B' ' 196' ' ' LYS . 0.3 OUTLIER -78.01 -10.97 59.85 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.682 -0.636 . . . . 0.0 110.558 179.423 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 18.4 tptt -91.72 -28.7 17.26 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.245 -0.91 . . . . 0.0 109.227 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.0 tptm -75.61 -32.68 60.38 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.702 -0.624 . . . . 0.0 109.733 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.543 ' HE2' HD23 ' B' ' 193' ' ' LEU . 0.0 OUTLIER -67.23 -28.58 68.18 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.493 179.335 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -69.27 -29.45 67.35 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.653 -0.654 . . . . 0.0 109.47 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -61.22 -41.72 97.35 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.641 -0.662 . . . . 0.0 109.789 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -62.37 -37.83 87.22 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.727 -0.608 . . . . 0.0 109.641 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.486 HD23 ' HG ' ' A' ' 62' ' ' LEU . 7.2 tp -75.08 -30.67 61.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.683 -0.636 . . . . 0.0 109.527 179.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.751 ' HG2' HD11 ' A' ' 62' ' ' LEU . 1.8 tm-20 . . . . . 0 N--CA 1.493 1.716 0 O-C-N 121.708 -0.62 . . . . 0.0 109.688 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.55 ' HG ' HD23 ' B' ' 200' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 121.083 0.468 . . . . 0.0 110.163 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -70.4 -36.1 73.84 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.619 -0.676 . . . . 0.0 110.157 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -74.7 -34.58 62.64 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.63 -0.669 . . . . 0.0 109.773 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.412 HG22 HD11 ' A' ' 69' ' ' ILE . 88.2 m -74.55 -30.55 61.79 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.705 -0.622 . . . . 0.0 109.665 179.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.13 -27.19 62.46 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.669 -0.645 . . . . 0.0 110.012 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -72.1 -36.23 69.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.483 -0.76 . . . . 0.0 110.187 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -72.32 -39.81 67.93 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.641 -0.662 . . . . 0.0 109.717 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.863 HG12 HD23 ' B' ' 193' ' ' LEU . 46.3 mt -66.74 -27.64 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.45 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.49 -41.44 96.46 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.623 -0.673 . . . . 0.0 109.484 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -69.96 -29.62 66.78 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.587 -0.695 . . . . 0.0 109.633 179.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.852 HD12 HD22 ' B' ' 193' ' ' LEU . 3.6 mt -71.11 -28.38 64.27 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.726 -0.609 . . . . 0.0 109.917 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -75.84 -34.49 60.09 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.595 -0.691 . . . . 0.0 109.929 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -31.73 68.7 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 120.182 -0.607 . . . . 0.0 109.543 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -64.58 -33.42 75.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.733 -0.604 . . . . 0.0 109.743 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 20.2 tp -72.07 -28.77 63.54 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.637 -0.665 . . . . 0.0 109.953 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 mt -75.04 -34.89 61.93 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.667 -0.646 . . . . 0.0 109.924 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.48 -31.54 65.47 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.583 -0.698 . . . . 0.0 109.949 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.743 HD23 ' HA ' ' B' ' 183' ' ' ILE . 6.5 tp -75.06 -37.25 61.71 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.711 -0.618 . . . . 0.0 109.812 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -72.26 -30.42 64.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.601 -0.687 . . . . 0.0 109.563 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -69.18 -29.2 67.14 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.208 -0.597 . . . . 0.0 109.795 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.44 -45.13 76.94 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.549 -0.719 . . . . 0.0 109.826 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.4 tttm -62.92 -29.49 70.82 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.495 -0.753 . . . . 0.0 109.563 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -62.57 -32.87 73.92 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.675 -0.641 . . . . 0.0 109.784 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -65.88 -30.8 71.46 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.682 -0.636 . . . . 0.0 109.722 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.2 OUTLIER -67.62 -33.09 74.29 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.607 -0.683 . . . . 0.0 109.65 179.695 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -61.81 -35.69 78.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.541 -0.724 . . . . 0.0 109.89 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.7 mp -74.0 -30.29 62.4 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.735 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -85.04 -21.89 29.23 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.741 -0.599 . . . . 0.0 110.414 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.653 ' HA ' HD23 ' B' ' 172' ' ' LEU . 56.2 tp . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.574 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.33 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.937 HD21 HD13 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -141.32 -83.5 0.21 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.572 -0.958 . . . . 0.0 110.654 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.2 m -128.79 19.62 6.08 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.148 -0.97 . . . . 0.0 110.994 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.3 tptt 50.71 25.81 2.25 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.228 -0.92 . . . . 0.0 110.539 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -147.95 -46.38 0.16 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.714 -0.616 . . . . 0.0 109.394 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.575 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.0 mm-40 -68.69 -32.93 73.1 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 119.9 -0.72 . . . . 0.0 109.276 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.937 HD13 HD21 ' B' ' 167' ' ' LEU . 13.8 tp -77.5 -29.17 52.41 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 49.3 mm -65.92 -31.6 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.669 -0.644 . . . . 0.0 109.322 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -71.28 -29.65 65.31 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.753 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.793 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.7 m-20 -72.07 -42.35 66.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.636 -0.665 . . . . 0.0 109.772 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.57 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -65.82 -33.99 77.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.684 -0.635 . . . . 0.0 109.651 179.736 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.34 -30.22 57.55 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.643 -0.661 . . . . 0.0 109.807 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -77.19 -30.0 54.59 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.668 -0.645 . . . . 0.0 109.865 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.793 HG23 ' O ' ' B' ' 175' ' ' ASN . 72.2 t -75.83 -30.03 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.587 -0.696 . . . . 0.0 109.592 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -74.08 -29.7 61.99 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.681 -0.637 . . . . 0.0 109.966 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -73.55 -29.43 62.44 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.65 -0.656 . . . . 0.0 109.957 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -73.28 -38.06 66.05 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.568 -0.708 . . . . 0.0 109.949 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.743 ' HA ' HD23 ' A' ' 79' ' ' LEU . 90.2 mt -67.39 -30.0 47.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.633 -0.667 . . . . 0.0 109.634 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.3 m -66.07 -35.69 81.19 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.597 -0.689 . . . . 0.0 109.743 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -50.34 58.24 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.648 -0.658 . . . . 0.0 109.643 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.6 t -63.85 -31.9 54.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.601 -0.687 . . . . 0.0 109.314 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -65.52 -34.85 79.24 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.7 -0.625 . . . . 0.0 109.947 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -63.89 -29.98 71.11 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.642 -0.661 . . . . 0.0 109.824 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.15 -27.68 61.8 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.669 -0.644 . . . . 0.0 109.969 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.713 HD13 HD22 ' A' ' 72' ' ' LEU . 45.0 mm -75.72 -41.99 40.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.606 -0.684 . . . . 0.0 109.525 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 51.8 m -68.66 -29.19 67.61 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.704 -0.622 . . . . 0.0 109.699 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 54.0 mmtt -74.27 -42.81 59.0 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.615 -0.678 . . . . 0.0 109.807 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.863 HD23 HG12 ' A' ' 69' ' ' ILE . 0.0 OUTLIER -72.15 -31.09 65.65 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.471 -0.768 . . . . 0.0 109.283 179.351 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -70.26 -37.76 74.98 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.662 -0.649 . . . . 0.0 109.392 179.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.3 mmtt -70.08 -31.52 69.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.592 -0.692 . . . . 0.0 109.319 179.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -65.01 -34.24 77.97 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -64.41 -30.25 71.3 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.661 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.83 -43.16 99.41 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.703 -0.623 . . . . 0.0 109.804 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -62.59 -40.15 95.98 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.75 -0.594 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.55 HD23 ' HG ' ' A' ' 62' ' ' LEU . 5.4 tp -73.23 -32.39 64.72 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.69 -0.631 . . . . 0.0 109.687 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.555 -0.716 . . . . 0.0 109.836 179.601 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.656 HD11 ' NE2' ' B' ' 197' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 CA-C-O 121.025 0.441 . . . . 0.0 110.065 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -72.7 -34.67 67.3 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.586 -0.696 . . . . 0.0 110.232 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -75.04 -33.37 61.73 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.671 -0.643 . . . . 0.0 109.9 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.8 m -75.31 -30.37 60.33 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.633 -0.667 . . . . 0.0 109.631 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -73.04 -26.58 61.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.686 -0.634 . . . . 0.0 110.057 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -72.8 -32.48 65.58 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.528 -0.732 . . . . 0.0 110.179 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -76.05 -36.38 59.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.659 -0.65 . . . . 0.0 109.691 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.9 mt -70.67 -27.66 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.682 -0.636 . . . . 0.0 109.63 179.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.1 tt -68.43 -36.81 79.59 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.513 -0.742 . . . . 0.0 109.821 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -69.77 -30.09 67.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.64 -0.663 . . . . 0.0 109.843 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.782 HD22 HG12 ' B' ' 190' ' ' ILE . 9.2 mt -70.0 -28.57 65.62 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.702 -0.624 . . . . 0.0 110.028 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.517 ' O ' HD13 ' A' ' 77' ' ' LEU . 6.6 mt-10 -72.35 -32.1 66.19 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.596 -0.69 . . . . 0.0 110.03 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.43 -30.9 60.17 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.604 -0.685 . . . . 0.0 109.78 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.78 -32.5 62.06 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.71 -0.619 . . . . 0.0 109.785 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.717 HD13 ' O ' ' A' ' 76' ' ' LEU . 0.5 OUTLIER -74.94 -31.01 61.4 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.576 -0.702 . . . . 0.0 109.654 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.517 HD13 ' O ' ' A' ' 73' ' ' GLU . 1.1 mp -74.64 -35.29 62.88 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.625 -0.672 . . . . 0.0 109.812 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.37 -30.61 64.86 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.651 -0.655 . . . . 0.0 109.77 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.641 HD23 ' HA ' ' B' ' 183' ' ' ILE . 5.9 tp -73.66 -37.9 65.12 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.642 -0.661 . . . . 0.0 109.817 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 15.6 tp60 -70.46 -30.95 67.91 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.63 -0.668 . . . . 0.0 109.625 179.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.11 -30.13 69.22 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.62 -0.675 . . . . 0.0 109.742 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -66.01 -46.53 77.61 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.664 -0.647 . . . . 0.0 109.698 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.3 tttt -64.0 -28.98 70.17 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.502 -0.749 . . . . 0.0 109.443 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -63.83 -31.38 72.54 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.671 -0.643 . . . . 0.0 109.932 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -65.28 -31.25 72.3 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.508 -0.745 . . . . 0.0 109.704 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' B' ' 176' ' ' MET . 0.6 OUTLIER -68.24 -32.84 73.32 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.674 -0.641 . . . . 0.0 109.588 179.679 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -61.65 -35.18 77.21 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.638 -0.664 . . . . 0.0 109.898 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.3 tp -63.45 -29.63 70.88 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.587 -0.695 . . . . 0.0 109.768 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -94.97 -23.46 17.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.666 -0.646 . . . . 0.0 110.379 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.625 HD11 HD11 ' B' ' 173' ' ' ILE . 56.6 tp . . . . . 0 N--CA 1.502 2.147 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.74 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . 0.504 ' HA2' HD12 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.82 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.5 OUTLIER -109.46 -61.98 1.56 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.677 -0.896 . . . . 0.0 109.2 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 52.1 m -153.53 37.09 0.46 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.322 0.582 . . . . 0.0 109.498 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . 0.495 ' C ' HD13 ' B' ' 173' ' ' ILE . 28.0 tptt 52.44 26.62 4.31 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.606 -0.684 . . . . 0.0 110.346 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -153.72 -43.7 0.09 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.619 -0.675 . . . . 0.0 110.397 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.685 ' HB3' HD13 ' B' ' 167' ' ' LEU . 1.0 OUTLIER -61.77 -29.59 70.23 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.82 ' HG ' HD11 ' B' ' 167' ' ' LEU . 0.6 OUTLIER -85.53 -28.98 24.56 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.933 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.625 HD11 HD11 ' A' ' 90' ' ' LEU . 2.7 mp -76.83 -30.97 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -66.0 -34.6 78.48 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -78.0 -32.57 51.25 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 178.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.466 ' O ' HG12 ' B' ' 179' ' ' VAL . 0.0 OUTLIER -69.31 -29.98 67.94 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 120.184 -0.606 . . . . 0.0 109.526 179.341 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -74.12 -27.48 60.89 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.598 -0.689 . . . . 0.0 110.006 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.2 -41.07 58.6 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.549 -0.719 . . . . 0.0 109.967 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.466 HG12 ' O ' ' B' ' 176' ' ' MET . 10.5 p -70.33 -26.96 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.606 -0.684 . . . . 0.0 109.999 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -76.04 -29.08 57.93 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.519 -0.738 . . . . 0.0 109.961 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 5.6 mtp-105 -73.42 -29.35 62.52 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.653 -0.654 . . . . 0.0 110.05 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -72.56 -36.97 68.35 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.573 -0.704 . . . . 0.0 109.9 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.641 ' HA ' HD23 ' A' ' 79' ' ' LEU . 88.3 mt -66.38 -28.63 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.652 -0.655 . . . . 0.0 109.664 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.4 m -65.43 -30.95 71.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.598 -0.689 . . . . 0.0 109.677 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -42.97 61.22 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.783 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.5 t -71.78 -31.23 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.645 -0.659 . . . . 0.0 109.46 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.9 -29.06 60.88 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.648 -0.658 . . . . 0.0 109.836 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -72.87 -29.64 63.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.707 -0.62 . . . . 0.0 109.999 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -73.26 -36.45 66.36 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.597 -0.689 . . . . 0.0 109.842 179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.782 HG12 HD22 ' A' ' 72' ' ' LEU . 78.0 mt -71.49 -31.35 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.674 -0.641 . . . . 0.0 109.584 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 44.8 m -69.95 -37.62 75.88 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.682 -0.636 . . . . 0.0 109.65 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -71.59 -37.42 71.0 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.614 -0.679 . . . . 0.0 109.495 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.575 HD13 HD11 ' A' ' 72' ' ' LEU . 0.3 OUTLIER -75.38 -11.85 60.13 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.731 -0.606 . . . . 0.0 110.601 179.53 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.55 -28.56 19.52 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.17 -0.956 . . . . 0.0 109.41 179.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -32.19 55.68 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.665 -0.647 . . . . 0.0 109.89 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.481 ' HE3' HD23 ' B' ' 193' ' ' LEU . 0.0 OUTLIER -71.96 -28.25 63.32 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.49 -0.756 . . . . 0.0 109.652 179.483 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . 0.656 ' NE2' HD11 ' A' ' 62' ' ' LEU . 1.1 tm0? -68.13 -30.54 69.71 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.642 -0.661 . . . . 0.0 109.657 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -62.65 -44.17 96.95 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.757 -0.589 . . . . 0.0 109.951 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -61.36 -40.63 95.0 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.045 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.565 ' CD2' HD22 ' A' ' 62' ' ' LEU . 29.1 tp -70.38 -40.98 73.65 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.607 -0.683 . . . . 0.0 109.746 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.494 1.768 0 O-C-N 121.653 -0.654 . . . . 0.0 109.637 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.656 HD11 ' CG ' ' B' ' 201' ' ' GLU . 1.2 tt . . . . . 0 N--CA 1.495 1.814 0 CA-C-O 121.078 0.466 . . . . 0.0 110.03 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -70.4 -36.03 73.82 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.608 -0.683 . . . . 0.0 109.981 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.53 -30.67 61.86 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.618 -0.676 . . . . 0.0 109.788 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 83.4 m -73.71 -30.62 62.95 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.655 -0.653 . . . . 0.0 109.587 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -69.81 -28.88 66.09 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.604 -0.685 . . . . 0.0 110.06 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -70.89 -33.22 70.36 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.57 -0.706 . . . . 0.0 110.155 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -72.43 -34.87 68.13 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.674 -0.641 . . . . 0.0 109.941 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.3 mt -68.43 -27.58 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.664 -0.647 . . . . 0.0 109.787 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.471 ' O ' HD23 ' A' ' 70' ' ' LEU . 4.8 tt -69.88 -44.31 70.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.553 -0.717 . . . . 0.0 109.783 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -65.11 -30.9 71.88 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.598 -0.689 . . . . 0.0 109.668 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.842 ' CD1' HD13 ' B' ' 193' ' ' LEU . 1.6 mt -66.54 -29.42 69.49 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.634 -0.666 . . . . 0.0 109.978 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -68.46 -45.8 71.49 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.604 -0.685 . . . . 0.0 110.029 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -63.93 -31.08 72.14 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.662 -0.649 . . . . 0.0 109.593 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.1 tttm -64.37 -35.19 80.07 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.635 -0.665 . . . . 0.0 109.913 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.9 tp -66.18 -33.75 76.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.626 -0.671 . . . . 0.0 109.824 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 mt -73.09 -37.9 66.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.728 -0.607 . . . . 0.0 109.552 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.33 -28.44 68.67 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.701 -0.624 . . . . 0.0 109.884 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.803 HD12 HG12 ' B' ' 183' ' ' ILE . 0.2 OUTLIER -69.07 -43.57 74.31 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.651 -0.655 . . . . 0.0 109.883 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -66.17 -32.81 74.46 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.62 -0.675 . . . . 0.0 109.713 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.9 -28.55 69.03 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.747 -0.596 . . . . 0.0 109.755 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.5 -44.39 94.47 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.664 -0.647 . . . . 0.0 109.735 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -65.81 -29.91 70.46 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.602 -0.686 . . . . 0.0 109.752 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -67.95 -34.17 76.06 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.578 -0.701 . . . . 0.0 109.903 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -68.9 -46.59 67.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.648 -0.658 . . . . 0.0 109.705 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.599 HD22 ' CG ' ' B' ' 176' ' ' MET . 0.2 OUTLIER -62.11 -29.58 70.43 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.658 -0.651 . . . . 0.0 109.832 179.528 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.405 ' HA ' ' HE1' ' B' ' 176' ' ' MET . 0.4 OUTLIER -66.16 -34.15 77.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.62 -0.675 . . . . 0.0 109.822 179.856 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.73 -30.4 71.5 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.6 -0.688 . . . . 0.0 109.858 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -85.26 -17.66 36.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.676 -0.64 . . . . 0.0 110.673 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.698 HD11 HD11 ' B' ' 173' ' ' ILE . 49.4 tp . . . . . 0 N--CA 1.5 2.058 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.743 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.775 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.5 OUTLIER -108.15 -61.71 1.55 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.541 -0.976 . . . . 0.0 109.165 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 88.5 p -154.5 37.3 0.42 Allowed 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . 0.477 ' C ' HD13 ' B' ' 173' ' ' ILE . 36.7 tptt 52.15 26.31 3.81 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.548 -0.72 . . . . 0.0 110.363 -179.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -152.86 -43.9 0.1 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.616 -0.678 . . . . 0.0 110.291 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.699 ' HB3' HD22 ' B' ' 167' ' ' LEU . 1.2 tt0 -61.85 -29.24 70.05 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 119.753 -0.779 . . . . 0.0 109.666 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.775 ' HG ' HD11 ' B' ' 167' ' ' LEU . 0.6 OUTLIER -85.21 -29.09 24.97 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.603 -0.685 . . . . 0.0 109.168 178.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.698 HD11 HD11 ' A' ' 90' ' ' LEU . 2.9 mp -78.38 -31.7 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.307 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -67.58 -33.88 75.91 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.784 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.3 m-20 -78.89 -32.32 45.77 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.599 ' CG ' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -71.78 -30.02 65.1 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.734 -0.604 . . . . 0.0 109.638 179.291 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.27 -33.49 61.27 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.57 -0.707 . . . . 0.0 109.827 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -71.67 -29.03 64.16 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.651 -0.656 . . . . 0.0 109.895 179.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.784 HG23 ' O ' ' B' ' 175' ' ' ASN . 64.6 t -69.51 -32.7 53.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.616 -0.677 . . . . 0.0 109.612 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -63.73 -37.26 86.71 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.666 -0.646 . . . . 0.0 109.81 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 5.7 mtp-105 -69.94 -29.4 66.54 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.748 -0.595 . . . . 0.0 109.722 179.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . 0.534 ' O ' HG23 ' B' ' 186' ' ' VAL . 5.7 tt0 -69.85 -32.35 70.7 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.676 -0.64 . . . . 0.0 109.869 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.803 HG12 HD12 ' A' ' 79' ' ' LEU . 86.6 mt -72.4 -33.17 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.676 -0.64 . . . . 0.0 109.616 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 58.9 m -71.96 -33.23 68.02 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.692 -0.63 . . . . 0.0 109.649 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.74 -41.46 71.78 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.644 -0.66 . . . . 0.0 109.602 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . 0.534 HG23 ' O ' ' B' ' 182' ' ' GLU . 63.2 t -68.28 -37.76 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 119.995 -0.682 . . . . 0.0 109.246 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.4 -33.57 75.83 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.805 -0.559 . . . . 0.0 109.893 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -29.91 70.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.648 -0.658 . . . . 0.0 109.858 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -72.91 -21.55 60.88 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.594 -0.691 . . . . 0.0 110.371 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.774 HD13 HD22 ' A' ' 72' ' ' LEU . 35.3 mm -79.55 -39.04 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.413 -0.804 . . . . 0.0 109.603 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.27 -30.2 64.61 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.623 -0.673 . . . . 0.0 109.734 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 13.8 mmtm -75.28 -36.15 61.23 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.692 -0.63 . . . . 0.0 109.85 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.842 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -74.08 -21.47 59.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.579 -0.7 . . . . 0.0 110.242 179.696 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.6 tptt -80.45 -28.59 37.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 109.575 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 14.9 tptt -74.26 -40.05 62.6 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.638 -0.664 . . . . 0.0 109.76 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.529 ' HE3' HD23 ' B' ' 193' ' ' LEU . 2.6 pttp -64.64 -26.11 68.25 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.532 -0.73 . . . . 0.0 109.639 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -69.81 -30.64 68.21 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.513 -0.742 . . . . 0.0 109.569 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -43.59 98.48 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.684 -0.635 . . . . 0.0 109.764 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -61.71 -31.18 71.32 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.777 -0.577 . . . . 0.0 109.66 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.57 HD23 ' HG ' ' A' ' 62' ' ' LEU . 3.9 tp -77.41 -38.16 50.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.69 -0.631 . . . . 0.0 109.534 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.656 ' CG ' HD11 ' A' ' 62' ' ' LEU . 28.6 mt-10 . . . . . 0 N--CA 1.493 1.687 0 O-C-N 121.687 -0.633 . . . . 0.0 109.598 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.587 HD11 ' CG ' ' B' ' 201' ' ' GLU . 5.1 tt . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 121.059 0.456 . . . . 0.0 109.911 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -63.95 -42.77 97.2 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.686 -0.634 . . . . 0.0 109.986 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -72.02 -30.77 65.54 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.72 -0.612 . . . . 0.0 109.636 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 66.7 m -73.59 -28.43 61.83 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.793 -0.567 . . . . 0.0 109.793 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.4 mmtp -72.06 -26.47 62.19 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.489 -0.757 . . . . 0.0 110.382 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -74.94 -31.85 61.6 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.542 -0.724 . . . . 0.0 110.433 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -76.23 -34.4 59.22 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.63 -0.669 . . . . 0.0 109.785 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.768 HG12 HD22 ' B' ' 193' ' ' LEU . 69.3 mt -71.5 -26.13 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.653 -0.655 . . . . 0.0 109.679 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.402 ' O ' HD23 ' A' ' 70' ' ' LEU . 1.6 tt -71.12 -40.77 71.25 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.477 -0.765 . . . . 0.0 109.929 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.5 tppt? -62.62 -31.07 71.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.557 -0.715 . . . . 0.0 109.69 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.8 HD22 HG12 ' B' ' 190' ' ' ILE . 11.3 mt -62.67 -29.6 70.77 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.714 -0.616 . . . . 0.0 109.915 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -66.58 -39.28 88.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.625 -0.672 . . . . 0.0 109.847 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.03 -30.23 63.59 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.654 -0.654 . . . . 0.0 109.53 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -29.72 63.98 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.678 -0.639 . . . . 0.0 109.908 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.454 HD13 HD12 ' B' ' 190' ' ' ILE . 25.9 tp -74.1 -33.67 63.68 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.63 -0.669 . . . . 0.0 109.899 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.8 mt -74.32 -33.1 63.08 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.666 -0.646 . . . . 0.0 109.632 179.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.88 -29.21 66.36 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.725 -0.609 . . . . 0.0 109.706 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.64 -42.75 77.56 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.655 -0.653 . . . . 0.0 109.79 179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -65.73 -29.05 69.52 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.468 -0.77 . . . . 0.0 109.876 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.0 tm-20 -68.41 -28.24 66.91 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.646 -0.659 . . . . 0.0 110.044 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -70.23 -45.76 65.86 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.557 -0.714 . . . . 0.0 109.87 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.1 tttm -63.7 -29.56 70.77 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.509 -0.744 . . . . 0.0 109.945 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -67.38 -29.3 68.78 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.59 -0.694 . . . . 0.0 109.943 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -36.15 83.18 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.533 -0.729 . . . . 0.0 109.945 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.485 HD23 HD21 ' B' ' 172' ' ' LEU . 1.4 mt -64.29 -34.36 77.96 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.638 -0.664 . . . . 0.0 109.992 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -65.59 -26.49 67.87 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.619 -0.676 . . . . 0.0 110.332 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.8 -28.24 64.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.575 -0.703 . . . . 0.0 110.267 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -117.29 26.19 9.93 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.557 -0.714 . . . . 0.0 110.467 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.526 HD11 ' CD1' ' B' ' 173' ' ' ILE . 49.8 tp . . . . . 0 N--CA 1.498 1.943 0 CA-C-O 117.957 -1.02 . . . . 0.0 110.171 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.378 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.739 HD12 ' N ' ' B' ' 168' ' ' SER . 2.5 pp -139.85 -46.35 0.44 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.67 -0.9 . . . . 0.0 110.637 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.739 ' N ' HD12 ' B' ' 167' ' ' LEU . 33.9 p -153.46 14.56 0.5 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.31 -0.868 . . . . 0.0 111.499 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 9.5 tptm 49.53 26.37 1.7 Allowed 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.012 -1.055 . . . . 0.0 111.051 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -152.92 -46.83 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.665 -0.647 . . . . 0.0 110.047 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.456 ' CB ' HD11 ' B' ' 167' ' ' LEU . 1.0 OUTLIER -73.58 -36.73 65.59 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 179.427 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.485 HD21 HD23 ' A' ' 86' ' ' LEU . 1.0 OUTLIER -74.09 -28.05 61.19 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.818 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.526 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.3 mm -67.54 -31.04 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.694 -0.629 . . . . 0.0 109.385 179.397 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -72.38 -29.09 63.44 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.681 -0.637 . . . . 0.0 109.916 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -72.55 -32.17 65.85 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.621 -0.674 . . . . 0.0 110.026 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.464 ' CE ' HD13 ' A' ' 90' ' ' LEU . 1.3 mtt -70.37 -30.19 67.05 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.695 -0.628 . . . . 0.0 109.888 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -69.39 -30.87 68.94 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.644 -0.66 . . . . 0.0 109.863 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.13 -45.48 66.76 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.701 -0.625 . . . . 0.0 109.695 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.419 HG21 ' CD1' ' A' ' 86' ' ' LEU . 58.5 t -61.96 -30.45 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.827 -0.545 . . . . 0.0 109.773 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -67.85 -31.73 71.75 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.658 -0.651 . . . . 0.0 109.863 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.19 -30.39 63.5 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.698 -0.626 . . . . 0.0 109.715 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . 0.604 ' O ' HG23 ' B' ' 186' ' ' VAL . 13.3 tt0 -70.89 -34.69 71.82 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.664 -0.647 . . . . 0.0 109.815 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.5 mt -73.66 -30.6 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.721 -0.612 . . . . 0.0 109.654 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 53.1 m -73.31 -34.76 65.88 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.674 -0.641 . . . . 0.0 109.626 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 tpp -72.13 -39.18 69.02 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.605 -0.685 . . . . 0.0 109.677 179.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . 0.604 HG23 ' O ' ' B' ' 182' ' ' GLU . 64.8 t -70.89 -32.07 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.641 -0.662 . . . . 0.0 109.423 179.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -70.77 -30.01 66.39 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.684 -0.635 . . . . 0.0 109.894 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -30.2 62.72 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.694 -0.629 . . . . 0.0 109.871 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -37.11 68.56 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.688 -0.632 . . . . 0.0 109.8 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.8 HG12 HD22 ' A' ' 72' ' ' LEU . 77.3 mt -72.95 -31.29 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.666 -0.646 . . . . 0.0 109.607 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.57 -34.7 65.26 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.656 -0.653 . . . . 0.0 109.662 179.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -73.1 -38.56 66.31 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.655 -0.653 . . . . 0.0 109.536 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.768 HD22 HG12 ' A' ' 69' ' ' ILE . 0.3 OUTLIER -67.34 -32.23 73.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.668 -0.645 . . . . 0.0 109.351 179.316 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -66.76 -47.23 72.86 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.66 -0.65 . . . . 0.0 109.387 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -64.21 -31.09 72.16 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 120.051 -0.66 . . . . 0.0 109.244 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.658 ' HE2' HD23 ' B' ' 193' ' ' LEU . 19.0 ttpt -62.79 -37.22 85.82 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.691 -0.631 . . . . 0.0 109.418 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . 0.405 HE22 HD12 ' A' ' 69' ' ' ILE . 5.5 tt0 -63.12 -30.16 71.37 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.722 -0.611 . . . . 0.0 109.66 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -61.04 -40.96 95.61 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.605 -0.685 . . . . 0.0 109.882 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -36.43 83.97 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.753 -0.592 . . . . 0.0 109.644 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' B' ' 200' ' ' LEU . 14.0 tp -75.68 -31.02 59.55 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.658 -0.651 . . . . 0.0 109.632 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.587 ' CG ' HD11 ' A' ' 62' ' ' LEU . 14.9 mt-10 . . . . . 0 N--CA 1.493 1.717 0 O-C-N 121.638 -0.664 . . . . 0.0 109.723 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.831 HD12 HD23 ' B' ' 200' ' ' LEU . 4.5 tp . . . . . 0 N--CA 1.496 1.863 0 CA-C-O 121.043 0.449 . . . . 0.0 110.087 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.71 -29.83 69.19 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.583 -0.698 . . . . 0.0 110.119 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -70.5 -46.13 64.3 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.623 -0.673 . . . . 0.0 109.886 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 21.0 m -62.93 -31.12 72.13 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.731 -0.606 . . . . 0.0 109.724 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -65.02 -28.27 69.38 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.628 -0.67 . . . . 0.0 109.93 179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -62.57 -39.75 94.68 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.609 -0.682 . . . . 0.0 110.104 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.4 tp60 -75.41 -30.69 60.15 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.6 -0.687 . . . . 0.0 109.632 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.418 HG12 HD22 ' B' ' 193' ' ' LEU . 73.7 mt -77.37 -27.04 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.785 -0.572 . . . . 0.0 109.712 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.1 mt -75.37 -32.69 60.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.458 -0.776 . . . . 0.0 109.826 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -31.62 70.41 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.567 -0.708 . . . . 0.0 109.822 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.672 HD22 HG12 ' B' ' 190' ' ' ILE . 5.3 mt -69.73 -28.96 66.25 Favored 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.898 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.28 -33.11 73.75 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.6 -0.688 . . . . 0.0 110.003 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -76.48 -33.23 58.68 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.557 -0.715 . . . . 0.0 109.71 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.8 tttt -75.35 -29.93 60.07 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.705 -0.622 . . . . 0.0 109.807 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.638 HD13 HD12 ' B' ' 190' ' ' ILE . 15.7 tp -77.22 -31.03 54.94 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.671 -0.643 . . . . 0.0 109.798 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mp -76.34 -33.57 58.97 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.642 -0.661 . . . . 0.0 109.634 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.92 -29.3 63.02 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.696 -0.627 . . . . 0.0 109.994 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.738 HD23 ' HA ' ' B' ' 183' ' ' ILE . 8.8 tp -75.14 -38.39 61.01 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.592 -0.693 . . . . 0.0 109.922 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.451 ' HG2' HG21 ' B' ' 183' ' ' ILE . 4.3 mm-40 -71.23 -29.69 65.43 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.734 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -69.99 -28.98 65.96 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.688 -0.632 . . . . 0.0 109.861 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -67.61 -43.04 81.42 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.522 -0.736 . . . . 0.0 109.863 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -62.3 -28.46 69.75 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.559 -0.713 . . . . 0.0 109.779 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -62.95 -31.86 73.05 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.619 -0.676 . . . . 0.0 109.875 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -40.04 94.61 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.675 -0.64 . . . . 0.0 109.9 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.702 HD23 HD21 ' B' ' 172' ' ' LEU . 2.9 mt -60.81 -35.5 76.65 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.629 -0.67 . . . . 0.0 110.127 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -61.3 -36.89 81.33 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.517 -0.739 . . . . 0.0 109.968 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mp -77.05 -29.17 55.06 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.703 -0.623 . . . . 0.0 109.684 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -95.18 -0.22 53.45 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.65 -0.656 . . . . 0.0 110.965 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.594 HD11 ' CD1' ' B' ' 173' ' ' ILE . 49.5 tp . . . . . 0 N--CA 1.498 1.964 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.245 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.559 HD12 ' N ' ' B' ' 168' ' ' SER . 1.3 pp -139.03 -48.73 0.5 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.624 -0.927 . . . . 0.0 110.753 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.559 ' N ' HD12 ' B' ' 167' ' ' LEU . 4.0 m -155.22 13.55 0.37 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.261 -0.9 . . . . 0.0 111.752 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 15.1 tptt 49.34 26.28 1.54 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.999 -1.063 . . . . 0.0 111.066 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -151.86 -47.26 0.11 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.684 -0.635 . . . . 0.0 109.829 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.38 -33.5 63.08 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.702 HD21 HD23 ' A' ' 86' ' ' LEU . 1.6 tt -75.56 -26.66 58.15 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.594 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.7 mm -69.4 -30.65 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.561 -0.712 . . . . 0.0 109.523 179.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -73.11 -28.57 62.34 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.714 -0.616 . . . . 0.0 110.15 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.709 ' O ' HG23 ' B' ' 179' ' ' VAL . 86.9 m-20 -74.86 -29.22 60.96 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.6 -0.687 . . . . 0.0 110.079 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -73.4 -29.96 62.95 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.581 -0.699 . . . . 0.0 109.921 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -77.25 -29.98 54.25 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.609 -0.682 . . . . 0.0 109.94 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.49 -31.13 47.63 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.646 -0.659 . . . . 0.0 109.787 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.709 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.0 t -77.96 -31.06 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.633 -0.667 . . . . 0.0 109.521 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -76.31 -29.0 57.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.654 -0.654 . . . . 0.0 109.811 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.38 -29.09 61.4 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.654 -0.654 . . . . 0.0 109.715 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -71.55 -31.4 66.97 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.579 -0.701 . . . . 0.0 110.039 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.738 ' HA ' HD23 ' A' ' 79' ' ' LEU . 83.9 mt -72.62 -29.64 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.628 -0.67 . . . . 0.0 109.706 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.4 -33.13 72.56 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.619 -0.675 . . . . 0.0 109.853 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 49.0 mtp -71.49 -45.76 61.61 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.589 -0.694 . . . . 0.0 109.768 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.1 t -71.57 -31.5 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.648 -0.658 . . . . 0.0 109.383 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . 0.457 ' HB2' HD11 ' A' ' 76' ' ' LEU . 10.7 tm-20 -74.51 -28.8 61.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.73 -0.606 . . . . 0.0 109.782 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -72.62 -29.72 63.72 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.558 -0.714 . . . . 0.0 110.044 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -36.43 65.71 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.683 -0.635 . . . . 0.0 109.935 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.672 HG12 HD22 ' A' ' 72' ' ' LEU . 75.6 mt -71.29 -31.05 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.639 -0.663 . . . . 0.0 109.573 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 3.2 m -67.77 -37.59 82.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.704 -0.623 . . . . 0.0 109.541 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -74.94 -32.46 61.76 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.622 -0.674 . . . . 0.0 109.4 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.477 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -71.39 -31.56 67.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.631 -0.668 . . . . 0.0 109.295 179.259 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 11.9 tptm -68.81 -46.3 69.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.629 -0.669 . . . . 0.0 109.407 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.67 -29.67 70.67 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 119.967 -0.693 . . . . 0.0 109.151 179.12 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -62.52 -36.55 82.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.604 -0.685 . . . . 0.0 109.208 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.15 -31.16 72.24 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -58.93 -42.78 90.54 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.684 -0.635 . . . . 0.0 109.986 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.64 -39.46 93.92 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.737 -0.602 . . . . 0.0 109.596 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.831 HD23 HD12 ' A' ' 62' ' ' LEU . 15.1 tp -74.41 -28.54 61.13 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.676 -0.64 . . . . 0.0 109.666 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.544 -0.723 . . . . 0.0 109.906 179.693 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.542 HD12 HD23 ' B' ' 200' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 121.069 0.461 . . . . 0.0 109.999 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -73.86 -33.1 63.95 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.63 -0.669 . . . . 0.0 109.932 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -74.45 -38.82 62.87 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.66 -0.65 . . . . 0.0 109.752 179.648 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 58.5 m -71.85 -32.62 67.7 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.723 -0.611 . . . . 0.0 109.434 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -68.14 -29.45 68.36 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.581 179.406 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -63.0 -36.86 84.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.611 -0.681 . . . . 0.0 109.827 179.668 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -75.48 -34.69 60.91 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.466 179.501 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.432 HG12 HD22 ' B' ' 193' ' ' LEU . 83.1 mt -72.12 -28.57 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.734 -0.604 . . . . 0.0 109.397 179.274 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.8 tp -69.21 -40.45 78.0 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.589 -0.694 . . . . 0.0 109.748 179.583 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.23 -31.89 73.15 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.533 -0.729 . . . . 0.0 109.696 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.794 HD22 HG12 ' B' ' 190' ' ' ILE . 6.4 mt -69.69 -30.37 68.01 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.685 -0.634 . . . . 0.0 109.773 179.575 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -69.49 -34.24 74.05 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.598 -0.689 . . . . 0.0 109.758 179.631 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -75.25 -31.7 60.88 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.695 -0.628 . . . . 0.0 109.508 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.15 -30.53 66.57 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.523 179.546 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -74.05 -31.3 62.82 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.61 -0.681 . . . . 0.0 109.714 179.605 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 tp -73.26 -37.85 66.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.673 -0.642 . . . . 0.0 109.693 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.36 -30.9 70.83 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.602 179.483 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.619 HD12 HG12 ' B' ' 183' ' ' ILE . 0.5 OUTLIER -70.76 -46.31 63.19 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.676 -0.64 . . . . 0.0 109.639 179.529 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -66.18 -29.3 69.56 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.661 -0.649 . . . . 0.0 109.644 179.453 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -68.95 -30.27 68.68 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.661 -0.649 . . . . 0.0 109.788 179.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -69.93 -47.05 63.93 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.668 -0.645 . . . . 0.0 109.808 179.692 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.4 tttt -62.28 -29.87 70.73 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.522 -0.736 . . . . 0.0 109.603 179.441 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -62.98 -31.83 73.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.662 -0.649 . . . . 0.0 109.743 179.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -67.2 -32.09 72.92 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.661 -0.649 . . . . 0.0 109.744 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.543 HD23 ' CD2' ' B' ' 172' ' ' LEU . 0.5 OUTLIER -67.57 -31.62 71.82 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.6 -0.687 . . . . 0.0 109.755 179.687 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -62.36 -35.45 79.18 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.615 -0.678 . . . . 0.0 109.88 179.659 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.44 -30.5 64.65 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.671 -0.643 . . . . 0.0 109.696 179.569 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.471 ' O ' HD13 ' B' ' 172' ' ' LEU . 18.8 mt-30 -88.72 -18.51 27.69 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.647 -0.658 . . . . 0.0 110.519 179.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.603 HD11 HD11 ' B' ' 173' ' ' ILE . 32.8 tp . . . . . 0 N--CA 1.501 2.097 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.646 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . 0.557 ' HA2' HD12 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.34 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' B' ' 171' ' ' GLU . 0.4 OUTLIER -109.96 -62.51 1.5 Allowed 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.63 -0.923 . . . . 0.0 109.088 179.975 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 6.2 t -154.41 35.99 0.42 Allowed 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.315 0.579 . . . . 0.0 109.528 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 5.9 tptm 51.87 26.07 3.39 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.524 -0.735 . . . . 0.0 110.118 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -147.61 -45.39 0.17 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.707 -0.621 . . . . 0.0 109.962 -179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.696 ' HB3' HD22 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -64.68 -30.27 71.28 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 119.618 -0.833 . . . . 0.0 109.2 179.39 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.557 HD12 ' HA2' ' B' ' 166' ' ' GLY . 0.3 OUTLIER -81.65 -27.53 34.06 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.63 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.603 HD11 HD11 ' A' ' 90' ' ' LEU . 49.9 mm -69.93 -30.82 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.753 -0.592 . . . . 0.0 109.498 179.428 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.95 -30.31 66.56 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.636 -0.665 . . . . 0.0 109.946 179.77 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.77 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.6 m-20 -76.83 -29.25 55.84 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.623 -0.673 . . . . 0.0 109.871 179.59 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.449 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -75.63 -28.31 58.76 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.653 -0.654 . . . . 0.0 110.056 179.761 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.75 -32.22 57.61 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.583 -0.698 . . . . 0.0 110.057 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -75.22 -29.99 60.46 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.611 -0.681 . . . . 0.0 109.889 179.711 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.77 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.9 t -73.75 -29.43 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.646 -0.659 . . . . 0.0 109.717 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.42 -29.21 65.76 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.558 -0.714 . . . . 0.0 110.029 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 -74.36 -28.9 61.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.602 -0.686 . . . . 0.0 110.118 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . 0.436 ' O ' HG23 ' B' ' 186' ' ' VAL . 9.0 tt0 -75.73 -34.34 60.32 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.533 -0.73 . . . . 0.0 110.155 179.954 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.619 HG12 HD12 ' A' ' 79' ' ' LEU . 83.4 mt -74.0 -29.07 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.628 -0.67 . . . . 0.0 109.768 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.6 m -73.92 -33.92 64.15 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.613 -0.68 . . . . 0.0 109.714 179.549 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.28 -39.2 78.52 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.664 -0.648 . . . . 0.0 109.77 179.662 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . 0.436 HG23 ' O ' ' B' ' 182' ' ' GLU . 57.6 t -70.66 -29.89 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.673 -0.642 . . . . 0.0 109.598 179.612 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -71.17 -28.63 64.38 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.603 -0.685 . . . . 0.0 110.07 179.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -69.72 -33.96 73.22 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.562 -0.711 . . . . 0.0 109.995 179.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -37.93 62.17 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.64 -0.663 . . . . 0.0 109.702 179.74 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.794 HG12 HD22 ' A' ' 72' ' ' LEU . 78.7 mt -73.29 -28.91 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.659 -0.651 . . . . 0.0 109.683 179.629 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 23.5 p -73.39 -34.76 65.7 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.571 -0.706 . . . . 0.0 109.759 179.504 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -77.36 -33.02 55.38 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.611 -0.681 . . . . 0.0 109.473 179.399 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.584 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -74.4 -30.42 61.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.712 -0.617 . . . . 0.0 109.387 179.353 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.0 tptm -68.42 -36.57 79.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.595 -0.691 . . . . 0.0 109.528 179.483 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 8.5 tptp -68.49 -30.25 69.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.663 -0.648 . . . . 0.0 109.547 179.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -35.63 81.24 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.612 -0.68 . . . . 0.0 109.484 179.525 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -63.4 -30.74 71.82 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.747 -0.596 . . . . 0.0 109.8 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.97 -41.73 98.34 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.71 -0.619 . . . . 0.0 109.91 179.71 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -61.99 -45.76 92.2 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.741 -0.599 . . . . 0.0 109.969 179.756 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.542 HD23 HD12 ' A' ' 62' ' ' LEU . 4.4 tp -70.32 -32.84 70.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.621 -0.674 . . . . 0.0 109.716 179.586 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 . . . . . 0 N--CA 1.494 1.726 0 O-C-N 121.678 -0.639 . . . . 0.0 109.895 179.619 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.541 HD11 ' HA ' ' B' ' 201' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.07 0.462 . . . . 0.0 110.113 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -72.94 -33.15 65.75 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.578 -0.701 . . . . 0.0 110.1 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -75.84 -30.03 58.8 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.653 -0.654 . . . . 0.0 109.908 179.762 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.487 HG23 ' NZ ' ' B' ' 196' ' ' LYS . 88.2 m -75.84 -29.59 58.67 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.654 -0.654 . . . . 0.0 109.875 179.621 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -73.83 -26.7 60.73 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.575 -0.703 . . . . 0.0 110.162 179.68 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.86 -33.28 62.08 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.597 -0.689 . . . . 0.0 110.133 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -76.38 -37.29 57.41 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.661 -0.649 . . . . 0.0 109.698 179.727 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.694 HG12 HD23 ' B' ' 193' ' ' LEU . 84.3 mt -72.6 -26.82 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.719 -0.613 . . . . 0.0 109.62 179.399 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.5 mt -72.91 -36.51 67.29 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.541 -0.724 . . . . 0.0 109.734 179.587 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -71.18 -31.06 67.2 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.611 -0.68 . . . . 0.0 109.718 179.605 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.41 HD22 HG12 ' B' ' 190' ' ' ILE . 5.0 mt -69.37 -30.57 68.59 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.774 -0.579 . . . . 0.0 109.831 179.667 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -69.21 -31.32 69.84 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.602 -0.686 . . . . 0.0 109.847 179.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.52 -32.73 54.26 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.603 -0.686 . . . . 0.0 109.626 179.583 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -76.06 -33.19 59.58 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.695 -0.628 . . . . 0.0 109.58 179.581 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.487 HD21 ' HG3' ' B' ' 187' ' ' GLU . 14.7 tp -74.96 -30.16 61.13 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.676 -0.64 . . . . 0.0 109.734 179.549 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.46 HD23 ' O ' ' A' ' 77' ' ' LEU . 2.8 tt -75.43 -36.2 60.82 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.667 -0.646 . . . . 0.0 109.71 179.562 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.72 -30.72 67.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.677 -0.639 . . . . 0.0 109.735 179.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.776 HD23 ' HA ' ' B' ' 183' ' ' ILE . 7.2 tp -69.32 -37.27 77.66 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.696 -0.628 . . . . 0.0 109.709 179.619 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -71.65 -30.09 65.35 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.598 -0.689 . . . . 0.0 109.639 179.359 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.52 -29.91 67.63 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.578 -0.701 . . . . 0.0 109.855 179.555 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.62 -42.8 81.76 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.634 -0.666 . . . . 0.0 109.885 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.53 ' HD3' HD12 ' B' ' 183' ' ' ILE . 3.3 ttpp -62.03 -29.61 70.4 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.555 -0.716 . . . . 0.0 109.769 179.596 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -62.48 -32.17 73.02 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.737 -0.602 . . . . 0.0 109.874 179.713 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -68.75 -37.7 79.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.639 -0.663 . . . . 0.0 109.714 179.68 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.701 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.3 OUTLIER -64.08 -30.08 71.17 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.678 -0.639 . . . . 0.0 109.711 179.668 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -62.47 -36.1 81.41 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.626 -0.671 . . . . 0.0 109.824 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.72 -28.86 69.72 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.638 -0.664 . . . . 0.0 110.007 179.703 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -87.68 -23.98 24.03 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.542 -0.723 . . . . 0.0 110.418 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.574 HD13 ' HE3' ' B' ' 176' ' ' MET . 29.4 tp . . . . . 0 N--CA 1.5 2.034 0 CA-C-O 118.018 -0.991 . . . . 0.0 110.575 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.8 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.4 OUTLIER -109.07 -61.98 1.54 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.561 -0.964 . . . . 0.0 109.01 179.897 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 93.7 p -155.27 35.41 0.38 Allowed 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 121.381 0.61 . . . . 0.0 109.451 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 4.8 tptm 51.88 26.16 3.46 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.526 -0.734 . . . . 0.0 110.146 -178.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -148.4 -44.84 0.15 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.679 -0.638 . . . . 0.0 109.916 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.691 ' HB3' HD22 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -63.89 -30.4 71.49 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 119.612 -0.835 . . . . 0.0 109.27 179.514 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.8 ' HG ' HD11 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -83.48 -28.88 28.43 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 178.567 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.553 HD11 HD11 ' A' ' 90' ' ' LEU . 51.0 mm -68.07 -30.96 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.058 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -70.3 -29.96 66.84 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.675 -0.641 . . . . 0.0 109.903 179.617 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.666 ' O ' HG23 ' B' ' 179' ' ' VAL . 56.4 m-20 -77.45 -32.96 54.83 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.618 -0.676 . . . . 0.0 109.771 179.683 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.701 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -75.68 -30.25 59.31 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.675 -0.641 . . . . 0.0 109.746 179.595 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -76.57 -30.53 57.07 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.634 -0.666 . . . . 0.0 109.859 179.767 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -77.43 -33.85 54.79 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.628 -0.67 . . . . 0.0 109.799 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.666 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.5 t -76.84 -30.65 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.632 -0.668 . . . . 0.0 109.476 179.497 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -75.41 -29.25 59.7 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.656 -0.653 . . . . 0.0 109.865 179.503 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -29.64 62.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.609 -0.682 . . . . 0.0 109.992 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -75.06 -33.18 61.68 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.601 -0.687 . . . . 0.0 109.984 179.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.776 ' HA ' HD23 ' A' ' 79' ' ' LEU . 89.2 mt -72.25 -30.05 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.66 -0.65 . . . . 0.0 109.739 179.698 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.63 -35.13 72.76 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.669 -0.644 . . . . 0.0 109.789 179.556 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.5 ttt -67.55 -41.84 83.6 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.567 -0.708 . . . . 0.0 109.802 179.618 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.5 t -70.79 -30.41 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.674 -0.641 . . . . 0.0 109.638 179.629 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . 0.487 ' HG3' HD21 ' A' ' 76' ' ' LEU . 4.0 tt0 -74.0 -29.9 62.2 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.584 -0.698 . . . . 0.0 109.964 179.697 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -72.36 -29.68 64.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.52 -0.738 . . . . 0.0 109.918 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -38.69 65.31 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.677 -0.64 . . . . 0.0 109.843 179.774 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.421 HD12 HD22 ' A' ' 76' ' ' LEU . 76.0 mt -70.82 -30.5 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.745 -0.597 . . . . 0.0 109.616 179.722 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.6 m -71.09 -36.72 72.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.649 -0.657 . . . . 0.0 109.603 179.557 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 16.5 mmtm -74.88 -31.95 61.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.642 -0.661 . . . . 0.0 109.584 179.478 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.694 HD23 HG12 ' A' ' 69' ' ' ILE . 0.3 OUTLIER -78.62 -14.42 59.33 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.694 -0.629 . . . . 0.0 110.438 179.358 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.7 tptp -87.65 -28.27 21.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.236 -0.915 . . . . 0.0 109.404 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.16 -34.92 56.39 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.583 -0.698 . . . . 0.0 109.753 179.523 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.487 ' NZ ' HG23 ' A' ' 65' ' ' THR . 0.0 OUTLIER -69.67 -27.62 65.18 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 119.785 -0.766 . . . . 0.0 109.538 179.454 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -69.29 -29.77 67.71 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.54 -0.725 . . . . 0.0 109.458 179.174 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -61.19 -43.58 98.65 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.705 -0.622 . . . . 0.0 109.707 179.52 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -61.58 -34.05 74.94 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.746 -0.596 . . . . 0.0 109.616 179.369 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 23.5 tp -78.12 -31.97 50.19 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.541 ' HA ' HD11 ' A' ' 62' ' ' LEU . 4.1 mm-40 . . . . . 0 N--CA 1.493 1.689 0 O-C-N 121.715 -0.615 . . . . 0.0 109.581 179.447 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.604 HD11 ' HG2' ' B' ' 201' ' ' GLU . 2.3 tt . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 121.104 0.478 . . . . 0.0 109.89 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -64.52 -35.69 81.79 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.573 -0.705 . . . . 0.0 109.9 179.888 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -73.7 -35.43 65.15 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.582 -0.699 . . . . 0.0 109.794 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.437 HG21 ' NZ ' ' B' ' 196' ' ' LYS . 86.6 m -71.72 -31.32 66.58 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.741 -0.6 . . . . 0.0 109.604 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -68.07 -28.34 67.28 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.725 -0.609 . . . . 0.0 109.89 179.625 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -65.99 -34.73 78.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.59 -0.694 . . . . 0.0 110.006 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.6 tp60 -77.64 -31.71 52.87 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.679 -0.638 . . . . 0.0 109.64 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.596 HG12 HD22 ' B' ' 193' ' ' LEU . 82.0 mt -77.01 -28.8 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.732 -0.605 . . . . 0.0 109.562 179.496 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 25.4 tp -74.35 -33.89 63.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.598 -0.689 . . . . 0.0 109.632 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -29.94 70.0 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.574 -0.704 . . . . 0.0 109.745 179.626 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.594 HD11 HD13 ' B' ' 193' ' ' LEU . 14.2 mt -65.02 -30.98 72.0 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.642 -0.661 . . . . 0.0 110.046 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.98 -38.87 92.66 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.565 -0.709 . . . . 0.0 110.004 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -73.9 -31.76 63.26 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.548 179.574 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -76.07 -34.96 59.57 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.706 -0.621 . . . . 0.0 109.663 179.58 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.702 ' O ' HD13 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -74.57 -30.65 61.8 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.58 -0.7 . . . . 0.0 109.607 179.464 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.55 HD23 ' O ' ' A' ' 77' ' ' LEU . 5.9 tt -74.39 -34.69 63.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.634 -0.666 . . . . 0.0 109.726 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.37 69.56 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.676 -0.64 . . . . 0.0 109.723 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 79' ' ' LEU . 1.8 mm? -72.16 -43.17 65.02 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.617 -0.677 . . . . 0.0 109.756 179.709 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -67.62 -29.05 68.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.684 -0.635 . . . . 0.0 109.872 179.486 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -70.1 -30.01 67.11 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.583 -0.698 . . . . 0.0 109.847 179.671 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -69.63 -45.65 68.0 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.599 -0.688 . . . . 0.0 109.711 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -61.87 -27.63 68.93 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.531 -0.731 . . . . 0.0 109.606 179.204 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -62.57 -30.01 71.01 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.592 -0.693 . . . . 0.0 109.771 179.561 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -61.34 -43.93 98.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.535 -0.728 . . . . 0.0 109.856 179.685 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.606 HD23 HD21 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -63.74 -33.65 76.13 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.703 -0.623 . . . . 0.0 109.394 179.436 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -62.03 -35.14 77.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.685 -0.634 . . . . 0.0 109.872 179.817 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.68 -27.17 69.05 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.981 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -106.33 12.73 29.55 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.62 -0.675 . . . . 0.0 110.803 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 58.8 tp . . . . . 0 N--CA 1.499 1.983 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.12 -179.866 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.738 HD12 ' N ' ' B' ' 168' ' ' SER . 2.5 pp -140.43 -46.05 0.42 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.616 -0.932 . . . . 0.0 110.501 -179.808 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.738 ' N ' HD12 ' B' ' 167' ' ' LEU . 38.6 m -153.93 13.99 0.46 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.285 -0.884 . . . . 0.0 111.466 179.925 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 24.3 tptp 49.31 26.6 1.62 Allowed 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.085 -1.01 . . . . 0.0 111.02 -179.825 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -151.4 -47.43 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.735 -0.603 . . . . 0.0 109.738 179.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.453 ' CB ' HD11 ' B' ' 167' ' ' LEU . 2.5 mm-40 -74.01 -35.28 64.39 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.27 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.606 HD21 HD23 ' A' ' 86' ' ' LEU . 0.9 OUTLIER -77.12 -29.72 54.89 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.774 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.0 mm -69.51 -29.98 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.393 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -74.1 -31.46 62.81 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.651 -0.656 . . . . 0.0 109.852 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -74.57 -32.76 62.5 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.658 -0.651 . . . . 0.0 109.837 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -29.4 64.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.729 -0.607 . . . . 0.0 109.772 179.523 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.18 -29.76 66.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.557 -0.715 . . . . 0.0 110.054 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 8.0 mtm180 -73.28 -37.08 66.39 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.679 -0.638 . . . . 0.0 109.936 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 59.2 t -73.57 -31.46 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.654 -0.654 . . . . 0.0 109.479 179.594 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -72.2 -29.19 63.74 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.712 -0.617 . . . . 0.0 109.919 179.592 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.52 -31.98 70.53 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.592 -0.692 . . . . 0.0 109.947 179.768 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.06 -35.06 66.63 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.666 -0.646 . . . . 0.0 109.926 179.779 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 86.0 mt -69.51 -30.24 44.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.545 179.6 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.91 -30.98 71.66 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.636 -0.665 . . . . 0.0 109.808 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.6 mtt -68.5 -50.24 53.72 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.685 -0.634 . . . . 0.0 109.843 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -68.21 -30.89 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.578 -0.701 . . . . 0.0 109.564 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -75.23 -28.4 59.88 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.655 -0.653 . . . . 0.0 109.94 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -74.15 -28.89 61.53 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.564 -0.71 . . . . 0.0 110.036 179.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.03 -36.6 64.43 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.545 -0.722 . . . . 0.0 109.97 179.801 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.59 HG12 HD22 ' A' ' 72' ' ' LEU . 84.0 mt -68.99 -30.48 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.669 -0.644 . . . . 0.0 109.668 179.698 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.7 m -68.37 -40.94 81.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.63 -0.669 . . . . 0.0 109.559 179.513 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt -73.31 -33.44 65.17 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.682 -0.636 . . . . 0.0 109.4 179.426 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.596 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -72.37 -30.44 64.7 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.701 -0.625 . . . . 0.0 109.398 179.322 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.4 tppt? -69.75 -42.42 73.9 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.644 -0.66 . . . . 0.0 109.727 179.587 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.41 -31.83 73.19 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.561 -0.712 . . . . 0.0 109.383 179.493 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.437 ' NZ ' HG21 ' A' ' 65' ' ' THR . 2.0 ttpp -63.75 -37.12 86.16 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.697 -0.627 . . . . 0.0 109.452 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -62.28 -29.9 70.75 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.763 -0.586 . . . . 0.0 109.767 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -61.97 -44.97 95.62 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.707 -0.62 . . . . 0.0 109.886 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -63.1 -37.9 89.06 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.698 -0.626 . . . . 0.0 109.82 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.4 tp -73.22 -36.22 66.44 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.612 -0.68 . . . . 0.0 109.719 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.604 ' HG2' HD11 ' A' ' 62' ' ' LEU . 6.1 mt-10 . . . . . 0 N--CA 1.493 1.706 0 O-C-N 121.599 -0.688 . . . . 0.0 109.76 179.639 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.808 HD11 ' HG2' ' B' ' 201' ' ' GLU . 7.6 tt . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.072 0.463 . . . . 0.0 110.019 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -66.45 -39.33 88.79 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.6 -0.688 . . . . 0.0 109.93 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -71.95 -29.88 64.73 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.729 -0.607 . . . . 0.0 109.811 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 74.9 m -73.06 -29.77 63.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.625 -0.672 . . . . 0.0 109.884 179.658 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.79 -27.47 63.93 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.568 -0.707 . . . . 0.0 110.1 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -76.11 -28.1 57.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.508 -0.745 . . . . 0.0 110.235 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 72.8 tp60 -77.7 -33.24 53.24 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.566 -0.709 . . . . 0.0 109.852 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.62 HG12 HD22 ' B' ' 193' ' ' LEU . 68.1 mt -74.12 -28.42 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.718 -0.613 . . . . 0.0 109.577 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.24 -37.22 66.44 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.547 -0.72 . . . . 0.0 109.647 179.537 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.9 tptt -62.8 -29.58 70.82 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.535 -0.728 . . . . 0.0 109.633 179.443 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.629 HD22 HG12 ' B' ' 190' ' ' ILE . 10.9 mt -61.47 -29.6 70.07 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.684 -0.635 . . . . 0.0 109.903 179.593 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.2 -38.55 89.57 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.6 -0.688 . . . . 0.0 109.719 179.603 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.04 -31.68 58.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.636 -0.665 . . . . 0.0 109.268 179.259 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -75.38 -31.97 60.65 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.763 -0.585 . . . . 0.0 109.702 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.439 HD13 HD12 ' B' ' 190' ' ' ILE . 22.3 tp -76.36 -31.41 58.05 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.606 -0.684 . . . . 0.0 109.647 179.469 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 tp -74.81 -33.95 62.29 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 120.263 -0.575 . . . . 0.0 109.61 179.485 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.4 -31.42 69.77 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.721 -0.612 . . . . 0.0 109.735 179.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.405 ' HA ' HD13 ' A' ' 79' ' ' LEU . 1.2 mm? -70.34 -44.01 69.04 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.678 -0.639 . . . . 0.0 109.668 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.441 ' NE2' HG21 ' B' ' 183' ' ' ILE . 32.7 mm-40 -66.42 -30.5 70.87 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.715 179.505 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -67.77 -31.7 71.77 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.682 -0.636 . . . . 0.0 109.779 179.709 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.07 -44.72 88.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.614 -0.679 . . . . 0.0 109.636 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.3 tttm -64.05 -28.82 70.05 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 120.044 -0.662 . . . . 0.0 109.543 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -65.78 -28.69 69.2 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.689 -0.632 . . . . 0.0 110.118 179.749 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -37.51 78.62 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.526 -0.734 . . . . 0.0 109.748 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.561 HD23 ' CD1' ' B' ' 172' ' ' LEU . 2.6 mt -62.87 -29.06 70.46 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.663 -0.648 . . . . 0.0 109.845 179.635 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -62.14 -42.32 99.13 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.5 -0.75 . . . . 0.0 109.508 179.64 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.86 -30.58 69.12 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-O 121.382 0.61 . . . . 0.0 109.515 179.152 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -85.9 -19.54 30.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.675 -0.641 . . . . 0.0 110.53 179.565 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.823 HD11 HD11 ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.03 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.712 -179.815 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.872 HD13 ' CB ' ' B' ' 171' ' ' GLU . 0.1 OUTLIER -131.19 -63.17 0.86 Allowed 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.616 -0.932 . . . . 0.0 109.158 179.95 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 4.2 m -144.56 37.08 1.2 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 121.343 0.592 . . . . 0.0 109.559 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 17.0 tptt 51.92 25.74 3.25 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.483 -0.761 . . . . 0.0 110.17 -179.009 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -146.7 -45.11 0.18 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.661 -0.649 . . . . 0.0 109.953 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.872 ' CB ' HD13 ' B' ' 167' ' ' LEU . 5.3 mm-40 -64.62 -32.43 74.08 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.554 -0.859 . . . . 0.0 109.148 179.399 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.654 HD23 HD11 ' B' ' 167' ' ' LEU . 0.1 OUTLIER -80.35 -28.35 38.09 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.583 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.823 HD11 HD11 ' A' ' 90' ' ' LEU . 47.2 mm -73.9 -30.7 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.641 -0.662 . . . . 0.0 109.623 179.698 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -73.69 -29.26 62.18 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.619 -0.676 . . . . 0.0 110.13 179.897 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.5 ' O ' HG23 ' B' ' 179' ' ' VAL . 42.6 m-20 -73.35 -27.54 61.55 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.603 -0.685 . . . . 0.0 110.204 179.875 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.799 ' HE3' HD23 ' A' ' 90' ' ' LEU . 1.2 mtt -74.51 -28.94 61.21 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.553 -0.717 . . . . 0.0 110.276 179.95 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.77 -28.42 55.67 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.577 -0.702 . . . . 0.0 110.163 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 8.4 ttp180 -77.93 -34.45 51.24 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.595 -0.69 . . . . 0.0 109.918 179.861 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 175' ' ' ASN . 84.2 t -73.58 -29.17 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.671 -0.643 . . . . 0.0 109.479 179.445 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -68.82 -29.56 67.93 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.69 -0.631 . . . . 0.0 109.919 179.592 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 30.8 mtp180 -75.39 -27.78 59.21 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.59 -0.694 . . . . 0.0 109.969 179.681 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -75.49 -34.27 60.85 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.557 -0.715 . . . . 0.0 110.064 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.441 HG21 ' NE2' ' A' ' 80' ' ' GLN . 88.1 mt -71.49 -28.76 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.824 179.675 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -33.53 71.94 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.584 -0.697 . . . . 0.0 109.771 179.555 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 5.0 ttm -69.53 -45.49 68.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.651 -0.656 . . . . 0.0 109.856 179.794 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 61.6 t -70.18 -31.03 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.609 -0.682 . . . . 0.0 109.611 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -74.91 -28.98 60.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.672 -0.643 . . . . 0.0 109.876 179.598 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -73.3 -28.94 62.38 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.607 -0.683 . . . . 0.0 110.001 179.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -35.55 65.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.662 -0.649 . . . . 0.0 110.013 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.629 HG12 HD22 ' A' ' 72' ' ' LEU . 77.2 mt -70.57 -29.76 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.628 -0.67 . . . . 0.0 109.834 179.931 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.12 -39.66 68.67 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.672 -0.643 . . . . 0.0 109.791 179.664 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -73.92 -30.81 62.77 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.598 -0.689 . . . . 0.0 109.487 179.481 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.626 HD13 HD11 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -72.11 -31.03 65.66 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.614 -0.679 . . . . 0.0 109.38 179.282 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -46.63 66.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.602 -0.686 . . . . 0.0 109.456 179.411 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -68.03 -31.54 71.28 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.597 -0.689 . . . . 0.0 109.203 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.41 ' HE2' HD23 ' B' ' 193' ' ' LEU . 15.3 ttpt -65.7 -33.34 75.66 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.703 -0.623 . . . . 0.0 109.436 179.267 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -65.16 -29.98 70.86 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.751 -0.593 . . . . 0.0 109.707 179.544 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -62.83 -42.5 99.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.65 -0.656 . . . . 0.0 109.916 179.743 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -61.13 -45.46 94.57 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.67 -0.644 . . . . 0.0 109.927 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 13.4 tp -72.2 -30.14 64.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.581 -0.7 . . . . 0.0 109.673 179.638 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.808 ' HG2' HD11 ' A' ' 62' ' ' LEU . 6.0 mt-10 . . . . . 0 N--CA 1.494 1.73 0 O-C-N 121.622 -0.674 . . . . 0.0 109.725 179.587 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.598 HD11 ' OE1' ' B' ' 197' ' ' GLN . 4.1 tp . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 121.076 0.465 . . . . 0.0 109.973 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.29 -38.79 88.58 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.552 -0.717 . . . . 0.0 110.035 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -73.44 -36.41 65.92 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.725 -0.609 . . . . 0.0 109.704 179.575 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.629 HG21 ' NZ ' ' B' ' 196' ' ' LYS . 90.8 m -74.06 -31.03 62.69 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.697 -0.627 . . . . 0.0 109.517 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -70.88 -26.67 63.35 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.677 -0.639 . . . . 0.0 109.965 179.51 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -69.11 -35.61 76.61 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.554 -0.716 . . . . 0.0 110.206 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -75.95 -37.06 59.05 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.551 -0.718 . . . . 0.0 109.681 179.665 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.443 HG12 HD22 ' B' ' 193' ' ' LEU . 90.1 mt -71.96 -26.61 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.692 -0.63 . . . . 0.0 109.603 179.256 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.4 tt -70.73 -37.21 73.47 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.493 -0.755 . . . . 0.0 109.884 179.591 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -67.85 -38.04 82.64 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.613 -0.679 . . . . 0.0 109.688 179.649 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.632 HD22 ' CG1' ' B' ' 190' ' ' ILE . 5.4 mt -63.95 -29.6 70.75 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.733 -0.604 . . . . 0.0 109.898 179.714 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.454 ' O ' HD23 ' A' ' 77' ' ' LEU . 2.9 mt-10 -65.22 -38.34 90.12 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.645 -0.659 . . . . 0.0 109.798 179.767 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -73.36 -32.87 64.76 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.383 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.9 tttt -69.76 -36.37 75.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.68 -0.638 . . . . 0.0 109.593 179.529 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.401 HD13 HD12 ' B' ' 190' ' ' ILE . 32.1 tp -70.39 -30.01 66.79 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.626 -0.671 . . . . 0.0 109.731 179.421 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 73' ' ' GLU . 1.9 mm? -73.29 -37.76 66.13 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.716 -0.615 . . . . 0.0 109.727 179.625 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.16 -30.26 70.19 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.716 -0.615 . . . . 0.0 109.826 179.675 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.767 HD23 ' HA ' ' B' ' 183' ' ' ILE . 3.3 mp -70.99 -43.79 67.27 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.687 -0.633 . . . . 0.0 109.829 179.863 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -66.2 -29.59 69.88 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.618 -0.676 . . . . 0.0 109.785 179.755 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -68.78 -30.5 69.1 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.572 -0.705 . . . . 0.0 109.77 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -48.72 56.81 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.635 -0.666 . . . . 0.0 109.777 179.729 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -63.69 -30.34 71.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.556 -0.715 . . . . 0.0 109.591 179.462 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -65.59 -34.6 78.62 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.676 -0.64 . . . . 0.0 109.817 179.613 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.444 ' HA ' HD12 ' A' ' 88' ' ' LEU . 29.8 tp60 -67.25 -37.76 84.05 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.725 -0.609 . . . . 0.0 109.713 179.61 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.635 HD23 HD21 ' B' ' 172' ' ' LEU . 1.3 mt -62.3 -38.45 89.44 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.646 -0.659 . . . . 0.0 109.762 179.66 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -60.9 -42.58 98.29 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.544 -0.722 . . . . 0.0 109.963 179.917 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 85' ' ' GLN . 15.8 mt -67.47 -30.08 69.7 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.742 -0.599 . . . . 0.0 109.676 179.465 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.53 -15.7 34.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.689 -0.632 . . . . 0.0 110.692 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.653 HD13 ' HE3' ' B' ' 176' ' ' MET . 30.5 tp . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.521 -179.859 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.593 HD12 ' N ' ' B' ' 168' ' ' SER . 1.6 pp -50.32 -46.37 55.51 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.793 -0.827 . . . . 0.0 111.607 179.868 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.593 ' N ' HD12 ' B' ' 167' ' ' LEU . 34.8 t -151.74 16.36 0.68 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.258 -0.902 . . . . 0.0 111.115 -179.987 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . 0.473 ' C ' HD13 ' B' ' 173' ' ' ILE . 26.0 tptt 49.94 26.36 1.97 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.131 -0.981 . . . . 0.0 111.021 -179.96 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -153.37 -46.4 0.09 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.648 -0.657 . . . . 0.0 110.03 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.587 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -74.64 -30.29 61.58 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.904 -0.718 . . . . 0.0 109.294 179.59 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.635 HD21 HD23 ' A' ' 86' ' ' LEU . 1.3 tt -79.13 -28.88 42.93 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.711 -0.618 . . . . 0.0 109.672 179.117 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.648 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.3 mp -76.82 -35.25 24.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -64.44 -31.39 72.58 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.905 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.807 ' O ' HG23 ' B' ' 179' ' ' VAL . 77.2 m-20 -75.83 -34.58 60.11 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.109 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.653 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -68.48 -31.76 71.28 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.645 179.524 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -76.93 -30.65 56.19 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.545 -0.722 . . . . 0.0 109.851 179.588 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 -74.8 -30.11 61.31 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.661 -0.65 . . . . 0.0 109.781 179.579 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.807 HG23 ' O ' ' B' ' 175' ' ' ASN . 66.5 t -72.12 -29.47 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.691 -0.63 . . . . 0.0 109.831 179.843 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.94 -31.38 67.95 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.543 -0.723 . . . . 0.0 109.985 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -30.03 63.61 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.739 -0.601 . . . . 0.0 109.828 179.746 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 47.6 tt0 -74.04 -41.17 62.19 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.639 -0.663 . . . . 0.0 109.901 179.716 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.767 ' HA ' HD23 ' A' ' 79' ' ' LEU . 84.0 mt -67.89 -28.37 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.674 -0.641 . . . . 0.0 109.505 179.482 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 35.2 m -66.74 -32.13 73.23 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.55 -0.719 . . . . 0.0 109.691 179.475 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.4 mtt -67.28 -50.28 60.97 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.716 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.9 t -65.13 -30.25 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.653 -0.655 . . . . 0.0 109.565 179.568 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -71.12 -29.61 65.46 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.672 -0.643 . . . . 0.0 109.932 179.734 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -30.5 69.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.618 -0.676 . . . . 0.0 109.861 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -37.42 56.75 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.604 -0.685 . . . . 0.0 109.612 179.689 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.632 ' CG1' HD22 ' A' ' 72' ' ' LEU . 70.9 mt -73.38 -28.98 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.651 -0.656 . . . . 0.0 109.593 179.673 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.2 m -73.18 -34.29 65.92 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.544 -0.722 . . . . 0.0 109.548 179.508 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -37.38 62.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.677 -0.639 . . . . 0.0 109.491 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.443 HD22 HG12 ' A' ' 69' ' ' ILE . 0.5 OUTLIER -69.54 -30.69 68.56 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.58 -0.7 . . . . 0.0 109.403 179.238 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -67.49 -42.93 82.1 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.633 -0.667 . . . . 0.0 109.663 179.54 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -68.74 -33.54 74.09 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.577 -0.702 . . . . 0.0 109.338 179.397 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.629 ' NZ ' HG21 ' A' ' 65' ' ' THR . 0.9 OUTLIER -64.42 -32.62 74.31 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.032 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . 0.598 ' OE1' HD11 ' A' ' 62' ' ' LEU . 6.8 mm-40 -65.49 -30.24 70.98 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.477 179.288 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -60.48 -42.47 96.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.684 -0.635 . . . . 0.0 109.868 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -45.42 93.6 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.679 -0.638 . . . . 0.0 109.689 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.429 HD23 HD12 ' A' ' 62' ' ' LEU . 5.0 tp -72.95 -30.9 64.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.707 -0.621 . . . . 0.0 109.422 179.231 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.69 -0.631 . . . . 0.0 109.928 179.511 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.923 HD12 HD23 ' B' ' 200' ' ' LEU . 18.6 tp . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 121.093 0.473 . . . . 0.0 110.046 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.82 -32.61 69.72 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.555 -0.716 . . . . 0.0 110.02 179.964 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -75.16 -34.19 61.57 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.638 -0.664 . . . . 0.0 109.816 179.669 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.414 HG21 ' OE1' ' B' ' 197' ' ' GLN . 35.9 m -73.53 -30.41 63.06 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.703 -0.623 . . . . 0.0 109.677 179.608 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -71.59 -27.76 63.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.611 -0.68 . . . . 0.0 110.05 179.611 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -70.0 -30.19 67.45 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.571 -0.706 . . . . 0.0 110.156 179.886 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.41 -37.14 60.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.578 -0.701 . . . . 0.0 109.914 179.797 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.447 HD12 HE21 ' B' ' 197' ' ' GLN . 84.9 mt -70.26 -27.77 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.671 -0.643 . . . . 0.0 109.697 179.611 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 21.4 tp -69.75 -35.06 74.64 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.563 -0.711 . . . . 0.0 109.895 179.679 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -67.98 -28.78 67.73 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.526 -0.734 . . . . 0.0 109.911 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.728 HD22 HG12 ' B' ' 190' ' ' ILE . 11.7 mt -68.57 -31.4 70.58 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.599 -0.688 . . . . 0.0 110.108 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -66.42 -37.31 84.92 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.583 -0.698 . . . . 0.0 110.039 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -74.9 -28.53 60.67 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.608 -0.682 . . . . 0.0 109.916 179.662 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -77.53 -29.8 52.52 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.64 -0.662 . . . . 0.0 109.899 179.78 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.1 tp -77.05 -30.71 55.73 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.602 -0.686 . . . . 0.0 109.97 179.837 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.4 mt -79.3 -31.03 43.16 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.625 -0.672 . . . . 0.0 109.74 179.666 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -77.08 -28.4 54.57 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.699 -0.625 . . . . 0.0 109.827 179.487 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.764 HD23 ' HA ' ' B' ' 183' ' ' ILE . 6.8 tp -76.06 -33.75 59.59 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.62 -0.675 . . . . 0.0 109.918 179.704 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -72.45 -31.16 65.22 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.578 -0.701 . . . . 0.0 109.586 179.372 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -67.89 -29.04 68.05 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.719 -0.613 . . . . 0.0 109.787 179.416 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.17 -44.98 82.48 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.544 -0.722 . . . . 0.0 109.864 179.772 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -62.89 -29.48 70.8 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.568 -0.707 . . . . 0.0 109.799 179.686 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -65.69 -38.59 89.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.616 -0.678 . . . . 0.0 109.844 179.721 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -64.99 -46.64 80.6 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.656 -0.653 . . . . 0.0 109.67 179.596 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.817 HD11 ' HB3' ' B' ' 175' ' ' ASN . 0.4 OUTLIER -61.52 -29.28 69.89 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.645 -0.659 . . . . 0.0 109.776 179.493 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.38 -35.58 81.36 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.59 -0.694 . . . . 0.0 109.537 179.619 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.93 -30.59 64.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.724 -0.61 . . . . 0.0 109.409 179.294 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.411 ' HB3' HD11 ' B' ' 172' ' ' LEU . 2.6 tt0 -75.44 -18.51 59.86 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.711 -0.618 . . . . 0.0 110.494 179.55 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.553 HD11 ' CD1' ' B' ' 173' ' ' ILE . 28.0 tp . . . . . 0 N--CA 1.5 2.068 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.643 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.881 HD13 ' CB ' ' B' ' 171' ' ' GLU . 0.2 OUTLIER -126.96 -62.91 1.09 Allowed 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.537 -0.978 . . . . 0.0 109.132 179.901 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 9.0 t -144.36 37.2 1.23 Allowed 'General case' 0 N--CA 1.489 1.484 0 CA-C-O 121.238 0.542 . . . . 0.0 109.576 179.747 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 10.1 tptt 51.76 26.14 3.32 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.569 -0.707 . . . . 0.0 110.138 -178.976 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -147.19 -44.99 0.17 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.691 -0.63 . . . . 0.0 109.834 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.881 ' CB ' HD13 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -65.12 -32.32 73.97 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.383 179.599 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.595 HD23 HD11 ' B' ' 167' ' ' LEU . 0.1 OUTLIER -79.45 -27.34 41.64 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.438 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.553 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.6 mm -70.07 -30.37 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.629 -0.67 . . . . 0.0 109.605 179.501 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -74.93 -27.82 60.36 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.566 -0.709 . . . . 0.0 110.225 179.97 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.817 ' HB3' HD11 ' A' ' 86' ' ' LEU . 55.3 m-20 -77.37 -29.42 53.26 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.543 -0.723 . . . . 0.0 110.14 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.522 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -76.99 -29.64 55.58 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.627 -0.671 . . . . 0.0 109.93 179.771 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.08 -29.37 54.94 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.66 -0.65 . . . . 0.0 110.026 179.914 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.11 -29.05 54.62 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.547 -0.72 . . . . 0.0 109.971 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.723 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.3 t -76.04 -29.32 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.582 -0.699 . . . . 0.0 109.792 179.701 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -74.69 -28.64 60.91 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.608 -0.682 . . . . 0.0 110.176 179.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -29.2 60.82 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.609 -0.682 . . . . 0.0 110.026 179.925 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . 0.54 ' O ' HG23 ' B' ' 186' ' ' VAL . 8.1 tt0 -76.6 -36.18 57.66 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.61 -0.681 . . . . 0.0 110.058 179.833 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.764 ' HA ' HD23 ' A' ' 79' ' ' LEU . 87.6 mt -73.77 -27.88 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.715 -0.616 . . . . 0.0 109.762 179.604 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 29.5 m -73.98 -33.02 63.69 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.502 -0.748 . . . . 0.0 109.769 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 2.9 tpt -76.6 -36.75 57.31 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.626 -0.671 . . . . 0.0 109.585 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . 0.54 HG23 ' O ' ' B' ' 182' ' ' GLU . 73.1 t -75.15 -31.17 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.689 -0.632 . . . . 0.0 109.455 179.343 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -74.74 -29.17 61.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.644 -0.66 . . . . 0.0 109.847 179.678 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -73.72 -29.55 62.32 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.621 -0.674 . . . . 0.0 109.937 179.726 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -71.53 -35.43 70.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.706 -0.621 . . . . 0.0 109.819 179.798 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.728 HG12 HD22 ' A' ' 72' ' ' LEU . 79.0 mt -68.74 -37.89 78.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.576 -0.703 . . . . 0.0 109.849 179.832 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 56.1 p -66.9 -35.07 79.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.629 -0.67 . . . . 0.0 109.446 179.442 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 6.2 mmmm -75.86 -36.05 59.71 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.316 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.66 HD23 ' HE2' ' B' ' 196' ' ' LYS . 0.3 OUTLIER -75.81 -14.61 60.3 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.682 -0.636 . . . . 0.0 110.458 179.358 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.9 tppt? -87.08 -29.25 22.03 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.238 -0.914 . . . . 0.0 109.355 179.334 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -76.53 -35.15 58.46 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 120.192 -0.603 . . . . 0.0 109.88 179.475 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.66 ' HE2' HD23 ' B' ' 193' ' ' LEU . 0.0 OUTLIER -69.77 -28.04 65.42 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 119.769 -0.773 . . . . 0.0 109.555 179.41 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . 0.447 HE21 HD12 ' A' ' 69' ' ' ILE . 4.9 tp60 -72.04 -30.28 65.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.597 -0.689 . . . . 0.0 109.223 179.032 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -35.79 80.55 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.73 -0.606 . . . . 0.0 109.786 179.637 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.06 -44.24 94.85 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.523 -0.736 . . . . 0.0 109.045 179.096 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.923 HD23 HD12 ' A' ' 62' ' ' LEU . 18.0 tp -68.02 -29.06 67.97 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.355 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.72 -0.613 . . . . 0.0 109.872 179.505 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.531 HD21 ' HG2' ' B' ' 201' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 121.152 0.501 . . . . 0.0 109.95 . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -76.05 -31.98 59.08 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.655 -0.653 . . . . 0.0 109.933 179.82 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.28 -34.71 59.1 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.716 -0.615 . . . . 0.0 109.675 179.565 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.1 m -74.82 -34.17 62.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.651 -0.656 . . . . 0.0 109.454 179.4 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.529 ' HA ' HD12 ' A' ' 69' ' ' ILE . 26.4 mttt -69.68 -27.78 65.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.686 -0.634 . . . . 0.0 109.746 179.405 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -67.19 -34.55 77.75 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.513 -0.742 . . . . 0.0 109.912 179.726 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -76.24 -32.44 58.88 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.661 -0.649 . . . . 0.0 109.557 179.544 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.778 HG12 HD22 ' B' ' 193' ' ' LEU . 75.1 mt -72.66 -28.3 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.719 -0.613 . . . . 0.0 109.557 179.335 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 tt -69.27 -38.4 78.37 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.621 -0.674 . . . . 0.0 109.846 179.659 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.2 tmtm? -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.592 -0.693 . . . . 0.0 109.846 179.728 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.641 HD12 ' CG1' ' B' ' 190' ' ' ILE . 1.7 mm? -64.55 -32.84 74.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.711 -0.618 . . . . 0.0 109.912 179.79 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -38.89 91.71 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.594 -0.691 . . . . 0.0 109.83 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.34 -32.07 64.34 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.642 -0.662 . . . . 0.0 109.518 179.455 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.3 tptm -73.19 -33.63 65.52 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.717 -0.614 . . . . 0.0 109.659 179.577 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 20.8 tp -76.02 -32.09 59.2 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.671 -0.643 . . . . 0.0 109.587 179.491 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -76.73 -34.48 58.11 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.747 -0.596 . . . . 0.0 109.558 179.396 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.42 -29.14 62.38 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.708 -0.62 . . . . 0.0 109.79 179.472 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.738 HD23 ' HA ' ' B' ' 183' ' ' ILE . 8.1 tp -75.8 -36.6 59.69 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.662 -0.649 . . . . 0.0 109.817 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.403 ' HA ' ' HG2' ' A' ' 83' ' ' LYS . 20.1 tt0 -76.2 -23.09 54.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.68 -0.637 . . . . 0.0 110.138 179.439 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -81.32 -26.75 35.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.455 -0.778 . . . . 0.0 109.573 179.187 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -76.43 -41.46 47.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.577 -0.702 . . . . 0.0 110.003 179.632 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.403 ' HG2' ' HA ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -68.28 -24.84 64.92 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.627 179.339 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -66.29 -31.04 71.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.552 -0.717 . . . . 0.0 109.446 179.184 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.01 -31.46 72.6 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.616 -0.677 . . . . 0.0 109.595 179.465 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.437 HD21 HD23 ' B' ' 172' ' ' LEU . 0.3 OUTLIER -68.07 -34.96 77.41 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.672 -0.643 . . . . 0.0 109.755 179.548 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -61.87 -36.36 81.02 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.596 -0.69 . . . . 0.0 109.975 179.684 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 tp -64.16 -29.86 70.95 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.677 -0.64 . . . . 0.0 109.95 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -82.41 -13.1 57.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.652 -0.655 . . . . 0.0 110.799 179.822 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.847 HD13 ' HE3' ' B' ' 176' ' ' MET . 38.5 tp . . . . . 0 N--CA 1.501 2.098 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.598 -179.946 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . 0.552 ' HA2' HD12 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.784 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.1 OUTLIER -118.98 -63.13 1.44 Allowed 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.583 -0.951 . . . . 0.0 108.946 -179.957 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.6 t -152.83 33.55 0.49 Allowed 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.277 0.56 . . . . 0.0 109.543 179.684 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 9.6 tptm 51.34 26.73 3.22 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.515 -0.741 . . . . 0.0 110.072 -179.065 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -149.03 -43.21 0.14 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.633 -0.667 . . . . 0.0 110.339 -179.785 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.706 ' HB3' HD22 ' B' ' 167' ' ' LEU . 0.2 OUTLIER -62.0 -40.83 96.98 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.667 179.77 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.784 ' HG ' HD11 ' B' ' 167' ' ' LEU . 1.4 mt -76.18 -28.53 57.33 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.464 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.8 mm -67.5 -31.06 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.328 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -75.53 -32.73 60.58 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.714 179.766 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -73.78 -35.0 64.89 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.67 -0.644 . . . . 0.0 109.566 179.45 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.847 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.8 OUTLIER -67.44 -29.54 69.04 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.729 -0.607 . . . . 0.0 109.966 179.628 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -77.17 -25.34 51.8 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.625 -0.672 . . . . 0.0 110.132 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -77.86 -31.5 51.45 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.562 -0.711 . . . . 0.0 110.194 179.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.535 HG22 ' O ' ' B' ' 176' ' ' MET . 34.5 m -77.21 -24.53 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.573 -0.705 . . . . 0.0 110.294 179.966 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -82.44 -29.71 30.5 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.405 -0.809 . . . . 0.0 109.836 179.653 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -77.49 -27.93 52.03 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.696 -0.627 . . . . 0.0 109.842 179.576 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -77.54 -34.54 53.86 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.537 -0.727 . . . . 0.0 110.021 179.705 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.738 ' HA ' HD23 ' A' ' 79' ' ' LEU . 76.9 mt -74.26 -27.0 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.551 -0.718 . . . . 0.0 109.692 179.574 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 28.1 m -71.61 -31.43 66.89 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.525 -0.735 . . . . 0.0 109.552 179.256 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.26 -44.37 53.17 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.61 -0.681 . . . . 0.0 109.497 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 70.5 t -71.45 -31.83 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.679 -0.638 . . . . 0.0 109.289 179.331 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -72.99 -29.06 62.75 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.704 -0.623 . . . . 0.0 109.797 179.565 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -72.43 -32.17 66.09 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.677 -0.639 . . . . 0.0 109.918 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.46 -29.85 67.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.715 -0.616 . . . . 0.0 109.983 179.803 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.641 ' CG1' HD12 ' A' ' 72' ' ' LEU . 79.7 mt -73.95 -30.27 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.602 -0.686 . . . . 0.0 109.762 179.775 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 97.7 p -71.73 -40.28 69.53 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.627 -0.671 . . . . 0.0 109.519 179.315 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 9.8 mtpp -71.35 -30.19 65.87 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.589 -0.695 . . . . 0.0 109.455 179.341 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.778 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -71.19 -37.65 72.13 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.668 -0.645 . . . . 0.0 109.341 179.366 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.93 -42.37 97.39 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.625 -0.672 . . . . 0.0 109.486 179.453 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.04 -30.64 71.2 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.46 179.337 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.574 ' HE2' HD23 ' B' ' 193' ' ' LEU . 28.5 ttpt -64.35 -34.31 77.85 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.686 -0.634 . . . . 0.0 109.33 179.296 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . 0.478 ' HG2' HD11 ' A' ' 69' ' ' ILE . 4.0 mm-40 -64.49 -31.35 72.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.77 -0.581 . . . . 0.0 109.465 179.38 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -60.22 -40.47 90.27 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.655 -0.653 . . . . 0.0 109.894 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -62.03 -39.64 93.0 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 120.286 -0.566 . . . . 0.0 109.793 179.605 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.78 -31.88 65.2 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.689 -0.632 . . . . 0.0 109.59 179.575 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.531 ' HG2' HD21 ' A' ' 62' ' ' LEU . 4.8 mm-40 . . . . . 0 N--CA 1.493 1.69 0 O-C-N 121.623 -0.673 . . . . 0.0 109.753 179.645 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tp . . . . . 0 N--CA 1.496 1.831 0 CA-C-O 121.005 0.431 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.1 tp10 -70.46 -30.16 66.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.563 -0.711 . . . . 0.0 110.111 179.985 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -73.55 -43.1 60.72 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.637 -0.664 . . . . 0.0 109.84 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.488 HG22 HD11 ' A' ' 69' ' ' ILE . 73.8 m -67.45 -30.55 70.3 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.701 -0.625 . . . . 0.0 109.596 179.503 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -67.6 -27.9 67.29 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.628 -0.67 . . . . 0.0 109.909 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.84 -40.6 91.92 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.507 -0.745 . . . . 0.0 110.119 179.872 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -73.75 -36.99 65.2 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.609 -0.682 . . . . 0.0 109.579 179.64 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.552 HG12 HD22 ' B' ' 193' ' ' LEU . 75.7 mt -73.02 -27.98 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.707 -0.62 . . . . 0.0 109.399 179.261 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.58 -34.91 72.7 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.61 -0.681 . . . . 0.0 109.764 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -62.96 -36.13 82.43 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.557 -0.714 . . . . 0.0 109.753 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.581 HD22 HG12 ' B' ' 190' ' ' ILE . 15.5 mt -63.05 -28.61 70.21 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.61 -0.681 . . . . 0.0 109.919 179.696 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.02 -41.16 99.47 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.575 -0.703 . . . . 0.0 110.002 179.822 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.46 -32.19 66.06 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.683 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -77.17 -33.97 56.4 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.728 -0.607 . . . . 0.0 109.631 179.635 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.4 tp -75.72 -29.67 59.0 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.651 -0.656 . . . . 0.0 109.706 179.454 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tt -76.27 -34.77 59.14 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.716 -0.615 . . . . 0.0 109.649 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.31 -29.69 65.32 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.634 -0.666 . . . . 0.0 109.792 179.49 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.588 HD12 ' CG1' ' B' ' 183' ' ' ILE . 0.4 OUTLIER -71.83 -40.19 69.26 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.63 -0.669 . . . . 0.0 109.725 179.736 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -69.45 -30.39 68.29 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.579 -0.7 . . . . 0.0 109.696 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -69.02 -29.5 67.67 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.738 -0.601 . . . . 0.0 109.769 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -65.75 -41.62 91.91 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.642 -0.661 . . . . 0.0 109.826 179.879 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -67.9 -29.69 68.84 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.59 -0.694 . . . . 0.0 109.791 179.623 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -68.29 -31.42 70.85 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.687 -0.633 . . . . 0.0 109.861 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 51.6 tp60 -68.15 -35.83 78.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.594 -0.691 . . . . 0.0 109.731 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.601 HD13 ' HA ' ' B' ' 176' ' ' MET . 2.8 mt -63.43 -32.2 73.58 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.661 -0.649 . . . . 0.0 109.851 179.702 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -61.5 -38.85 88.81 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.555 -0.716 . . . . 0.0 109.789 179.73 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 44.4 mt -73.73 -30.66 62.96 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.709 -0.619 . . . . 0.0 109.663 179.492 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -86.9 -16.99 34.32 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.59 -0.694 . . . . 0.0 110.688 179.65 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.465 HD11 ' CD1' ' B' ' 173' ' ' ILE . 53.4 tp . . . . . 0 N--CA 1.5 2.061 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.646 179.996 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.737 HD12 ' N ' ' B' ' 168' ' ' SER . 2.9 pp -139.54 -44.59 0.45 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.617 -0.931 . . . . 0.0 110.54 -179.911 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.737 ' N ' HD12 ' B' ' 167' ' ' LEU . 20.5 t -153.85 15.16 0.49 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.407 -0.808 . . . . 0.0 111.299 -179.99 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.9 tptm 49.51 26.44 1.7 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.095 -1.003 . . . . 0.0 111.059 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.63 -46.77 0.1 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.695 -0.628 . . . . 0.0 110.064 179.991 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.563 ' CB ' HD11 ' B' ' 167' ' ' LEU . 2.6 mm-40 -73.49 -37.29 65.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.575 -0.703 . . . . 0.0 109.119 179.483 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.466 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.3 tt -74.39 -27.59 60.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.746 -0.597 . . . . 0.0 109.408 178.821 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.465 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.3 mm -69.53 -33.68 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.591 -0.693 . . . . 0.0 109.277 179.388 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -70.7 -30.56 67.15 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.711 -0.618 . . . . 0.0 109.722 179.538 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -70.03 -41.37 74.37 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.68 -0.637 . . . . 0.0 109.86 179.594 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.601 ' HA ' HD13 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -62.35 -32.63 73.44 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.704 -0.623 . . . . 0.0 109.888 179.669 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -73.07 -29.41 62.93 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.71 -0.619 . . . . 0.0 109.969 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -73.03 -33.13 65.53 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.627 -0.671 . . . . 0.0 109.966 179.863 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.568 HG21 ' CD1' ' A' ' 86' ' ' LEU . 61.3 t -71.23 -30.68 41.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.622 -0.674 . . . . 0.0 109.668 179.788 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.26 -30.45 68.57 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 120.123 -0.631 . . . . 0.0 109.891 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -76.16 -28.35 57.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.678 -0.639 . . . . 0.0 109.941 179.585 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -76.35 -34.16 58.96 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.564 -0.71 . . . . 0.0 110.016 179.771 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.588 ' CG1' HD12 ' A' ' 79' ' ' LEU . 85.1 mt -74.34 -29.97 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.673 -0.642 . . . . 0.0 109.653 179.676 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 26.3 m -72.52 -30.75 64.75 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.549 -0.72 . . . . 0.0 109.778 179.479 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.4 mtp -73.64 -44.64 56.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.625 -0.672 . . . . 0.0 109.688 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -72.08 -30.84 37.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.585 -0.697 . . . . 0.0 109.399 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -74.4 -29.33 61.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.625 -0.672 . . . . 0.0 109.747 179.358 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.23 -30.95 68.15 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.695 -0.628 . . . . 0.0 109.81 179.609 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -36.04 68.9 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.632 -0.667 . . . . 0.0 109.824 179.638 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.581 HG12 HD22 ' A' ' 72' ' ' LEU . 75.7 mt -71.57 -31.05 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.687 -0.633 . . . . 0.0 109.439 179.704 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 11.5 m -68.41 -37.89 80.75 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.633 -0.667 . . . . 0.0 109.474 179.519 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 39.2 mttm -74.85 -36.25 62.35 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 120.098 -0.641 . . . . 0.0 109.37 179.349 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.552 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -72.18 -31.32 65.81 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.167 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? -67.56 -39.75 84.92 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.664 -0.648 . . . . 0.0 109.489 179.407 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -31.74 73.0 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.689 -0.632 . . . . 0.0 109.317 179.284 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -63.48 -37.03 85.75 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.71 -0.619 . . . . 0.0 109.411 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -62.05 -29.8 70.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.775 -0.578 . . . . 0.0 109.66 179.458 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -61.69 -46.28 90.39 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.683 -0.635 . . . . 0.0 109.906 179.662 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -63.87 -40.8 97.4 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.752 -0.592 . . . . 0.0 109.863 179.751 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 21.9 tp -71.71 -32.68 68.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.632 -0.668 . . . . 0.0 109.814 179.692 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 . . . . . 0 N--CA 1.493 1.681 0 O-C-N 121.569 -0.707 . . . . 0.0 109.814 179.718 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.734 HD12 HD23 ' B' ' 200' ' ' LEU . 1.7 tp . . . . . 0 N--CA 1.495 1.811 0 CA-C-O 121.052 0.453 . . . . 0.0 109.965 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -63.62 -32.19 73.59 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.653 -0.654 . . . . 0.0 110.081 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -67.8 -52.0 42.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.61 -0.681 . . . . 0.0 109.946 179.667 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.2 m -62.95 -31.92 73.12 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.701 -0.624 . . . . 0.0 109.484 179.504 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -65.46 -28.38 69.17 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.647 -0.658 . . . . 0.0 109.773 179.415 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -62.21 -42.41 99.27 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.572 -0.705 . . . . 0.0 109.935 179.814 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -75.5 -33.26 60.75 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.584 -0.698 . . . . 0.0 109.403 179.417 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -75.63 -26.52 18.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.212 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.8 tp -72.2 -34.04 68.08 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.576 -0.703 . . . . 0.0 109.825 179.657 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -66.21 -37.48 85.65 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.525 -0.735 . . . . 0.0 109.808 179.696 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.65 HD22 HG12 ' B' ' 190' ' ' ILE . 8.0 mt -64.88 -29.19 70.13 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.695 -0.628 . . . . 0.0 109.92 179.737 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.435 ' O ' HD13 ' A' ' 77' ' ' LEU . 14.3 mt-10 -66.52 -34.37 77.76 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.58 -0.7 . . . . 0.0 109.897 179.837 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -76.61 -31.83 57.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.707 -0.621 . . . . 0.0 109.558 179.589 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -76.2 -30.32 57.95 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.811 -0.555 . . . . 0.0 109.716 179.712 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.928 HD13 HD12 ' B' ' 190' ' ' ILE . 6.1 tp -77.11 -31.99 56.21 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.628 -0.67 . . . . 0.0 109.661 179.581 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.435 HD13 ' O ' ' A' ' 73' ' ' GLU . 0.7 OUTLIER -74.98 -34.6 62.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.622 -0.674 . . . . 0.0 109.558 179.502 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.85 -29.99 67.36 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.784 179.452 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.767 HD12 HG12 ' B' ' 183' ' ' ILE . 0.3 OUTLIER -71.03 -44.27 66.19 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.636 -0.665 . . . . 0.0 109.609 179.575 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -66.81 -30.85 71.14 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.588 -0.695 . . . . 0.0 109.664 179.445 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.8 -30.2 69.57 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.772 -0.58 . . . . 0.0 109.802 179.593 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.68 -44.26 86.79 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.643 -0.661 . . . . 0.0 109.805 179.765 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -62.83 -33.06 74.44 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.574 -0.704 . . . . 0.0 109.619 179.556 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -62.66 -31.26 72.1 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.703 -0.623 . . . . 0.0 109.962 179.772 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -70.9 -35.95 72.51 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.712 -0.617 . . . . 0.0 109.785 179.689 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.648 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.2 OUTLIER -64.89 -30.52 71.52 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.684 -0.635 . . . . 0.0 109.671 179.611 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -62.43 -36.46 82.47 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.661 -0.649 . . . . 0.0 109.8 179.726 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.437 HD12 ' N ' ' A' ' 88' ' ' LEU . 8.6 mp -73.07 -29.51 63.01 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.756 -0.59 . . . . 0.0 109.965 179.656 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -85.86 -23.86 26.93 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.67 -0.644 . . . . 0.0 110.345 179.829 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.522 HD22 ' CE ' ' B' ' 176' ' ' MET . 53.2 tp . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.471 -179.977 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . 0.441 ' HA2' HD13 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.734 HD12 ' N ' ' B' ' 168' ' ' SER . 3.0 pp -140.76 -43.65 0.39 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.607 -0.937 . . . . 0.0 110.597 -179.77 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.734 ' N ' HD12 ' B' ' 167' ' ' LEU . 33.3 t -153.21 16.55 0.55 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.344 -0.848 . . . . 0.0 111.141 179.851 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . 0.462 ' C ' HD13 ' B' ' 173' ' ' ILE . 10.6 tptm 49.84 26.37 1.9 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.133 -0.979 . . . . 0.0 111.12 179.982 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -154.58 -45.86 0.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.628 -0.67 . . . . 0.0 110.331 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.632 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.6 OUTLIER -74.21 -31.04 62.47 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.436 179.8 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.562 HD12 HD23 ' B' ' 167' ' ' LEU . 1.5 tt -79.69 -29.77 40.88 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.671 -0.643 . . . . 0.0 109.606 179.182 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.638 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.3 mp -75.83 -34.33 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 179.322 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -65.09 -32.73 74.58 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.748 ' O ' HG23 ' B' ' 179' ' ' VAL . 76.8 m-20 -75.56 -33.43 60.64 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.03 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.648 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -70.14 -35.89 74.39 Favored 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.54 179.549 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -72.86 -30.5 64.04 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.651 -0.656 . . . . 0.0 109.81 179.708 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -29.63 64.47 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.641 -0.662 . . . . 0.0 109.888 179.7 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.748 HG23 ' O ' ' B' ' 175' ' ' ASN . 65.5 t -69.76 -29.91 42.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.589 -0.694 . . . . 0.0 109.805 179.728 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -68.72 -30.4 69.03 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.61 -0.681 . . . . 0.0 109.841 179.819 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.04 -29.49 61.93 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.643 -0.661 . . . . 0.0 109.897 179.783 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -74.81 -37.45 62.32 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.685 -0.634 . . . . 0.0 109.949 179.699 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.767 HG12 HD12 ' A' ' 79' ' ' LEU . 85.9 mt -72.08 -29.25 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.698 -0.626 . . . . 0.0 109.674 179.606 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 25.2 m -72.49 -31.76 65.64 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.56 -0.713 . . . . 0.0 109.847 179.555 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -42.52 65.74 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.592 -0.693 . . . . 0.0 109.796 179.631 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.69 -31.44 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.695 -0.628 . . . . 0.0 109.457 179.584 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -72.13 -29.75 64.37 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.63 -0.669 . . . . 0.0 109.818 179.579 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -30.86 69.54 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.569 -0.707 . . . . 0.0 109.803 179.739 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -75.59 -35.16 60.63 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.666 -0.646 . . . . 0.0 109.766 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.928 HD12 HD13 ' A' ' 76' ' ' LEU . 79.1 mt -73.39 -31.55 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.58 -0.7 . . . . 0.0 109.43 179.616 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.9 m -70.02 -35.94 74.7 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.7 -0.625 . . . . 0.0 109.327 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -75.2 -37.22 61.24 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.594 -0.691 . . . . 0.0 109.283 179.299 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.75 -30.96 66.16 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.677 -0.639 . . . . 0.0 109.436 179.196 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -68.83 -36.93 78.79 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.697 -0.627 . . . . 0.0 109.753 179.587 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -62.8 -30.28 71.35 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.584 -0.698 . . . . 0.0 109.628 179.571 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -39.33 94.45 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.692 -0.63 . . . . 0.0 109.621 179.443 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -62.69 -29.19 70.47 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.716 -0.615 . . . . 0.0 109.704 179.494 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -61.75 -38.12 86.8 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.665 -0.647 . . . . 0.0 109.771 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -68.01 -39.68 83.13 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.707 -0.62 . . . . 0.0 109.727 179.635 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.734 HD23 HD12 ' A' ' 62' ' ' LEU . 11.0 tp -74.07 -30.75 62.53 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.632 -0.667 . . . . 0.0 109.685 179.552 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.613 ' HG2' HD11 ' A' ' 62' ' ' LEU . 3.8 mm-40 . . . . . 0 N--CA 1.494 1.732 0 O-C-N 121.604 -0.685 . . . . 0.0 109.852 179.544 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.491 ' HG ' HD23 ' B' ' 200' ' ' LEU . 1.5 tt . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 121.168 0.508 . . . . 0.0 109.953 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -61.78 -33.25 73.77 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.546 -0.721 . . . . 0.0 110.063 179.911 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.29 -48.84 63.9 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.615 -0.678 . . . . 0.0 109.796 179.782 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.4 m -63.04 -33.53 75.63 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 120.266 -0.573 . . . . 0.0 109.599 179.523 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.89 -28.74 69.75 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.66 -0.65 . . . . 0.0 109.819 179.651 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -63.21 -36.78 84.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.601 -0.687 . . . . 0.0 110.056 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -75.0 -35.85 62.0 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.66 -0.65 . . . . 0.0 109.65 179.656 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.57 ' CD1' HD22 ' B' ' 193' ' ' LEU . 50.8 mm -72.82 -28.46 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.679 -0.638 . . . . 0.0 109.545 179.434 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.5 tp -73.18 -40.16 65.02 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.555 -0.716 . . . . 0.0 109.875 179.516 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.6 ttpp -69.36 -32.57 71.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.622 -0.674 . . . . 0.0 109.597 179.54 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.78 HD12 HG12 ' B' ' 190' ' ' ILE . 1.5 mm? -69.42 -36.28 76.55 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.721 -0.612 . . . . 0.0 109.719 179.55 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -64.54 -33.46 75.96 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.629 -0.67 . . . . 0.0 109.727 179.712 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -74.38 -31.74 62.48 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.673 -0.642 . . . . 0.0 109.448 179.505 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -68.62 -30.47 69.2 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.768 -0.582 . . . . 0.0 109.747 179.599 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.501 HD13 HD12 ' B' ' 190' ' ' ILE . 14.2 tp -73.0 -34.36 66.35 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.56 -0.713 . . . . 0.0 109.696 179.664 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.82 -36.71 64.99 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.253 -0.579 . . . . 0.0 109.611 179.51 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.54 -29.98 67.7 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.708 -0.62 . . . . 0.0 109.723 179.565 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.568 HD12 HG12 ' B' ' 183' ' ' ILE . 0.3 OUTLIER -73.64 -44.01 58.02 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.67 -0.644 . . . . 0.0 109.624 179.607 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -68.68 -30.79 69.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.619 -0.675 . . . . 0.0 109.538 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.56 -29.56 68.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.602 -0.686 . . . . 0.0 109.703 179.527 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -67.42 -45.91 74.74 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.693 -0.629 . . . . 0.0 109.88 179.703 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.2 tttm -62.86 -29.98 71.16 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.529 -0.732 . . . . 0.0 109.682 179.466 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -64.18 -29.41 70.52 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.669 -0.644 . . . . 0.0 109.863 179.595 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.97 -39.22 79.58 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.521 -0.737 . . . . 0.0 109.797 179.74 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.478 HD23 HD21 ' B' ' 172' ' ' LEU . 2.6 mt -61.86 -31.06 71.3 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.544 -0.722 . . . . 0.0 109.873 179.727 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -61.84 -40.41 95.2 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.535 -0.728 . . . . 0.0 109.78 179.748 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.4 mt -72.5 -31.38 65.31 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.684 -0.635 . . . . 0.0 109.486 179.392 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -86.15 -14.76 43.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.756 -0.59 . . . . 0.0 110.634 179.533 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.425 HD11 HD11 ' B' ' 173' ' ' ILE . 50.7 tp . . . . . 0 N--CA 1.5 2.062 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.572 -179.895 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.353 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.75 HD12 ' N ' ' B' ' 168' ' ' SER . 2.6 pp -139.83 -45.98 0.44 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.614 -0.933 . . . . 0.0 110.458 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.75 ' N ' HD12 ' B' ' 167' ' ' LEU . 37.4 t -156.82 12.38 0.25 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.343 -0.848 . . . . 0.0 111.931 -179.945 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 39.5 tptt 49.24 26.48 1.53 Allowed 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.085 -1.01 . . . . 0.0 111.197 -179.826 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -152.23 -47.77 0.1 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.761 -0.587 . . . . 0.0 109.647 179.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.406 ' HB2' ' CD1' ' B' ' 167' ' ' LEU . 3.5 mm-40 -74.29 -34.0 63.41 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.374 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.565 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.7 tt -75.18 -27.91 59.85 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.798 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.425 HD11 HD11 ' A' ' 90' ' ' LEU . 50.6 mm -68.54 -31.5 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.6 -0.688 . . . . 0.0 109.374 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -68.52 -30.11 68.84 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.746 -0.596 . . . . 0.0 109.789 179.657 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -74.94 -29.26 60.89 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.63 -0.669 . . . . 0.0 109.924 179.808 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.03 -24.34 55.19 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.641 -0.662 . . . . 0.0 110.243 179.889 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.75 -27.05 31.33 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.451 -0.781 . . . . 0.0 109.691 179.464 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -37.82 37.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.564 -0.71 . . . . 0.0 109.868 179.729 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 11.3 p -73.92 -25.62 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 C-N-CA 119.88 -0.728 . . . . 0.0 109.831 179.508 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -73.97 -30.5 62.55 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.564 -0.71 . . . . 0.0 109.688 179.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 12.3 mtp180 -72.73 -29.91 63.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.618 -0.676 . . . . 0.0 109.784 179.62 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . 0.464 ' O ' HG23 ' B' ' 186' ' ' VAL . 0.6 OUTLIER -69.09 -31.0 69.42 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.598 -0.689 . . . . 0.0 109.872 179.705 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.568 HG12 HD12 ' A' ' 79' ' ' LEU . 82.9 mt -70.39 -31.39 46.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.696 -0.628 . . . . 0.0 109.629 179.695 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.33 -38.09 71.69 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.678 -0.639 . . . . 0.0 109.708 179.582 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 7.2 ttm -67.66 -39.34 84.54 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.612 -0.68 . . . . 0.0 109.746 179.621 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . 0.464 HG23 ' O ' ' B' ' 182' ' ' GLU . 70.1 t -72.34 -30.86 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.604 -0.685 . . . . 0.0 109.543 179.622 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -73.13 -28.44 62.25 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.654 -0.654 . . . . 0.0 109.977 179.664 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -72.66 -32.29 65.74 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.638 -0.664 . . . . 0.0 109.998 179.855 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -73.88 -38.88 64.26 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.715 -0.615 . . . . 0.0 109.823 179.807 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.78 HG12 HD12 ' A' ' 72' ' ' LEU . 79.4 mt -71.52 -31.52 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.468 179.577 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.0 m -67.91 -35.36 78.32 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.662 -0.649 . . . . 0.0 109.256 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.3 mmtp -77.92 -33.0 52.0 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 179.181 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.57 HD22 ' CD1' ' A' ' 69' ' ' ILE . 0.9 OUTLIER -74.85 -31.5 61.67 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.135 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . 0.427 ' HE3' HG21 ' A' ' 69' ' ' ILE . 0.0 OUTLIER -69.54 -40.94 76.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.692 -0.63 . . . . 0.0 109.425 179.4 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -31.0 71.47 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.248 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.417 ' HE2' HD23 ' B' ' 193' ' ' LEU . 24.8 ttpt -63.68 -36.5 84.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.666 -0.646 . . . . 0.0 109.375 179.245 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 31.8 tp60 -62.82 -30.45 71.49 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.793 -0.567 . . . . 0.0 109.692 179.504 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -61.28 -42.75 99.17 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.711 -0.618 . . . . 0.0 109.898 179.685 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -62.3 -43.02 99.8 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.707 -0.621 . . . . 0.0 109.84 179.719 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.491 HD23 ' HG ' ' A' ' 62' ' ' LEU . 14.0 tp -72.66 -30.27 64.13 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.659 -0.651 . . . . 0.0 109.656 179.46 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.608 -0.683 . . . . 0.0 109.889 179.548 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.555 ' HG ' HD23 ' B' ' 200' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 121.08 0.466 . . . . 0.0 110.223 . . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -75.42 -36.72 60.76 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.573 -0.705 . . . . 0.0 110.113 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -74.49 -30.54 61.86 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.691 -0.63 . . . . 0.0 109.922 179.735 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 70.4 m -74.81 -29.26 61.03 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.617 -0.677 . . . . 0.0 109.832 179.505 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.0 mmtt -72.47 -26.9 61.98 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.612 -0.68 . . . . 0.0 110.219 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.27 -31.89 64.34 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.521 -0.737 . . . . 0.0 110.305 179.986 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.9 tp60 -75.91 -33.36 59.9 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.525 -0.734 . . . . 0.0 109.877 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.659 HG12 HD23 ' B' ' 193' ' ' LEU . 88.3 mt -74.16 -26.87 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.663 -0.648 . . . . 0.0 109.8 179.706 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.573 ' O ' HD23 ' A' ' 70' ' ' LEU . 6.6 tt -74.93 -37.42 62.04 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.487 -0.758 . . . . 0.0 109.499 179.331 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -62.6 -29.91 70.95 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.646 -0.659 . . . . 0.0 109.521 179.202 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.615 HD22 HG12 ' B' ' 190' ' ' ILE . 12.5 mt -60.72 -30.01 69.71 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.616 -0.678 . . . . 0.0 109.935 179.654 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -61.99 -38.17 87.58 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.647 -0.658 . . . . 0.0 109.776 179.763 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.96 -31.85 56.87 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.217 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.482 ' O ' HD23 ' A' ' 79' ' ' LEU . 4.8 tttm -75.43 -31.56 60.39 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.82 -0.55 . . . . 0.0 109.781 179.561 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 46.9 tp -76.03 -33.36 59.64 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.592 -0.692 . . . . 0.0 109.709 179.633 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.2 tt -75.35 -35.37 61.15 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.728 -0.607 . . . . 0.0 109.473 179.314 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.51 68.19 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 120.228 -0.589 . . . . 0.0 109.656 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.482 HD23 ' O ' ' A' ' 75' ' ' LYS . 1.0 OUTLIER -68.75 -43.92 74.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.616 -0.678 . . . . 0.0 109.828 179.73 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -66.86 -31.12 71.52 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.586 -0.697 . . . . 0.0 109.623 179.586 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -68.05 -28.4 67.35 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.671 -0.643 . . . . 0.0 109.819 179.546 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.5 -43.27 85.76 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.57 -0.706 . . . . 0.0 109.954 179.858 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.51 ' HA ' HG11 ' B' ' 179' ' ' VAL . 8.8 ttpp -62.62 -30.13 71.12 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.593 -0.692 . . . . 0.0 109.822 179.818 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -64.48 -38.6 91.58 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.564 -0.71 . . . . 0.0 109.75 179.799 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -64.7 -29.43 70.42 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.707 -0.621 . . . . 0.0 109.708 179.59 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.442 HD12 ' HG3' ' B' ' 176' ' ' MET . 0.3 OUTLIER -65.1 -31.74 73.1 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.68 -0.637 . . . . 0.0 109.793 179.822 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -66.48 -45.68 78.85 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.663 -0.648 . . . . 0.0 110.143 179.998 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.8 mp -62.21 -32.71 73.4 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.69 -0.631 . . . . 0.0 109.899 179.777 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.416 ' O ' HD13 ' B' ' 172' ' ' LEU . 6.8 mt-30 -86.71 -22.04 26.28 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.732 -0.605 . . . . 0.0 110.372 179.714 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.789 HD11 ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.957 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.634 -179.907 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.734 HD12 ' N ' ' B' ' 168' ' ' SER . 2.8 pp -140.16 -44.92 0.42 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.59 -0.947 . . . . 0.0 110.582 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.734 ' N ' HD12 ' B' ' 167' ' ' LEU . 10.5 t -153.81 15.12 0.49 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.354 -0.841 . . . . 0.0 111.35 -179.99 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.0 tptt 49.64 26.41 1.78 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.091 -1.006 . . . . 0.0 111.048 -179.835 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -152.5 -46.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.697 -0.627 . . . . 0.0 110.052 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.549 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.7 OUTLIER -74.44 -34.62 63.24 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.215 179.45 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.563 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.5 tt -75.92 -27.32 57.57 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.864 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.789 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.8 mm -68.76 -32.02 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.627 -0.671 . . . . 0.0 109.336 179.331 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -72.98 -28.51 62.44 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.725 -0.609 . . . . 0.0 109.891 179.542 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.805 ' O ' HG23 ' B' ' 179' ' ' VAL . 78.7 m-20 -71.48 -29.52 64.92 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.682 -0.636 . . . . 0.0 109.994 179.818 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.637 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -69.28 -30.73 68.88 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.583 -0.698 . . . . 0.0 109.871 179.923 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -77.03 -31.41 56.27 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.707 -0.621 . . . . 0.0 109.718 179.67 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 5.2 tpm_? -74.51 -30.26 61.73 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.675 -0.641 . . . . 0.0 109.784 179.57 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.805 HG23 ' O ' ' B' ' 175' ' ' ASN . 65.4 t -71.79 -29.78 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.685 -0.635 . . . . 0.0 109.735 179.66 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -78.26 -23.46 47.27 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.614 -0.679 . . . . 0.0 110.306 179.751 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.48 -28.41 37.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.437 -0.789 . . . . 0.0 109.087 179.448 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -72.0 -29.4 64.17 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.49 -0.756 . . . . 0.0 109.952 179.613 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 84.8 mt -73.83 -29.66 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.647 -0.658 . . . . 0.0 109.826 179.808 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 12.9 m -72.86 -30.14 63.74 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.622 -0.674 . . . . 0.0 109.96 179.787 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.7 mtt -73.99 -40.71 62.77 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.673 -0.642 . . . . 0.0 109.906 179.767 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.4 t -71.48 -30.37 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.621 -0.674 . . . . 0.0 109.577 179.718 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -73.34 -28.81 62.27 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.616 -0.677 . . . . 0.0 109.991 179.638 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.39 -28.51 63.04 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.575 -0.703 . . . . 0.0 110.085 179.806 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -30.66 58.54 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.565 -0.71 . . . . 0.0 110.082 179.969 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.615 HG12 HD22 ' A' ' 72' ' ' LEU . 76.4 mt -76.79 -31.13 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.583 -0.698 . . . . 0.0 109.789 179.834 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 14.7 m -73.78 -31.27 63.22 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.744 -0.597 . . . . 0.0 109.609 179.37 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 26.1 mmtm -76.63 -34.73 58.31 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.416 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.659 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -70.17 -34.63 73.23 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.307 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -63.96 -45.15 90.42 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.331 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -71.31 -31.11 67.05 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.023 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -69.98 -35.03 74.11 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.222 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.11 -30.1 71.19 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.678 -0.639 . . . . 0.0 109.602 179.464 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -61.41 -43.05 99.53 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.742 -0.598 . . . . 0.0 109.92 179.695 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -61.97 -38.62 89.23 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.673 -0.642 . . . . 0.0 109.908 179.836 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.555 HD23 ' HG ' ' A' ' 62' ' ' LEU . 0.4 OUTLIER -75.08 -29.79 60.75 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.607 -0.683 . . . . 0.0 109.766 179.554 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.414 ' HA ' HD11 ' A' ' 62' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.73 0 O-C-N 121.634 -0.666 . . . . 0.0 109.802 179.676 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.703 HD11 ' CG ' ' B' ' 201' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 121.13 0.49 . . . . 0.0 110.025 . . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -72.57 -34.62 67.59 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.552 -0.718 . . . . 0.0 109.917 179.798 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -76.46 -33.54 58.73 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.675 -0.641 . . . . 0.0 109.562 179.521 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.9 m -74.2 -30.8 62.37 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.732 -0.605 . . . . 0.0 109.428 179.351 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -69.76 -27.9 65.32 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.705 -0.622 . . . . 0.0 109.987 179.663 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.94 -37.69 75.93 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.473 -0.767 . . . . 0.0 110.15 179.982 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.13 -40.79 64.64 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.593 -0.692 . . . . 0.0 109.634 179.644 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.699 HG12 HD23 ' B' ' 193' ' ' LEU . 94.7 mt -68.29 -26.92 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.746 -0.596 . . . . 0.0 109.433 179.367 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.4 mt -67.09 -38.55 85.9 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.455 -0.778 . . . . 0.0 109.635 179.433 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -31.15 65.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.532 -0.73 . . . . 0.0 109.614 179.386 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.46 HD12 HD22 ' B' ' 193' ' ' LEU . 8.6 mt -71.69 -34.24 69.47 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.684 -0.635 . . . . 0.0 109.725 179.516 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -67.89 -30.83 70.27 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.587 -0.696 . . . . 0.0 109.746 179.652 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.31 -30.16 57.62 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.678 -0.639 . . . . 0.0 109.674 179.556 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -72.47 -29.15 63.39 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.712 -0.617 . . . . 0.0 109.884 179.667 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.1 tp -70.88 -35.56 72.41 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.515 -0.741 . . . . 0.0 109.838 179.817 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 87.9 mt -75.3 -32.73 61.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.696 -0.628 . . . . 0.0 109.664 179.606 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.83 -30.0 62.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.722 -0.611 . . . . 0.0 109.642 179.444 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.406 ' HA ' HD13 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -71.89 -39.7 69.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.677 -0.64 . . . . 0.0 109.694 179.65 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -71.82 -32.17 67.3 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.559 -0.713 . . . . 0.0 109.452 179.404 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -68.15 -29.77 68.74 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.79 -0.569 . . . . 0.0 109.544 179.348 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -62.84 -43.03 99.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.685 -0.635 . . . . 0.0 109.707 179.639 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -66.29 -32.27 73.57 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.554 -0.716 . . . . 0.0 109.484 179.48 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -63.74 -31.61 72.84 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.695 -0.628 . . . . 0.0 109.754 179.459 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -71.08 -35.11 71.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.642 -0.661 . . . . 0.0 109.619 179.566 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.716 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.2 OUTLIER -64.84 -30.18 71.17 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.568 -0.707 . . . . 0.0 109.637 179.559 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -61.93 -40.16 94.56 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.69 -0.631 . . . . 0.0 109.766 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.81 -30.71 71.68 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.704 -0.623 . . . . 0.0 109.738 179.64 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -84.14 -17.41 40.16 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.634 -0.666 . . . . 0.0 110.572 179.696 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.685 HD13 ' HE3' ' B' ' 176' ' ' MET . 53.1 tp . . . . . 0 N--CA 1.501 2.097 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.531 -179.939 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . 0.503 ' HA2' HD13 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.727 HD12 ' N ' ' B' ' 168' ' ' SER . 2.9 pp -139.54 -44.2 0.45 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.647 -0.913 . . . . 0.0 110.534 -179.917 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.727 ' N ' HD12 ' B' ' 167' ' ' LEU . 69.4 m -153.66 15.82 0.51 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.35 -0.843 . . . . 0.0 111.248 179.834 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 8.3 tptt 49.34 26.48 1.6 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.104 -0.998 . . . . 0.0 110.984 -179.789 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -151.65 -46.44 0.11 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.658 -0.651 . . . . 0.0 110.151 -179.926 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.611 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -73.58 -36.55 65.59 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.177 179.609 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.581 HD21 HD23 ' A' ' 86' ' ' LEU . 1.9 tt -74.22 -28.17 61.13 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.894 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.432 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.0 mm -66.89 -34.58 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.264 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -72.57 -29.07 63.21 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.611 179.257 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -70.63 -40.38 73.12 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.685 -0.634 . . . . 0.0 109.958 179.634 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.716 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -62.94 -30.77 71.82 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.655 -0.653 . . . . 0.0 109.749 179.87 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -75.45 -28.73 59.42 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.606 -0.684 . . . . 0.0 109.87 179.535 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -73.52 -31.31 63.62 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.563 -0.71 . . . . 0.0 110.139 179.893 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.557 HG21 ' CD1' ' A' ' 86' ' ' LEU . 57.6 t -72.26 -29.58 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.621 -0.674 . . . . 0.0 109.807 179.784 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . 0.45 ' HA ' HD12 ' B' ' 183' ' ' ILE . 4.0 t70 -72.55 -30.25 64.28 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.55 -0.719 . . . . 0.0 109.928 179.713 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 1.3 tpt85 -74.68 -28.99 61.06 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.757 -0.589 . . . . 0.0 109.913 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -73.96 -33.01 63.73 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.612 -0.68 . . . . 0.0 110.018 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.45 HD12 ' HA ' ' B' ' 180' ' ' ASP . 67.5 mt -71.17 -29.23 35.5 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 O-C-N 121.644 -0.66 . . . . 0.0 109.727 179.742 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -34.58 75.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.621 -0.674 . . . . 0.0 109.783 179.651 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.0 ttt -67.99 -46.28 71.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.68 -0.638 . . . . 0.0 109.815 179.674 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 61.3 t -68.54 -30.27 46.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.552 -0.717 . . . . 0.0 109.573 179.66 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -73.7 -29.44 62.28 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.669 -0.644 . . . . 0.0 109.916 179.659 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -72.04 -30.58 65.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.638 -0.664 . . . . 0.0 109.987 179.819 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -40.25 61.99 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.652 -0.655 . . . . 0.0 109.694 179.662 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.455 HG12 HD22 ' A' ' 72' ' ' LEU . 79.7 mt -70.5 -29.78 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.677 -0.639 . . . . 0.0 109.656 179.572 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -34.59 73.79 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.619 -0.675 . . . . 0.0 109.553 179.515 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 55.7 mmtt -75.86 -35.86 59.78 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.677 -0.64 . . . . 0.0 109.654 179.666 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.699 HD23 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -77.14 -19.72 56.52 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.694 -0.628 . . . . 0.0 110.257 179.466 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 22.3 mmtt -84.73 -28.43 26.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.279 -0.888 . . . . 0.0 109.455 179.316 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.4 mmtm -78.61 -36.25 44.42 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.733 -0.604 . . . . 0.0 109.734 179.48 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' B' ' 193' ' ' LEU . 0.0 OUTLIER -71.74 -28.06 63.41 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.494 179.41 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . 0.425 ' NE2' HD12 ' A' ' 69' ' ' ILE . 33.4 tt0 -68.64 -29.22 67.66 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.613 -0.679 . . . . 0.0 109.466 179.253 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -46.69 88.36 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.68 -0.638 . . . . 0.0 109.599 179.525 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -61.38 -35.89 78.75 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.738 -0.601 . . . . 0.0 109.881 179.669 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.675 HD23 HD12 ' A' ' 62' ' ' LEU . 6.8 tp -77.65 -31.86 52.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.574 -0.704 . . . . 0.0 109.601 179.412 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.703 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.3 mt-10 . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.717 -0.615 . . . . 0.0 109.681 179.447 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.8 tt . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 121.085 0.469 . . . . 0.0 110.026 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -67.58 -39.46 84.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.568 -0.708 . . . . 0.0 110.022 179.959 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -73.41 -30.82 63.5 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.675 -0.641 . . . . 0.0 109.753 179.624 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.2 m -74.44 -29.59 61.54 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.632 -0.667 . . . . 0.0 109.714 179.551 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -71.32 -28.12 63.87 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.655 -0.653 . . . . 0.0 110.047 179.711 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -70.21 -33.63 71.91 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.636 -0.665 . . . . 0.0 110.145 179.911 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -76.46 -34.36 58.7 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.651 -0.655 . . . . 0.0 109.857 179.669 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.739 HG12 HD22 ' B' ' 193' ' ' LEU . 74.5 mt -74.85 -27.87 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.667 -0.645 . . . . 0.0 109.683 179.498 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.467 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.3 tt -74.12 -29.72 61.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.587 -0.696 . . . . 0.0 109.982 179.666 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -74.74 -38.89 62.13 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.517 -0.739 . . . . 0.0 109.931 179.748 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.728 HD22 ' CD1' ' B' ' 193' ' ' LEU . 2.7 tp -70.9 -27.42 63.78 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.603 -0.686 . . . . 0.0 109.922 179.573 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -71.76 -33.25 68.49 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.541 -0.724 . . . . 0.0 109.553 179.371 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -74.31 -30.34 62.01 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.787 -0.571 . . . . 0.0 109.577 179.496 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.8 tttt -72.15 -37.7 69.33 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.586 -0.696 . . . . 0.0 109.824 179.685 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.579 HD13 ' HA ' ' B' ' 187' ' ' GLU . 24.1 tp -66.91 -31.16 71.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.56 -0.712 . . . . 0.0 109.967 179.703 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 tp -76.61 -34.14 58.39 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.683 -0.636 . . . . 0.0 109.849 179.75 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.65 -28.17 60.75 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 120.254 -0.578 . . . . 0.0 109.932 179.558 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.418 HD12 ' CG1' ' B' ' 183' ' ' ILE . 0.3 OUTLIER -76.07 -36.12 59.11 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.581 -0.699 . . . . 0.0 109.81 179.751 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -72.78 -29.06 62.98 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.576 -0.702 . . . . 0.0 109.886 179.618 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -72.36 -28.25 62.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.658 -0.651 . . . . 0.0 109.965 179.564 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.24 -41.21 70.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.673 -0.642 . . . . 0.0 110.033 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 tttm -65.19 -29.52 70.34 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.511 -0.743 . . . . 0.0 109.753 179.742 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -64.79 -33.4 75.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.599 -0.688 . . . . 0.0 109.83 179.662 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -69.27 -29.87 67.85 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.649 -0.657 . . . . 0.0 109.784 179.687 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.608 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.3 OUTLIER -67.15 -37.04 83.09 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.695 -0.628 . . . . 0.0 109.893 179.738 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -61.52 -33.49 73.91 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.585 -0.697 . . . . 0.0 109.97 179.921 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.3 mp -77.99 -29.37 49.6 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.602 -0.686 . . . . 0.0 109.804 179.686 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -88.7 -21.01 24.11 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.655 -0.653 . . . . 0.0 110.545 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.497 ' HA ' HD22 ' B' ' 172' ' ' LEU . 54.1 tp . . . . . 0 N--CA 1.5 2.049 0 CA-C-O 118.014 -0.994 . . . . 0.0 110.545 -179.931 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . 0.637 ' HA3' HD13 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.76 HD11 ' CB ' ' B' ' 171' ' ' GLU . 3.2 pp -143.08 -42.24 0.3 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.687 -0.89 . . . . 0.0 110.761 -179.527 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.734 ' N ' HD12 ' B' ' 167' ' ' LEU . 53.1 m -153.07 17.85 0.57 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.32 -0.863 . . . . 0.0 111.039 179.999 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . 0.461 ' C ' HD13 ' B' ' 173' ' ' ILE . 4.8 tptm 49.73 26.63 1.92 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.244 -0.91 . . . . 0.0 110.884 -179.729 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -151.79 -46.77 0.11 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.7 -0.625 . . . . 0.0 110.133 -179.996 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.76 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -74.48 -30.79 61.98 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.798 -0.761 . . . . 0.0 109.294 179.512 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.637 HD13 ' HA3' ' B' ' 166' ' ' GLY . 2.9 tt -78.31 -30.43 48.27 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.727 -0.608 . . . . 0.0 109.583 179.176 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.616 ' N ' HD12 ' B' ' 173' ' ' ILE . 1.9 mp -73.03 -33.97 44.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.409 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.23 -32.55 72.82 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.955 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.763 ' O ' HG23 ' B' ' 179' ' ' VAL . 84.7 m-20 -73.02 -38.57 66.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.715 -0.615 . . . . 0.0 109.427 179.222 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.608 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -64.79 -30.63 71.65 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.696 -0.628 . . . . 0.0 109.645 179.637 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -78.89 -30.95 45.2 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.655 -0.653 . . . . 0.0 109.831 179.738 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.37 -29.89 47.68 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.744 -0.597 . . . . 0.0 109.684 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.763 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.4 t -76.3 -29.73 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.72 -0.613 . . . . 0.0 109.58 179.57 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -73.43 -30.59 63.32 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.523 -0.735 . . . . 0.0 109.915 179.833 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.21 -29.3 60.27 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.674 -0.642 . . . . 0.0 109.942 179.714 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . 0.664 ' O ' HG23 ' B' ' 186' ' ' VAL . 6.5 tt0 -75.93 -36.7 59.27 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.634 -0.666 . . . . 0.0 109.914 179.831 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.418 ' CG1' HD12 ' A' ' 79' ' ' LEU . 72.8 mt -71.28 -29.92 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.705 -0.622 . . . . 0.0 109.511 179.663 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 86.0 m -72.21 -39.32 68.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.61 -0.681 . . . . 0.0 109.743 179.594 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 mtp -72.53 -37.7 68.26 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.635 -0.665 . . . . 0.0 109.495 179.525 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . 0.664 HG23 ' O ' ' B' ' 182' ' ' GLU . 66.5 t -72.56 -34.79 49.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 179.283 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . 0.579 ' HA ' HD13 ' A' ' 76' ' ' LEU . 21.3 tt0 -64.87 -33.27 75.61 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.748 -0.595 . . . . 0.0 109.526 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -67.39 -26.1 66.28 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.677 -0.639 . . . . 0.0 109.933 179.562 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -76.31 -25.34 54.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.52 -0.737 . . . . 0.0 110.361 179.871 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.606 HD13 HD23 ' A' ' 72' ' ' LEU . 25.6 mm -80.38 -35.95 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.484 -0.76 . . . . 0.0 109.398 -179.945 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 14.9 m -76.01 -29.38 58.12 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.755 -0.591 . . . . 0.0 109.839 179.595 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 7.3 mmmt -77.51 -31.58 53.56 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.624 -0.672 . . . . 0.0 109.786 179.708 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.739 HD22 HG12 ' A' ' 69' ' ' ILE . 0.4 OUTLIER -75.68 -29.71 59.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.546 -0.721 . . . . 0.0 109.49 179.491 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -34.52 71.07 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.63 -0.669 . . . . 0.0 109.762 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -71.78 -31.23 66.39 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.676 -0.64 . . . . 0.0 109.71 179.561 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -68.4 -31.51 70.91 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.674 -0.641 . . . . 0.0 109.576 179.509 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -66.7 -30.43 70.67 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.69 -0.631 . . . . 0.0 109.734 179.533 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -62.65 -40.79 98.13 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.651 -0.656 . . . . 0.0 109.794 179.706 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -62.25 -39.73 93.83 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.779 179.681 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 8.7 tp -73.59 -33.21 64.51 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.563 -0.71 . . . . 0.0 109.71 179.473 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.74 0 O-C-N 121.72 -0.612 . . . . 0.0 109.753 179.553 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.677 HD11 ' HG2' ' B' ' 201' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 121.128 0.489 . . . . 0.0 109.813 . . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.92 -32.65 74.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.594 -0.691 . . . . 0.0 109.934 179.81 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -75.48 -36.98 60.52 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.598 -0.689 . . . . 0.0 109.771 179.68 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.47 HG23 ' NZ ' ' B' ' 196' ' ' LYS . 32.3 m -72.91 -30.57 64.02 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.694 -0.628 . . . . 0.0 109.557 179.438 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.488 ' O ' HD23 ' A' ' 70' ' ' LEU . 0.6 OUTLIER -70.04 -28.2 65.28 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.689 -0.632 . . . . 0.0 109.803 179.514 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -66.65 -37.92 85.8 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.585 -0.697 . . . . 0.0 110.081 179.926 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.46 -40.33 67.07 Favored 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.64 179.605 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.835 HG12 HD23 ' B' ' 193' ' ' LEU . 49.1 mt -68.41 -26.84 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.793 -0.567 . . . . 0.0 109.502 179.457 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.488 HD23 ' O ' ' A' ' 66' ' ' LYS . 0.7 OUTLIER -68.67 -37.42 79.6 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.533 -0.729 . . . . 0.0 109.796 179.563 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -68.39 -31.6 71.07 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.588 -0.695 . . . . 0.0 109.846 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.573 HD22 HG12 ' B' ' 190' ' ' ILE . 8.9 mt -68.65 -29.37 67.84 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.655 -0.653 . . . . 0.0 110.039 179.84 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -70.88 -31.16 67.74 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.595 -0.691 . . . . 0.0 109.958 179.824 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -78.12 -31.35 49.89 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.554 -0.716 . . . . 0.0 109.712 179.572 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -74.72 -29.45 61.19 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.707 -0.621 . . . . 0.0 109.771 179.506 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.549 HD13 HD12 ' B' ' 190' ' ' ILE . 14.8 tp -72.29 -34.77 68.41 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.626 -0.671 . . . . 0.0 109.883 179.756 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.8 mt -75.18 -36.45 61.47 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.643 -0.66 . . . . 0.0 109.426 179.513 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.12 -28.45 67.33 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.082 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' B' ' 183' ' ' ILE . 6.1 tp -67.9 -48.16 66.79 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.72 -0.613 . . . . 0.0 110.054 179.698 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -63.06 -25.91 68.6 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.612 -0.68 . . . . 0.0 110.366 179.868 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.57 -29.96 63.99 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.426 -0.796 . . . . 0.0 110.148 179.88 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -76.76 -46.9 23.41 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.591 -0.693 . . . . 0.0 109.603 179.555 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.667 ' HG3' HD11 ' B' ' 183' ' ' ILE . 11.3 mmtt -65.67 -24.34 66.99 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.647 -0.821 . . . . 0.0 108.815 178.686 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -60.82 -26.57 67.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.428 -0.795 . . . . 0.0 109.266 178.403 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.3 tp60 -59.15 -38.92 80.84 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.512 -0.743 . . . . 0.0 109.733 179.191 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.561 HD21 ' HB3' ' B' ' 175' ' ' ASN . 0.2 OUTLIER -67.69 -34.33 76.69 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 179.137 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -61.84 -29.82 70.43 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.741 -0.599 . . . . 0.0 109.818 179.524 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.07 -28.08 65.14 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.657 -0.652 . . . . 0.0 109.993 179.673 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -95.02 -7.24 40.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.623 -0.673 . . . . 0.0 111.063 179.946 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.017 HD23 ' HE3' ' B' ' 176' ' ' MET . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.034 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.418 -179.969 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.541 HD11 ' CB ' ' B' ' 171' ' ' GLU . 1.3 pp -50.92 -47.14 61.01 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.848 -0.795 . . . . 0.0 111.594 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.518 ' N ' HD12 ' B' ' 167' ' ' LEU . 7.6 t -152.96 15.99 0.56 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.228 -0.92 . . . . 0.0 111.278 179.982 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 6.9 tptm 49.7 26.33 1.8 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.179 -0.951 . . . . 0.0 110.985 -179.893 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -151.71 -46.83 0.11 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.659 -0.65 . . . . 0.0 109.974 -179.944 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.541 ' CB ' HD11 ' B' ' 167' ' ' LEU . 1.9 mt-10 -75.08 -32.21 61.41 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 119.881 -0.728 . . . . 0.0 109.182 179.407 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.569 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.5 tt -78.45 -28.23 46.54 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 178.886 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.723 HD13 HD21 ' A' ' 90' ' ' LEU . 49.6 mm -71.69 -32.28 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.655 -0.653 . . . . 0.0 109.433 179.52 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 65.5 mm-40 -68.2 -32.79 73.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.655 -0.653 . . . . 0.0 109.671 179.541 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.676 ' O ' HG23 ' B' ' 179' ' ' VAL . 43.0 m-20 -63.52 -46.04 87.9 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.482 179.384 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 1.017 ' HE3' HD23 ' A' ' 90' ' ' LEU . 8.2 mtt -52.85 -31.86 41.56 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.665 -0.647 . . . . 0.0 110.73 179.765 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -68.8 -52.95 24.67 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.683 -0.635 . . . . 0.0 109.75 179.839 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -28.19 67.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.736 -0.603 . . . . 0.0 109.78 179.48 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.676 HG23 ' O ' ' B' ' 175' ' ' ASN . 94.3 t -77.88 -32.08 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.636 -0.665 . . . . 0.0 109.752 179.703 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -74.92 -31.38 61.52 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.562 -0.711 . . . . 0.0 109.64 179.553 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -25.27 64.18 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.724 -0.61 . . . . 0.0 109.86 179.345 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -68.62 -42.25 78.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.534 -0.729 . . . . 0.0 110.419 179.994 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.667 HD11 ' HG3' ' A' ' 83' ' ' LYS . 69.7 mt -66.94 -28.91 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.429 179.697 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 24.5 m -63.55 -32.05 73.39 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.608 -0.682 . . . . 0.0 109.623 179.43 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 1.2 ttt -68.52 -51.02 47.71 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.59 -0.694 . . . . 0.0 109.783 179.62 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.8 t -68.73 -31.61 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.546 -0.721 . . . . 0.0 109.425 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -75.3 -28.34 59.66 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.735 -0.603 . . . . 0.0 109.895 179.584 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -74.6 -27.87 60.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.605 -0.685 . . . . 0.0 110.085 179.76 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -74.23 -33.28 63.31 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.597 -0.689 . . . . 0.0 109.967 179.852 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.573 HG12 HD22 ' A' ' 72' ' ' LEU . 72.1 mt -73.26 -31.08 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.647 -0.658 . . . . 0.0 109.495 179.769 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.23 -31.81 71.57 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.716 -0.615 . . . . 0.0 109.48 179.377 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 23.7 mmtt -77.25 -34.1 55.87 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.678 -0.639 . . . . 0.0 109.511 179.381 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.835 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -72.72 -31.49 65.01 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.294 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.9 tptp -66.5 -40.83 89.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.623 -0.673 . . . . 0.0 109.372 179.323 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.92 -30.41 70.55 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.224 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . 0.47 ' NZ ' HG23 ' A' ' 65' ' ' THR . 24.8 ttpt -63.35 -36.93 85.34 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.319 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -63.24 -30.64 71.75 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.692 -0.63 . . . . 0.0 109.519 179.464 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -61.32 -38.52 87.18 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.725 -0.609 . . . . 0.0 109.785 179.684 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.85 -39.83 93.21 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.719 -0.613 . . . . 0.0 109.862 179.772 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.8 tp -72.76 -30.7 64.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.658 -0.651 . . . . 0.0 109.831 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . 0.677 ' HG2' HD11 ' A' ' 62' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.495 1.79 0 O-C-N 121.61 -0.682 . . . . 0.0 109.782 179.639 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.906 HD12 HD23 ' B' ' 200' ' ' LEU . 7.4 tp . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 121.063 0.459 . . . . 0.0 110.066 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -66.27 -29.49 69.73 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.575 -0.703 . . . . 0.0 110.162 179.997 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -72.72 -44.61 61.48 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.589 -0.694 . . . . 0.0 109.886 179.786 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.499 HG22 HD11 ' A' ' 69' ' ' ILE . 51.6 m -65.27 -30.27 71.12 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.646 -0.659 . . . . 0.0 109.648 179.51 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -66.4 -28.22 68.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.704 -0.623 . . . . 0.0 109.945 179.608 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.15 -44.01 89.98 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.614 -0.679 . . . . 0.0 110.101 179.938 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -39.05 72.7 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.651 -0.656 . . . . 0.0 109.642 179.739 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.546 HG12 HD22 ' B' ' 193' ' ' LEU . 81.5 mt -71.03 -25.89 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.719 -0.613 . . . . 0.0 109.634 179.42 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.454 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.2 tt -72.32 -34.42 68.06 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.534 -0.728 . . . . 0.0 110.001 179.755 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp -67.3 -36.63 81.9 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.491 -0.755 . . . . 0.0 109.91 179.806 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.667 HD22 ' CG1' ' B' ' 190' ' ' ILE . 7.3 mt -64.74 -28.29 69.49 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.669 -0.645 . . . . 0.0 109.944 179.748 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -66.08 -38.3 87.95 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.593 -0.692 . . . . 0.0 110.13 179.962 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.96 -31.08 61.39 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.611 -0.681 . . . . 0.0 109.743 179.654 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -77.9 -30.41 50.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.618 -0.676 . . . . 0.0 109.635 179.691 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -78.78 -30.87 45.82 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.62 -0.675 . . . . 0.0 109.725 179.604 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.5 mt -77.28 -30.54 54.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.642 -0.661 . . . . 0.0 109.753 179.584 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.01 -28.4 60.51 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.667 -0.646 . . . . 0.0 110.032 179.638 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.584 HD12 HG12 ' B' ' 183' ' ' ILE . 0.5 OUTLIER -76.65 -36.06 57.61 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.596 -0.69 . . . . 0.0 109.875 179.796 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -74.72 -27.38 60.35 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.616 -0.677 . . . . 0.0 109.993 179.731 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -76.53 -27.7 56.05 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.565 -0.709 . . . . 0.0 109.782 179.597 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.71 -41.95 59.24 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.663 -0.648 . . . . 0.0 109.886 179.63 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.41 ' HB3' HG11 ' B' ' 179' ' ' VAL . 11.4 ptmt -65.65 -26.31 67.74 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.758 -0.777 . . . . 0.0 109.672 179.362 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -63.8 -29.42 70.63 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.572 -0.705 . . . . 0.0 109.621 179.258 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -63.97 -35.43 80.67 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.6 -0.687 . . . . 0.0 109.877 179.717 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.55 HD22 ' HG2' ' B' ' 176' ' ' MET . 0.5 OUTLIER -66.01 -33.11 75.05 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.6 -0.688 . . . . 0.0 109.605 179.723 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.44 ' HA ' ' HE2' ' B' ' 176' ' ' MET . 6.7 m-85 -62.77 -29.27 70.57 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.609 -0.682 . . . . 0.0 110.049 179.782 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.35 -29.09 59.83 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.589 -0.695 . . . . 0.0 110.14 179.834 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -87.57 -26.66 23.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.653 -0.654 . . . . 0.0 110.371 179.894 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.494 HD22 ' HE3' ' B' ' 176' ' ' MET . 45.4 tp . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.21 -179.978 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' B' B ' 167' ' ' LEU . . . . . 0.718 HD12 ' N ' ' B' ' 168' ' ' SER . 3.0 pp -141.46 -42.94 0.36 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.567 -0.961 . . . . 0.0 110.724 -179.735 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 168' ' ' SER . . . . . 0.718 ' N ' HD12 ' B' ' 167' ' ' LEU . 48.1 t -153.34 16.97 0.54 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.317 -0.864 . . . . 0.0 111.234 179.934 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . 0.469 ' C ' HD13 ' B' ' 173' ' ' ILE . 34.3 tptt 50.03 26.26 1.99 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.099 -1.001 . . . . 0.0 111.084 -179.954 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -154.3 -45.52 0.09 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.6 -0.687 . . . . 0.0 110.409 179.982 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.673 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -74.48 -30.75 61.97 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.899 -0.72 . . . . 0.0 109.434 179.691 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' B' B ' 172' ' ' LEU . . . . . 0.495 HD21 HD23 ' A' ' 86' ' ' LEU . 3.3 tt -79.29 -29.56 42.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.733 -0.605 . . . . 0.0 109.601 179.18 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 173' ' ' ILE . . . . . 0.643 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.5 mp -77.56 -34.55 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.405 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -65.27 -33.61 76.39 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.832 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 175' ' ' ASN . . . . . 0.749 ' O ' HG23 ' B' ' 179' ' ' VAL . 81.4 m-20 -75.58 -36.21 60.4 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.976 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 176' ' ' MET . . . . . 0.55 ' HG2' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -68.05 -30.71 69.99 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.678 -0.638 . . . . 0.0 109.804 179.437 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -75.34 -34.51 61.2 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.644 -0.66 . . . . 0.0 109.677 179.655 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -30.05 67.99 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.689 -0.632 . . . . 0.0 109.63 179.488 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 179' ' ' VAL . . . . . 0.749 HG23 ' O ' ' B' ' 175' ' ' ASN . 82.4 t -66.28 -32.14 56.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.695 -0.628 . . . . 0.0 109.699 179.711 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.56 -43.18 90.63 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.7 -0.625 . . . . 0.0 109.93 179.882 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -34.07 75.59 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.733 -0.605 . . . . 0.0 109.97 179.8 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -71.16 -45.91 62.51 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.521 -0.737 . . . . 0.0 109.855 179.842 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 183' ' ' ILE . . . . . 0.584 HG12 HD12 ' A' ' 79' ' ' LEU . 78.0 mt -69.73 -29.45 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.649 -0.657 . . . . 0.0 109.38 179.513 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 87.7 m -70.22 -32.49 70.4 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.633 -0.667 . . . . 0.0 109.43 179.343 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.4 ttm -70.22 -48.33 57.49 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.623 -0.673 . . . . 0.0 109.754 179.511 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.8 t -69.84 -31.32 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.551 -0.718 . . . . 0.0 109.376 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -73.99 -29.79 62.14 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.705 -0.622 . . . . 0.0 109.757 179.522 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.24 -30.7 67.83 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.625 -0.672 . . . . 0.0 109.827 179.54 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -37.65 67.64 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.673 -0.642 . . . . 0.0 109.621 179.652 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 190' ' ' ILE . . . . . 0.667 ' CG1' HD22 ' A' ' 72' ' ' LEU . 82.1 mt -69.26 -31.43 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.623 -0.673 . . . . 0.0 109.495 179.542 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.13 -41.59 85.88 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.659 -0.651 . . . . 0.0 109.617 179.55 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -70.69 -35.87 72.99 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.635 -0.665 . . . . 0.0 109.583 179.528 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 193' ' ' LEU . . . . . 0.546 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -70.71 -31.32 68.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.673 -0.642 . . . . 0.0 109.501 179.399 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.4 tptp -69.14 -41.13 77.72 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.637 -0.664 . . . . 0.0 109.699 179.482 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -62.79 -31.69 72.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.665 -0.647 . . . . 0.0 109.508 179.518 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -37.16 86.17 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.696 -0.628 . . . . 0.0 109.382 179.256 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -62.72 -29.6 70.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.734 -0.604 . . . . 0.0 109.642 179.496 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.76 -43.61 98.52 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.632 -0.667 . . . . 0.0 109.741 179.695 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -63.09 -44.71 94.96 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.712 -0.618 . . . . 0.0 109.853 179.796 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . 0.906 HD23 HD12 ' A' ' 62' ' ' LEU . 18.4 tp -71.6 -31.28 66.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.589 -0.694 . . . . 0.0 109.809 179.59 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 . . . . . 0 N--CA 1.493 1.696 0 O-C-N 121.622 -0.674 . . . . 0.0 109.834 179.595 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.1 0.476 . . . . 0.0 110.18 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.4 mttm -112.57 -172.76 2.11 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.57 -0.706 . . . . 0.0 110.196 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 52.7 34.74 16.7 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.402 -0.811 . . . . 0.0 110.77 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 15.3 ttm -109.87 -26.51 9.75 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.601 -0.687 . . . . 0.0 110.453 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -60.13 -31.72 70.33 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.502 -0.748 . . . . 0.0 110.235 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -73.81 -29.79 62.35 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.648 -0.658 . . . . 0.0 109.84 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -71.61 -27.86 63.4 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.689 -0.632 . . . . 0.0 110.011 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 mmt -70.38 -33.58 71.58 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.552 -0.717 . . . . 0.0 110.165 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.6 m -72.88 -30.72 64.18 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.602 -0.686 . . . . 0.0 109.905 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.722 HD11 ' HG2' ' B' ' 201' ' ' GLU . 6.3 tt -70.75 -28.67 64.87 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.679 -0.638 . . . . 0.0 109.882 179.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -67.47 -29.93 69.5 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.544 -0.722 . . . . 0.0 109.955 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -74.94 -35.59 62.15 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.651 -0.656 . . . . 0.0 109.943 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 88.3 m -71.29 -30.81 66.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.763 -0.586 . . . . 0.0 109.682 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -68.74 -28.71 67.06 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.618 -0.676 . . . . 0.0 109.899 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -66.86 -32.36 73.58 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.585 -0.697 . . . . 0.0 110.022 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -78.18 -31.34 49.53 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.644 -0.66 . . . . 0.0 109.695 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.672 HG12 HD22 ' B' ' 193' ' ' LEU . 85.4 mt -77.28 -29.67 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.663 -0.648 . . . . 0.0 109.539 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.97 -33.35 63.82 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.639 -0.663 . . . . 0.0 109.651 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.9 tptt -66.31 -30.7 71.16 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.655 -0.653 . . . . 0.0 109.563 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.65 HD11 HD13 ' B' ' 193' ' ' LEU . 10.4 mt -62.38 -31.24 71.87 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.669 -0.644 . . . . 0.0 109.856 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -63.01 -36.59 84.06 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.57 -0.707 . . . . 0.0 109.787 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -76.36 -31.52 58.11 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.694 -0.629 . . . . 0.0 109.576 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -77.07 -30.49 55.52 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.702 -0.624 . . . . 0.0 109.671 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 41.5 tp -77.91 -32.8 51.94 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.614 -0.679 . . . . 0.0 109.633 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.3 mt -75.18 -31.63 61.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.706 -0.621 . . . . 0.0 109.565 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.66 -30.41 67.01 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.645 -0.66 . . . . 0.0 109.731 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.484 HD12 HG12 ' B' ' 183' ' ' ILE . 0.6 OUTLIER -68.16 -41.81 80.98 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.72 -0.613 . . . . 0.0 109.641 179.649 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -68.15 -31.14 70.49 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.609 -0.682 . . . . 0.0 109.674 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.91 -30.53 69.88 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.657 -0.652 . . . . 0.0 109.62 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.07 -45.84 83.62 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.672 -0.642 . . . . 0.0 109.749 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.3 tttm -64.34 -32.2 73.71 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.568 -0.707 . . . . 0.0 109.45 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.78 -30.13 71.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.722 -0.611 . . . . 0.0 109.844 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.7 tm0? -65.99 -33.58 76.13 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.601 -0.687 . . . . 0.0 109.736 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.8 mt -65.76 -32.32 73.79 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.631 -0.668 . . . . 0.0 109.661 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -61.28 -35.83 78.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.654 -0.654 . . . . 0.0 109.83 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' A' ' 88' ' ' LEU . 1.1 mm? -61.73 -29.94 70.45 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.74 -0.6 . . . . 0.0 109.832 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -101.71 -19.6 15.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.676 -0.64 . . . . 0.0 110.553 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.789 HD11 ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.047 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.552 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.755 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.1 OUTLIER -144.88 -67.47 0.32 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.61 -0.935 . . . . 0.0 110.751 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 11.0 t -145.39 16.68 1.5 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.145 -0.972 . . . . 0.0 110.919 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.3 tptt 50.68 25.76 2.21 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.171 -0.955 . . . . 0.0 110.684 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -148.93 -46.77 0.14 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.655 -0.653 . . . . 0.0 109.472 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.574 ' HB2' HD12 ' B' ' 167' ' ' LEU . 2.1 mm-40 -68.9 -33.17 73.32 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 119.95 -0.7 . . . . 0.0 109.262 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.755 ' N ' HD11 ' B' ' 167' ' ' LEU . 1.5 tt -77.87 -27.75 49.81 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.789 ' CD1' HD11 ' A' ' 90' ' ' LEU . 49.1 mm -71.14 -31.08 43.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.632 -0.667 . . . . 0.0 109.399 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -70.35 -29.49 66.18 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.689 -0.632 . . . . 0.0 109.984 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.564 ' O ' HG23 ' B' ' 179' ' ' VAL . 82.0 m-20 -69.29 -29.08 66.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.605 -0.684 . . . . 0.0 110.081 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.787 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -71.46 -29.34 64.73 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.527 -0.733 . . . . 0.0 110.045 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -75.6 -29.96 59.44 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.603 -0.686 . . . . 0.0 110.168 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.4 ttp180 -76.11 -32.21 59.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.619 -0.675 . . . . 0.0 109.95 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.564 HG23 ' O ' ' B' ' 175' ' ' ASN . 72.1 t -74.08 -29.86 26.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.684 -0.635 . . . . 0.0 109.652 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -71.76 -28.59 63.75 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.667 -0.645 . . . . 0.0 110.022 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 19.4 mtp180 -74.15 -28.39 61.29 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.568 -0.708 . . . . 0.0 110.077 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -73.82 -29.12 61.97 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.588 -0.695 . . . . 0.0 110.128 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.484 HG12 HD12 ' A' ' 79' ' ' LEU . 85.0 mt -72.53 -27.81 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.587 -0.696 . . . . 0.0 109.894 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.2 m -71.2 -31.01 67.09 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.56 -0.712 . . . . 0.0 109.937 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.3 ttp -71.7 -44.08 64.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.637 -0.664 . . . . 0.0 109.934 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.0 t -71.28 -31.24 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.615 -0.678 . . . . 0.0 109.554 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -75.21 -29.11 60.21 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.717 -0.614 . . . . 0.0 109.779 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . 0.4 ' O ' ' OG ' ' B' ' 191' ' ' SER . 11.5 tp-100 -73.27 -28.5 62.16 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.654 -0.654 . . . . 0.0 110.068 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -32.49 64.13 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.572 -0.705 . . . . 0.0 109.962 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.638 HG12 HD22 ' A' ' 72' ' ' LEU . 77.0 mt -73.41 -31.67 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.677 -0.64 . . . . 0.0 109.776 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . 0.4 ' OG ' ' O ' ' B' ' 188' ' ' GLN . 19.0 p -69.9 -35.61 74.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.649 -0.657 . . . . 0.0 109.636 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -76.91 -32.28 57.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.659 -0.651 . . . . 0.0 109.431 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.672 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -73.89 -30.8 62.81 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.685 -0.634 . . . . 0.0 109.374 179.277 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -67.76 -40.32 84.09 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.647 -0.658 . . . . 0.0 109.514 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -68.48 -33.11 73.58 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.634 -0.666 . . . . 0.0 109.344 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 1.5 ttpp -63.91 -34.54 78.2 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -29.87 71.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.753 -0.592 . . . . 0.0 109.469 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -47.65 85.36 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.652 -0.655 . . . . 0.0 109.74 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -62.41 -41.49 98.73 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.198 -0.601 . . . . 0.0 109.925 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.58 -36.31 68.15 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.619 -0.676 . . . . 0.0 109.733 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.722 ' HG2' HD11 ' A' ' 62' ' ' LEU . 55.9 mt-10 -76.58 -29.64 56.68 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.642 -0.661 . . . . 0.0 109.826 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -79.88 -29.4 39.93 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.665 -0.647 . . . . 0.0 109.768 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -79.74 -28.59 40.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.625 -0.672 . . . . 0.0 109.843 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -79.42 -25.07 42.11 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.562 -0.711 . . . . 0.0 110.242 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.87 -26.16 27.53 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.435 -0.791 . . . . 0.0 110.21 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.13 148.64 77.7 Favored Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.543 -0.723 . . . . 0.0 110.233 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.318 -1.074 0 O-C-N 123.367 1.193 . . . . 0.0 110.445 -179.979 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.007 0.432 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -121.45 168.71 11.38 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.568 -0.708 . . . . 0.0 110.29 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -93.27 -29.32 15.74 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.53 -0.731 . . . . 0.0 110.172 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.2 mtt -76.22 -28.0 57.03 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.643 -0.661 . . . . 0.0 110.266 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -60.74 -27.22 67.78 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.621 -0.675 . . . . 0.0 110.352 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -71.14 -32.47 69.0 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.52 -0.738 . . . . 0.0 110.129 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 35.0 ttm105 -75.44 -30.29 59.96 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.655 -0.653 . . . . 0.0 109.905 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 32.6 mtt -74.15 -30.01 62.07 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.636 -0.665 . . . . 0.0 109.806 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.2 m -70.14 -28.66 65.53 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.653 -0.654 . . . . 0.0 109.903 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.4 HD11 ' OE2' ' B' ' 201' ' ' GLU . 4.8 tp -68.11 -29.52 68.46 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.652 -0.655 . . . . 0.0 109.987 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -76.64 -32.69 58.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.605 -0.684 . . . . 0.0 110.089 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -76.83 -30.7 56.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.598 -0.689 . . . . 0.0 109.771 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.3 m -74.53 -29.98 61.59 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.727 -0.608 . . . . 0.0 109.704 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -70.41 -27.04 63.98 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.611 -0.681 . . . . 0.0 109.997 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -69.37 -33.22 72.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.581 -0.7 . . . . 0.0 110.189 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -76.11 -36.05 59.05 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.581 -0.699 . . . . 0.0 109.711 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.42 HD12 ' OE1' ' B' ' 197' ' ' GLN . 82.5 mt -71.79 -27.19 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.737 -0.602 . . . . 0.0 109.533 179.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.4 -37.37 77.46 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.599 -0.688 . . . . 0.0 109.717 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -71.06 -30.38 66.51 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.594 -0.691 . . . . 0.0 109.781 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.937 HD13 HD13 ' B' ' 193' ' ' LEU . 0.4 OUTLIER -72.32 -27.08 62.2 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.639 -0.663 . . . . 0.0 110.067 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -74.16 -32.82 63.27 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.493 -0.754 . . . . 0.0 109.622 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.91 -31.69 63.22 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.733 -0.604 . . . . 0.0 109.392 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -67.82 -30.8 70.29 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.734 -0.604 . . . . 0.0 109.666 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.1 tp -74.38 -30.02 61.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.633 -0.667 . . . . 0.0 109.851 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.89 -33.41 62.05 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.625 -0.672 . . . . 0.0 109.739 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.4 -29.43 66.06 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.709 -0.619 . . . . 0.0 109.858 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.476 HD12 HG12 ' B' ' 183' ' ' ILE . 0.3 OUTLIER -71.78 -42.41 67.17 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.715 -0.616 . . . . 0.0 109.761 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -66.88 -30.52 70.71 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.567 -0.708 . . . . 0.0 109.696 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -67.17 -29.42 69.1 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.706 -0.621 . . . . 0.0 109.803 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -47.64 71.05 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.598 -0.688 . . . . 0.0 109.614 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -62.78 -28.92 70.32 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.558 -0.714 . . . . 0.0 109.67 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -65.14 -29.54 70.39 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.654 -0.654 . . . . 0.0 109.996 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -65.36 -41.46 93.8 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.612 -0.68 . . . . 0.0 109.693 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.513 HD23 HD21 ' B' ' 172' ' ' LEU . 3.5 mt -61.77 -29.22 69.99 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.609 -0.682 . . . . 0.0 109.868 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.22 -35.72 79.78 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.594 -0.691 . . . . 0.0 109.636 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.4 mt -77.46 -29.59 52.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.739 -0.601 . . . . 0.0 109.789 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.574 ' HG2' HD11 ' B' ' 172' ' ' LEU . 10.8 tt0 -90.04 -14.52 33.7 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.671 -0.643 . . . . 0.0 110.807 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.461 HD11 HD11 ' B' ' 173' ' ' ILE . 52.0 tp . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.515 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.929 HD21 HD12 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -145.75 -75.52 0.21 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.621 -0.929 . . . . 0.0 110.492 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 3.9 t -138.0 19.51 2.82 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.124 -0.985 . . . . 0.0 110.924 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.459 ' C ' HD13 ' B' ' 173' ' ' ILE . 18.5 tptm 50.82 25.91 2.36 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.134 -0.979 . . . . 0.0 110.67 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -150.73 -45.84 0.12 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.715 -0.615 . . . . 0.0 109.661 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.629 ' HB2' HD12 ' B' ' 167' ' ' LEU . 1.4 mp0 -68.23 -30.26 69.28 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.671 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.929 HD12 HD21 ' B' ' 167' ' ' LEU . 2.0 tt -81.51 -30.46 33.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.648 -0.657 . . . . 0.0 109.483 179.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.617 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.1 mp -74.13 -30.88 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -63.97 -32.73 74.37 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.488 ' O ' HG23 ' B' ' 179' ' ' VAL . 80.6 m-20 -76.18 -31.3 58.44 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.447 ' HE2' ' C ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -69.11 -29.01 67.0 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.664 -0.647 . . . . 0.0 109.83 179.547 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -75.04 -29.65 60.84 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.568 -0.708 . . . . 0.0 110.243 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -75.25 -29.73 60.28 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.59 -0.694 . . . . 0.0 110.043 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.488 HG23 ' O ' ' B' ' 175' ' ' ASN . 60.7 t -76.19 -28.63 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.629 -0.669 . . . . 0.0 109.837 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . 0.404 ' HA ' HD12 ' B' ' 183' ' ' ILE . 37.5 t70 -75.77 -28.63 58.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.631 -0.668 . . . . 0.0 110.07 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -28.49 59.89 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.588 -0.695 . . . . 0.0 110.117 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.7 -30.66 61.62 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.618 -0.676 . . . . 0.0 110.138 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.476 HG12 HD12 ' A' ' 79' ' ' LEU . 75.7 mt -73.42 -30.11 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.633 -0.667 . . . . 0.0 109.749 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.9 -32.45 69.41 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.669 -0.645 . . . . 0.0 109.713 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 5.5 mtp -71.99 -46.09 58.58 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.617 -0.677 . . . . 0.0 109.693 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -66.97 -31.31 52.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 119.989 -0.685 . . . . 0.0 109.286 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -66.24 -33.99 77.0 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.756 -0.59 . . . . 0.0 110.027 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 65.8 mm-40 -66.58 -27.53 67.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.582 -0.699 . . . . 0.0 110.0 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -23.32 57.7 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.586 -0.696 . . . . 0.0 110.408 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.624 HD13 HD22 ' A' ' 72' ' ' LEU . 33.8 mm -79.79 -36.8 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.369 -0.832 . . . . 0.0 109.55 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -30.53 63.95 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.735 -0.603 . . . . 0.0 109.736 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -75.33 -38.75 60.05 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.649 -0.657 . . . . 0.0 109.783 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.937 HD13 HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -72.0 -30.23 65.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.578 -0.701 . . . . 0.0 109.348 179.351 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -67.03 -37.69 84.56 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.351 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 24.4 tptt -66.43 -30.96 71.44 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.63 -0.669 . . . . 0.0 109.361 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -62.96 -37.57 87.61 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.702 -0.624 . . . . 0.0 109.464 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . 0.42 ' OE1' HD12 ' A' ' 69' ' ' ILE . 9.5 tp60 -62.49 -30.65 71.42 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.78 -0.575 . . . . 0.0 109.609 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -61.3 -41.31 96.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.705 -0.622 . . . . 0.0 110.016 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -63.28 -39.93 95.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.735 -0.603 . . . . 0.0 109.891 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.3 tp -72.83 -30.76 64.28 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.639 -0.663 . . . . 0.0 109.833 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.4 ' OE2' HD11 ' A' ' 62' ' ' LEU . 7.7 mm-40 -77.08 -30.65 55.54 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.586 -0.696 . . . . 0.0 109.879 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -77.59 -29.45 51.99 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.656 -0.652 . . . . 0.0 109.885 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -78.02 -28.93 49.24 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.605 -0.685 . . . . 0.0 110.008 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.58 -25.44 45.28 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.607 -0.683 . . . . 0.0 110.201 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.19 -23.56 30.5 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.501 -0.749 . . . . 0.0 110.438 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 1.6 mttp -57.85 153.77 30.95 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 121.364 -0.835 . . . . 0.0 110.415 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo . . . . . 0 C--N 1.317 -1.103 0 O-C-N 123.464 1.244 . . . . 0.0 110.386 179.947 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.3 mtmm . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.146 0.498 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.2 ttmt -87.29 -162.57 0.81 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.524 -0.735 . . . . 0.0 110.113 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 52.56 24.71 3.21 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.38 -0.825 . . . . 0.0 110.867 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.9 mtt -133.54 22.1 3.98 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.563 -0.711 . . . . 0.0 110.388 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -85.0 -29.16 25.24 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.396 -0.815 . . . . 0.0 110.069 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -66.63 -32.25 73.46 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.684 -0.635 . . . . 0.0 109.931 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 -73.72 -36.4 65.21 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.595 -0.691 . . . . 0.0 109.846 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.4 mtt -69.55 -30.5 68.32 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.715 -0.616 . . . . 0.0 109.6 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.6 m -65.88 -30.31 70.89 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.718 -0.614 . . . . 0.0 109.723 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.751 HD12 HD23 ' B' ' 200' ' ' LEU . 30.1 tp -62.4 -29.45 70.5 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.667 -0.645 . . . . 0.0 110.015 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.24 -29.56 64.04 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.602 -0.686 . . . . 0.0 110.049 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -75.4 -33.27 60.96 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.592 -0.693 . . . . 0.0 109.892 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.7 m -71.18 -30.49 66.49 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.649 -0.657 . . . . 0.0 109.713 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -68.2 -29.14 67.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.607 -0.683 . . . . 0.0 109.978 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -66.58 -32.55 73.96 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.541 -0.725 . . . . 0.0 110.05 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -76.7 -32.82 58.12 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.643 -0.66 . . . . 0.0 109.853 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.69 HG12 HD22 ' B' ' 193' ' ' LEU . 83.9 mt -75.66 -28.96 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.719 -0.613 . . . . 0.0 109.597 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.7 tp -74.4 -33.6 63.06 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.662 -0.649 . . . . 0.0 109.845 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.63 -35.76 70.53 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.639 -0.663 . . . . 0.0 109.808 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.895 HD23 HD13 ' B' ' 190' ' ' ILE . 2.0 tp -68.67 -27.87 66.36 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.608 -0.683 . . . . 0.0 109.849 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -67.4 -35.51 79.45 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.544 -0.722 . . . . 0.0 109.493 179.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.19 -31.44 60.95 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -71.06 -30.79 67.04 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.753 -0.592 . . . . 0.0 109.712 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' B' ' 187' ' ' GLU . 13.1 tp -72.08 -31.31 65.96 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.592 -0.693 . . . . 0.0 109.689 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.09 -32.8 56.9 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.655 -0.653 . . . . 0.0 109.677 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.41 -31.24 63.74 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 120.121 -0.631 . . . . 0.0 109.376 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.709 HD23 ' HA ' ' B' ' 183' ' ' ILE . 3.3 tp -65.06 -33.85 77.03 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.663 -0.648 . . . . 0.0 109.425 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.406 ' NE2' HG21 ' B' ' 183' ' ' ILE . 0.0 OUTLIER -72.27 -31.32 65.66 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.697 -0.627 . . . . 0.0 109.49 179.266 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -67.98 -30.09 69.28 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.691 -0.63 . . . . 0.0 109.735 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -66.27 -44.96 82.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.646 -0.659 . . . . 0.0 109.914 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -66.91 -30.15 70.23 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.597 -0.69 . . . . 0.0 109.863 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -70.32 -29.27 65.94 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.713 -0.617 . . . . 0.0 109.894 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -67.4 -32.21 72.95 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.629 -0.67 . . . . 0.0 109.866 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.71 -30.55 69.22 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.593 -0.692 . . . . 0.0 109.969 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -68.54 -27.89 66.5 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.597 -0.689 . . . . 0.0 110.187 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.5 -28.66 64.07 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.524 -0.735 . . . . 0.0 110.025 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -117.82 25.6 10.26 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.627 -0.67 . . . . 0.0 110.532 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.1 HD23 ' HE3' ' B' ' 176' ' ' MET . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.061 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.928 HD21 HD13 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -139.78 -82.75 0.26 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.554 -0.968 . . . . 0.0 110.536 -179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 88.6 p -130.49 20.81 5.17 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.246 -0.909 . . . . 0.0 110.94 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.1 tptt 50.92 25.62 2.29 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.234 -0.916 . . . . 0.0 110.729 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -150.64 -46.09 0.12 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.724 -0.61 . . . . 0.0 109.643 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.626 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.4 OUTLIER -66.38 -29.88 70.14 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.982 -0.687 . . . . 0.0 109.447 179.418 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.928 HD13 HD21 ' B' ' 167' ' ' LEU . 14.8 tp -81.49 -33.2 32.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.704 -0.622 . . . . 0.0 109.386 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.62 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.1 mp -74.76 -31.37 26.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -64.06 -32.14 73.59 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.82 ' O ' HG23 ' B' ' 179' ' ' VAL . 78.4 m-20 -75.38 -32.72 60.89 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 1.1 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -66.45 -33.13 75.02 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.172 -0.611 . . . . 0.0 109.555 179.47 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -76.33 -31.59 58.21 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.639 -0.663 . . . . 0.0 109.751 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -74.31 -29.58 61.68 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.701 -0.624 . . . . 0.0 109.864 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.82 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.8 t -73.43 -29.57 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.658 -0.651 . . . . 0.0 109.763 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -75.37 -32.83 60.96 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.568 -0.707 . . . . 0.0 110.04 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -73.02 -29.43 63.0 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.71 -0.619 . . . . 0.0 109.864 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -73.42 -39.66 64.86 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.616 -0.677 . . . . 0.0 109.925 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.709 ' HA ' HD23 ' A' ' 79' ' ' LEU . 96.3 mt -66.81 -28.49 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.67 -0.644 . . . . 0.0 109.723 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 79.0 m -67.95 -37.07 81.14 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.609 -0.682 . . . . 0.0 109.672 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 19.9 tpp -70.73 -44.4 66.91 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.64 -0.662 . . . . 0.0 109.485 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 68.3 t -66.85 -35.79 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . 0.417 ' HA ' HD13 ' A' ' 76' ' ' LEU . 12.2 tt0 -63.7 -34.23 77.4 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.726 -0.609 . . . . 0.0 109.815 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.88 -24.88 62.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.681 -0.637 . . . . 0.0 110.033 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -24.83 57.33 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.547 -0.72 . . . . 0.0 110.458 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.895 HD13 HD23 ' A' ' 72' ' ' LEU . 32.8 mm -79.16 -34.86 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.354 -0.842 . . . . 0.0 109.601 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.1 m -75.55 -30.8 59.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.729 -0.607 . . . . 0.0 109.684 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 39.0 mmtt -74.68 -32.59 62.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.689 -0.632 . . . . 0.0 109.678 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.69 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -71.61 -35.83 70.6 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.566 -0.709 . . . . 0.0 109.424 179.459 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.2 -40.8 94.68 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.64 -0.663 . . . . 0.0 109.407 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -70.83 -32.05 68.96 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.687 -0.633 . . . . 0.0 109.378 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.451 ' HE2' HD23 ' B' ' 193' ' ' LEU . 16.8 ttpt -67.64 -31.88 72.19 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -65.46 -30.67 71.48 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.726 -0.608 . . . . 0.0 109.676 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -62.2 -43.47 98.76 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.713 -0.617 . . . . 0.0 109.829 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -61.54 -40.73 95.74 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.777 -0.577 . . . . 0.0 109.842 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.751 HD23 HD12 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -73.93 -32.53 63.55 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.533 -0.729 . . . . 0.0 109.558 179.502 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.499 ' HG2' HD21 ' A' ' 62' ' ' LEU . 4.8 mt-10 -77.61 -30.72 52.49 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.791 -0.568 . . . . 0.0 109.747 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -76.58 -29.02 56.43 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.801 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -75.48 -29.78 59.69 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.652 -0.655 . . . . 0.0 109.862 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -72.36 -29.36 63.72 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.592 -0.692 . . . . 0.0 109.982 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -118.22 27.91 8.69 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.583 -0.698 . . . . 0.0 110.204 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.26 142.11 96.56 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.5 -0.75 . . . . 0.0 110.074 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.317 -1.114 0 O-C-N 123.304 1.16 . . . . 0.0 110.392 -179.964 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.4 tptt . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.137 0.494 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.7 mttm -121.21 179.99 4.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.544 -0.722 . . . . 0.0 110.191 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 52.78 26.19 4.35 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.431 -0.793 . . . . 0.0 110.838 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.31 -34.66 8.7 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.451 -0.781 . . . . 0.0 110.182 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -73.58 -28.79 62.02 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.615 -0.678 . . . . 0.0 110.007 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -75.44 -28.48 59.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.632 -0.667 . . . . 0.0 110.04 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -75.11 -30.64 60.93 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.552 -0.718 . . . . 0.0 109.963 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 24.5 mtp -72.34 -30.44 64.75 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.652 -0.655 . . . . 0.0 109.879 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 21.5 m -68.04 -28.99 67.87 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.655 -0.653 . . . . 0.0 109.901 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' B' ' 201' ' ' GLU . 0.9 OUTLIER -65.19 -31.47 72.67 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.566 -0.709 . . . . 0.0 110.021 179.809 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -75.22 -37.46 61.09 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.61 -0.681 . . . . 0.0 109.91 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -74.01 -30.55 62.51 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.733 -0.604 . . . . 0.0 109.672 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.506 HG21 ' NZ ' ' B' ' 196' ' ' LYS . 79.0 m -72.71 -29.94 63.79 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.677 -0.639 . . . . 0.0 109.71 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -68.94 -27.74 66.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.647 -0.658 . . . . 0.0 110.051 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -68.24 -33.21 73.96 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.45 -0.781 . . . . 0.0 110.14 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -75.65 -33.86 60.47 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.678 -0.639 . . . . 0.0 109.722 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.7 mt -71.82 -28.25 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.768 -0.583 . . . . 0.0 109.617 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.23 -38.27 78.43 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.558 -0.714 . . . . 0.0 109.796 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.3 tptp -68.74 -29.89 68.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.584 -0.697 . . . . 0.0 109.766 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.805 HD22 HG12 ' B' ' 190' ' ' ILE . 8.4 mt -68.58 -32.17 71.88 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.69 -0.631 . . . . 0.0 110.023 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -68.29 -33.46 74.39 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.64 -0.663 . . . . 0.0 109.829 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -75.34 -30.07 60.14 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.655 -0.653 . . . . 0.0 109.814 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -74.61 -30.12 61.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.698 -0.626 . . . . 0.0 109.905 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.407 HD13 HD12 ' B' ' 190' ' ' ILE . 28.8 tp -74.94 -34.01 62.04 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.661 -0.649 . . . . 0.0 109.901 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 22.0 mt -74.97 -32.31 61.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.674 -0.641 . . . . 0.0 109.743 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.68 -29.75 62.48 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.71 -0.618 . . . . 0.0 109.767 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.45 -41.13 56.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.712 -0.617 . . . . 0.0 109.614 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -71.05 -29.19 65.02 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.65 -0.656 . . . . 0.0 109.743 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -71.11 -29.65 65.53 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.593 -0.692 . . . . 0.0 109.716 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -68.03 -42.23 80.94 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.678 -0.639 . . . . 0.0 109.867 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -66.91 -28.96 68.73 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.546 -0.721 . . . . 0.0 109.864 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -68.76 -30.94 69.65 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.644 -0.66 . . . . 0.0 109.95 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -65.04 -38.07 89.65 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.606 -0.684 . . . . 0.0 109.784 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.426 ' C ' ' HE2' ' B' ' 176' ' ' MET . 2.0 mt -61.25 -33.84 74.18 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.707 -0.621 . . . . 0.0 109.98 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -63.35 -46.06 88.33 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.511 -0.743 . . . . 0.0 109.905 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 42.4 mt -69.31 -28.63 66.43 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.734 -0.604 . . . . 0.0 109.862 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -100.52 7.95 43.79 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.673 -0.642 . . . . 0.0 110.997 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.786 HD12 HD22 ' B' ' 172' ' ' LEU . 53.0 tp . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.304 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.938 HD21 HD12 ' B' ' 172' ' ' LEU . 0.1 OUTLIER -141.86 -84.08 0.19 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.51 -0.994 . . . . 0.0 110.454 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 66.7 m -127.84 19.35 6.62 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.064 -1.022 . . . . 0.0 110.819 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 16.7 tptt 50.71 25.92 2.29 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.237 -0.915 . . . . 0.0 110.652 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -148.96 -46.74 0.14 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.643 -0.661 . . . . 0.0 109.453 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.586 ' HB2' HD12 ' B' ' 167' ' ' LEU . 1.1 mt-10 -66.3 -34.75 78.7 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.248 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.938 HD12 HD21 ' B' ' 167' ' ' LEU . 5.5 tt -77.63 -29.35 51.75 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.492 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.5 mm -68.56 -31.07 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.702 -0.624 . . . . 0.0 109.358 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -76.29 -30.31 57.73 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.672 -0.643 . . . . 0.0 109.835 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.784 ' O ' HG23 ' B' ' 179' ' ' VAL . 76.2 m-20 -75.05 -30.1 60.92 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.718 -0.614 . . . . 0.0 109.847 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.452 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -72.05 -31.19 65.91 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.636 -0.665 . . . . 0.0 109.848 179.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.72 -29.97 56.44 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.956 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -76.81 -30.1 56.26 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.608 -0.683 . . . . 0.0 109.829 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.784 HG23 ' O ' ' B' ' 175' ' ' ASN . 71.1 t -74.48 -29.69 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.616 -0.677 . . . . 0.0 109.687 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -71.63 -28.8 64.02 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.583 -0.698 . . . . 0.0 109.99 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 22.1 mtp180 -74.88 -29.49 61.03 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.591 -0.693 . . . . 0.0 110.031 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . 0.501 ' O ' HG23 ' B' ' 186' ' ' VAL . 3.0 tp10 -74.64 -34.44 62.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.725 -0.609 . . . . 0.0 110.039 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 78.3 mt -71.18 -28.77 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.715 -0.616 . . . . 0.0 109.768 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.6 m -72.17 -33.59 67.82 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.59 -0.694 . . . . 0.0 109.803 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 11.2 ttt -75.46 -36.86 60.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.62 -0.675 . . . . 0.0 109.733 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . 0.501 HG23 ' O ' ' B' ' 182' ' ' GLU . 58.5 t -74.88 -30.58 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.7 -0.625 . . . . 0.0 109.528 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -75.48 -28.77 59.34 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.716 -0.615 . . . . 0.0 109.915 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -74.44 -28.98 61.29 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.648 -0.657 . . . . 0.0 109.992 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.27 -36.71 63.84 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.637 -0.665 . . . . 0.0 109.952 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.805 HG12 HD22 ' A' ' 72' ' ' LEU . 82.0 mt -72.1 -31.55 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.621 -0.674 . . . . 0.0 109.607 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 3.7 m -71.36 -35.85 71.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.698 -0.626 . . . . 0.0 109.571 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 14.7 mmtt -75.52 -32.47 60.49 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.517 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.691 HD13 HD11 ' A' ' 72' ' ' LEU . 0.3 OUTLIER -77.0 -17.65 58.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.695 -0.628 . . . . 0.0 110.426 179.49 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 7.3 tptt -85.53 -27.0 25.87 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.349 -0.844 . . . . 0.0 109.545 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -76.45 -32.84 58.66 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.624 -0.673 . . . . 0.0 110.006 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.506 ' NZ ' HG21 ' A' ' 65' ' ' THR . 0.0 OUTLIER -70.56 -25.07 62.92 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.495 -0.753 . . . . 0.0 109.896 179.533 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -70.39 -30.07 66.88 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.509 -0.744 . . . . 0.0 109.591 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.61 -46.69 87.1 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.596 -0.69 . . . . 0.0 109.513 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -61.74 -36.94 82.44 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.738 -0.601 . . . . 0.0 109.899 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 19.6 tp -75.47 -35.32 60.89 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.603 -0.686 . . . . 0.0 109.658 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.585 ' HA ' HD11 ' A' ' 62' ' ' LEU . 13.5 mt-10 -77.86 -30.66 51.02 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.66 -0.65 . . . . 0.0 109.641 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.46 -28.56 46.57 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.61 -0.681 . . . . 0.0 109.738 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -77.06 -27.8 54.47 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.612 -0.68 . . . . 0.0 110.015 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.23 -24.64 51.19 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.549 -0.719 . . . . 0.0 110.33 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.35 -25.83 28.88 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.472 -0.768 . . . . 0.0 110.3 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 13.1 mttt -59.72 167.23 2.7 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.511 -0.743 . . . . 0.0 110.315 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo . . . . . 0 C--N 1.317 -1.12 0 O-C-N 123.35 1.184 . . . . 0.0 110.402 -179.963 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.7 mttm . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.038 0.447 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -117.13 -177.85 3.31 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.59 -0.694 . . . . 0.0 110.237 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 52.72 26.98 4.84 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.4 -0.813 . . . . 0.0 110.706 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.23 -45.82 0.34 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.583 -0.698 . . . . 0.0 110.118 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -64.58 -29.19 70.2 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.694 -0.628 . . . . 0.0 110.032 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -71.13 -28.74 64.51 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.634 -0.666 . . . . 0.0 110.03 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -29.53 67.11 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.601 -0.687 . . . . 0.0 110.078 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 6.3 mmm -74.12 -30.35 62.28 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.601 -0.687 . . . . 0.0 110.013 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 t -71.77 -29.77 64.84 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.672 -0.642 . . . . 0.0 109.898 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.717 ' HG ' HD23 ' B' ' 200' ' ' LEU . 2.0 mp -69.11 -28.98 66.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.623 -0.673 . . . . 0.0 109.97 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -67.23 -30.63 70.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.543 -0.723 . . . . 0.0 110.007 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -75.03 -39.23 61.18 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.608 -0.682 . . . . 0.0 109.87 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 47.3 m -72.21 -30.75 65.23 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.655 -0.653 . . . . 0.0 109.638 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -71.72 -27.47 63.02 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.647 -0.658 . . . . 0.0 109.967 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -69.64 -34.84 74.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.626 -0.671 . . . . 0.0 110.175 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 -75.67 -35.27 60.42 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.612 -0.68 . . . . 0.0 109.652 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.3 mt -72.34 -27.52 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.781 -0.574 . . . . 0.0 109.554 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.405 HD23 ' C ' ' A' ' 70' ' ' LEU . 9.6 tt -71.13 -38.88 72.27 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.635 -0.666 . . . . 0.0 109.915 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -35.02 79.51 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.596 -0.69 . . . . 0.0 109.676 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.614 ' CD1' HD13 ' B' ' 193' ' ' LEU . 5.5 mt -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.719 -0.613 . . . . 0.0 109.825 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.9 -36.13 83.38 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.607 -0.683 . . . . 0.0 109.977 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -76.1 -30.98 58.48 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.634 -0.666 . . . . 0.0 109.724 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tttm -77.19 -31.71 55.55 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.715 -0.616 . . . . 0.0 109.774 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 36.4 tp -77.74 -30.65 51.73 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.624 -0.672 . . . . 0.0 109.681 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.79 -30.94 56.66 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.678 -0.639 . . . . 0.0 109.639 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.32 -29.99 61.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.593 -0.692 . . . . 0.0 109.956 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.405 HD12 HG12 ' B' ' 183' ' ' ILE . 0.4 OUTLIER -76.34 -38.2 56.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.639 -0.663 . . . . 0.0 109.631 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -71.69 -29.07 64.17 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.589 -0.694 . . . . 0.0 109.748 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -71.4 -29.47 64.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.581 -0.7 . . . . 0.0 109.866 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -70.8 -43.57 68.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.619 -0.676 . . . . 0.0 109.852 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -62.96 -29.31 70.71 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.587 -0.696 . . . . 0.0 109.748 179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -63.44 -31.14 72.21 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.622 -0.674 . . . . 0.0 109.848 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -62.8 -32.82 74.08 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.672 -0.643 . . . . 0.0 109.852 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.487 HD13 ' HG2' ' B' ' 176' ' ' MET . 0.4 OUTLIER -68.39 -35.93 78.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.647 -0.658 . . . . 0.0 109.81 179.692 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -64.18 -29.24 70.36 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.682 -0.636 . . . . 0.0 110.052 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 tp -65.85 -30.12 70.68 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.58 -0.7 . . . . 0.0 110.004 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.58 27.38 9.23 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.601 -0.687 . . . . 0.0 110.289 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.772 HD11 ' CD1' ' B' ' 173' ' ' ILE . 51.2 tp . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 118.045 -0.978 . . . . 0.0 110.168 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.882 HD21 HD13 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -140.84 -84.07 0.21 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.578 -0.954 . . . . 0.0 110.561 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -128.64 19.66 6.16 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.143 -0.973 . . . . 0.0 110.9 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 7.6 tptm 50.76 26.09 2.4 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.21 -0.931 . . . . 0.0 110.604 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -149.33 -45.87 0.14 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.627 -0.67 . . . . 0.0 109.694 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.599 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.1 OUTLIER -66.45 -35.85 81.33 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.804 -0.759 . . . . 0.0 109.292 179.498 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.882 HD13 HD21 ' B' ' 167' ' ' LEU . 10.2 tp -76.9 -28.79 55.45 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 178.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.772 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.7 mm -66.59 -31.38 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.616 -0.677 . . . . 0.0 109.196 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -74.98 -31.08 61.35 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.124 -0.63 . . . . 0.0 109.775 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.596 ' O ' HG23 ' B' ' 179' ' ' VAL . 83.7 m-20 -75.03 -34.72 61.91 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.681 -0.637 . . . . 0.0 109.77 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.574 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -70.01 -30.67 68.03 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.743 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -67.15 -35.26 79.33 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.666 -0.647 . . . . 0.0 109.727 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.51 -30.73 59.92 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.72 -0.612 . . . . 0.0 109.686 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.596 HG23 ' O ' ' B' ' 175' ' ' ASN . 69.3 t -76.67 -30.96 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.702 -0.624 . . . . 0.0 109.569 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -75.24 -29.72 60.31 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.728 -0.608 . . . . 0.0 109.907 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -73.47 -30.16 62.99 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.691 -0.631 . . . . 0.0 109.851 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -72.53 -36.91 68.41 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.652 -0.655 . . . . 0.0 109.965 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.405 HG12 HD12 ' A' ' 79' ' ' LEU . 82.0 mt -70.02 -30.52 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.705 -0.622 . . . . 0.0 109.652 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.8 m -68.58 -35.04 76.82 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.673 -0.642 . . . . 0.0 109.652 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -46.63 74.79 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.582 -0.699 . . . . 0.0 109.659 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 60.5 t -70.57 -33.03 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.634 -0.666 . . . . 0.0 109.307 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -72.86 -29.95 63.6 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.775 -0.578 . . . . 0.0 109.675 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 37.5 mm-40 -68.89 -30.27 68.73 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.636 -0.665 . . . . 0.0 109.781 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.55 -36.83 63.11 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.594 -0.691 . . . . 0.0 109.841 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.609 ' CG1' HD22 ' A' ' 72' ' ' LEU . 79.4 mt -69.54 -30.58 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.627 -0.671 . . . . 0.0 109.523 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 20.4 m -66.67 -40.29 88.53 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.701 -0.624 . . . . 0.0 109.612 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -72.32 -31.53 65.75 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 120.087 -0.645 . . . . 0.0 109.495 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.614 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.4 OUTLIER -72.39 -35.41 68.41 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.756 -0.59 . . . . 0.0 109.418 179.364 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -68.5 -43.09 77.6 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.693 -0.63 . . . . 0.0 109.497 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -67.3 -32.0 72.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.667 -0.646 . . . . 0.0 109.327 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -34.89 79.25 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -63.01 -30.37 71.55 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.795 -0.566 . . . . 0.0 109.637 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.42 -46.24 90.93 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.705 -0.622 . . . . 0.0 109.743 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -62.09 -46.2 90.11 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.714 -0.617 . . . . 0.0 109.843 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.717 HD23 ' HG ' ' A' ' 62' ' ' LEU . 4.9 tp -69.48 -34.34 74.19 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.623 -0.673 . . . . 0.0 109.822 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -76.72 -30.34 56.6 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.649 -0.657 . . . . 0.0 109.811 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -77.08 -29.78 55.15 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.595 -0.691 . . . . 0.0 109.799 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.36 -27.83 56.57 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.664 -0.648 . . . . 0.0 110.036 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.31 -27.81 47.3 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.576 -0.703 . . . . 0.0 110.206 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -88.36 -28.69 20.81 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.552 -0.717 . . . . 0.0 110.166 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 153.07 78.05 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.565 -0.71 . . . . 0.0 110.13 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo . . . . . 0 C--N 1.318 -1.078 0 O-C-N 123.417 1.22 . . . . 0.0 110.371 179.978 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.7 mtpp . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.037 0.446 . . . . 0.0 110.186 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.3 tttt -146.95 178.58 8.24 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.601 -0.687 . . . . 0.0 110.189 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -99.51 -29.36 12.77 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.533 -0.729 . . . . 0.0 110.11 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -89.9 -24.31 21.38 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.592 -0.692 . . . . 0.0 110.43 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.74 -26.67 62.16 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.366 -0.834 . . . . 0.0 110.509 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -61.27 -41.47 96.98 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.481 -0.762 . . . . 0.0 110.096 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -70.17 -29.88 66.88 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.619 -0.676 . . . . 0.0 109.855 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.6 mmm -72.23 -30.22 64.69 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.638 -0.664 . . . . 0.0 109.737 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.4 t -67.65 -28.07 67.39 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.654 -0.654 . . . . 0.0 109.938 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.665 HD11 ' HG2' ' B' ' 201' ' ' GLU . 6.1 tp -66.73 -29.16 69.07 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.539 -0.725 . . . . 0.0 110.131 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -76.29 -31.71 58.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.579 -0.701 . . . . 0.0 110.082 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -76.78 -30.8 56.63 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.596 -0.69 . . . . 0.0 109.798 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.459 HG22 HD11 ' A' ' 69' ' ' ILE . 5.9 m -75.16 -30.04 60.62 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.686 -0.634 . . . . 0.0 109.755 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.1 mmtt -72.33 -27.21 62.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.624 -0.672 . . . . 0.0 110.137 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -72.86 -35.32 67.18 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.562 -0.711 . . . . 0.0 110.206 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.1 tp60 -76.07 -35.09 59.56 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.502 -0.748 . . . . 0.0 109.706 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.806 HG12 HD23 ' B' ' 193' ' ' LEU . 67.6 mt -75.39 -28.62 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.771 -0.58 . . . . 0.0 109.503 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.469 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.3 tt -75.19 -36.93 61.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.625 -0.672 . . . . 0.0 109.601 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -66.31 -29.45 69.65 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.469 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.629 HD22 HG12 ' B' ' 190' ' ' ILE . 6.6 mt -62.04 -33.03 73.62 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.695 -0.628 . . . . 0.0 109.899 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -61.6 -36.04 79.56 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.523 -0.736 . . . . 0.0 109.888 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -77.31 -31.46 54.66 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.71 -0.618 . . . . 0.0 109.353 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.596 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -74.3 -30.67 62.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.705 -0.622 . . . . 0.0 109.621 179.517 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -74.01 -34.89 64.32 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.667 -0.646 . . . . 0.0 109.647 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tp -71.83 -36.71 70.3 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.693 -0.629 . . . . 0.0 109.61 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.69 -30.38 71.06 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.745 -0.597 . . . . 0.0 109.481 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' B' ' 183' ' ' ILE . 2.8 mp -61.6 -41.88 98.08 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.707 -0.621 . . . . 0.0 109.828 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -67.58 -30.26 69.84 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.614 -0.679 . . . . 0.0 109.753 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -30.18 69.42 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.688 -0.632 . . . . 0.0 109.765 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.33 -49.29 57.09 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.657 -0.652 . . . . 0.0 109.782 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.9 ttpt -66.96 -31.27 71.73 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.578 -0.701 . . . . 0.0 109.494 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -70.12 -30.24 67.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.753 -0.592 . . . . 0.0 109.775 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -67.43 -29.72 69.28 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.571 -0.706 . . . . 0.0 109.886 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.59 HD23 HD21 ' B' ' 172' ' ' LEU . 0.7 OUTLIER -66.47 -39.55 88.85 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.579 -0.701 . . . . 0.0 109.922 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -61.14 -29.26 69.67 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.546 -0.721 . . . . 0.0 110.14 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.9 tp -70.32 -27.65 64.54 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.628 -0.67 . . . . 0.0 110.199 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -119.84 26.99 8.96 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.528 -0.733 . . . . 0.0 110.412 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.71 HD13 ' CE ' ' B' ' 176' ' ' MET . 29.2 tp . . . . . 0 N--CA 1.496 1.861 0 CA-C-O 117.933 -1.032 . . . . 0.0 109.989 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.779 HD21 HD12 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -142.43 -77.59 0.25 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.553 -0.969 . . . . 0.0 110.536 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 18.1 t -136.48 18.62 3.12 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.105 -0.997 . . . . 0.0 110.876 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 40.6 tptt 50.67 25.95 2.28 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.238 -0.914 . . . . 0.0 110.562 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -148.23 -46.66 0.16 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.692 -0.63 . . . . 0.0 109.386 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.598 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.4 OUTLIER -68.18 -32.56 72.88 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.21 179.331 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.779 HD12 HD21 ' B' ' 167' ' ' LEU . 3.9 tt -78.96 -29.28 43.88 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.531 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.8 mm -68.61 -30.55 47.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.721 -0.612 . . . . 0.0 109.4 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -72.67 -30.55 64.36 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.6 -0.688 . . . . 0.0 109.803 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.793 ' O ' HG23 ' B' ' 179' ' ' VAL . 96.9 m-20 -74.67 -31.7 62.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.619 -0.676 . . . . 0.0 109.701 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.71 ' CE ' HD13 ' A' ' 90' ' ' LEU . 1.6 mtt -70.16 -30.83 68.08 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.763 -0.586 . . . . 0.0 109.869 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -76.95 -30.94 56.25 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.635 -0.666 . . . . 0.0 109.886 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -29.84 57.37 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.661 -0.649 . . . . 0.0 109.735 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.793 HG23 ' O ' ' B' ' 175' ' ' ASN . 73.9 t -74.39 -28.45 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.6 -0.688 . . . . 0.0 109.81 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -74.65 -36.72 62.86 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.613 -0.68 . . . . 0.0 110.047 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 15.3 mtt85 -70.09 -26.32 63.93 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.639 -0.663 . . . . 0.0 109.977 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -72.87 -36.1 67.31 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.515 -0.741 . . . . 0.0 110.142 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.752 ' HA ' HD23 ' A' ' 79' ' ' LEU . 87.3 mt -67.89 -27.94 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.57 -0.707 . . . . 0.0 109.874 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 7.8 m -67.97 -34.61 76.89 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.559 -0.713 . . . . 0.0 109.787 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 mtm -73.78 -37.71 64.9 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.6 -0.688 . . . . 0.0 109.742 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . 0.678 HG21 HD21 ' A' ' 79' ' ' LEU . 57.7 t -73.29 -30.42 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.642 -0.661 . . . . 0.0 109.616 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.56 -29.22 61.27 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.6 -0.688 . . . . 0.0 109.991 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -30.85 63.37 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.651 -0.655 . . . . 0.0 109.939 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -32.57 69.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.625 -0.672 . . . . 0.0 109.942 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.629 HG12 HD22 ' A' ' 72' ' ' LEU . 78.1 mt -75.3 -30.71 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.546 -0.721 . . . . 0.0 109.739 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 27.6 m -75.53 -35.86 60.62 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.632 -0.667 . . . . 0.0 109.654 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 28.5 mtmt -73.48 -34.19 65.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.662 -0.649 . . . . 0.0 109.538 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.806 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -69.28 -35.6 76.21 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -64.15 -47.32 80.37 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -67.43 -31.93 72.45 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -64.83 -34.18 77.77 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -63.41 -30.85 71.91 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 120.223 -0.591 . . . . 0.0 109.48 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -60.98 -45.89 92.96 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.655 -0.653 . . . . 0.0 109.885 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -61.82 -39.51 92.04 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.745 -0.597 . . . . 0.0 109.739 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 13.7 tp -74.89 -30.52 61.33 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.65 -0.656 . . . . 0.0 109.582 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.665 ' HG2' HD11 ' A' ' 62' ' ' LEU . 24.5 mt-10 -78.44 -31.33 48.0 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.644 -0.66 . . . . 0.0 109.761 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -77.92 -28.87 49.83 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.719 -0.613 . . . . 0.0 109.786 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -79.43 -29.73 42.0 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.637 -0.664 . . . . 0.0 109.949 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -81.04 -27.69 35.67 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.632 -0.668 . . . . 0.0 110.025 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -92.95 -26.51 17.54 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.53 -0.732 . . . . 0.0 110.325 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 52.78 76.83 0.49 Allowed Pre-proline 0 N--CA 1.501 2.111 0 O-C-N 121.406 -0.809 . . . . 0.0 110.764 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.317 -1.095 0 O-C-N 123.339 1.178 . . . . 0.0 110.403 -179.984 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.033 0.445 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -147.1 -165.66 2.3 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.585 -0.697 . . . . 0.0 110.221 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 52.43 24.86 3.18 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.407 -0.808 . . . . 0.0 110.852 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.2 mmt -132.54 21.73 4.31 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.522 -0.737 . . . . 0.0 110.337 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -83.11 -29.86 28.38 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.406 -0.809 . . . . 0.0 110.014 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -71.53 -30.23 65.67 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.591 -0.693 . . . . 0.0 109.954 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -30.3 69.58 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.597 -0.69 . . . . 0.0 109.82 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.2 mmt -63.77 -33.52 75.85 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.639 -0.663 . . . . 0.0 109.952 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.9 t -66.66 -28.81 68.76 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.637 -0.664 . . . . 0.0 109.972 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.499 HD11 ' CG ' ' B' ' 201' ' ' GLU . 10.3 tt -66.23 -29.51 69.77 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.601 -0.687 . . . . 0.0 110.082 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -64.58 -31.41 72.61 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.626 -0.671 . . . . 0.0 110.067 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -72.25 -33.15 67.29 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.595 -0.69 . . . . 0.0 109.924 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.8 m -70.56 -38.51 74.15 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.689 -0.632 . . . . 0.0 109.76 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -63.99 -27.04 68.86 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.625 -0.672 . . . . 0.0 109.943 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -66.82 -39.58 87.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.532 -0.73 . . . . 0.0 110.204 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.0 tp60 -76.07 -31.48 58.8 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.608 -0.682 . . . . 0.0 109.624 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.816 HG12 HD23 ' B' ' 193' ' ' LEU . 90.8 mt -77.42 -28.12 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.743 -0.598 . . . . 0.0 109.533 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 24.5 tp -75.14 -38.12 61.14 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.585 -0.697 . . . . 0.0 109.536 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -65.54 -30.95 71.76 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.623 -0.673 . . . . 0.0 109.565 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.613 HD22 HG12 ' B' ' 190' ' ' ILE . 6.7 mt -62.64 -35.72 80.54 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.655 -0.653 . . . . 0.0 110.06 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.403 ' O ' HD13 ' A' ' 77' ' ' LEU . 3.1 tt0 -61.99 -35.69 79.24 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.598 -0.689 . . . . 0.0 110.033 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -76.16 -30.66 58.18 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.612 -0.68 . . . . 0.0 109.731 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.6 tttt -75.81 -28.95 58.51 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.658 -0.651 . . . . 0.0 109.888 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.7 tp -76.83 -32.37 57.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.676 -0.64 . . . . 0.0 109.984 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 73' ' ' GLU . 0.9 OUTLIER -76.64 -31.56 57.45 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.652 -0.655 . . . . 0.0 109.792 179.7 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.24 -27.71 59.6 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.699 -0.626 . . . . 0.0 110.068 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.761 HD23 ' HA ' ' B' ' 183' ' ' ILE . 7.1 tp -76.55 -31.66 57.72 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.543 -0.723 . . . . 0.0 110.086 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -75.07 -30.48 60.99 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.642 -0.661 . . . . 0.0 109.784 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -71.91 -28.13 63.29 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.689 -0.632 . . . . 0.0 109.81 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -68.76 -37.5 79.4 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.565 -0.709 . . . . 0.0 110.012 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -70.32 -29.65 66.42 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.474 -0.766 . . . . 0.0 109.923 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -69.67 -29.83 67.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.591 -0.693 . . . . 0.0 109.75 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.0 tm0? -64.85 -34.19 77.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.647 -0.658 . . . . 0.0 109.959 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.44 HD23 HD21 ' B' ' 172' ' ' LEU . 0.5 OUTLIER -64.24 -38.62 91.7 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.586 -0.696 . . . . 0.0 109.858 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.405 ' N ' ' HE2' ' B' ' 176' ' ' MET . 9.6 m-85 -60.76 -28.59 68.84 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.628 -0.67 . . . . 0.0 110.141 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 66.7 mt -72.85 -28.72 62.7 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.572 -0.705 . . . . 0.0 110.138 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -116.99 25.82 10.23 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.628 -0.67 . . . . 0.0 110.433 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.106 HD23 ' HE3' ' B' ' 176' ' ' MET . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.805 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.903 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.741 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.0 OUTLIER -149.66 -80.03 0.13 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.476 -1.014 . . . . 0.0 110.524 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 3.1 t -134.18 19.2 3.72 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.234 -0.916 . . . . 0.0 110.919 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 25.4 tptt 50.63 25.92 2.24 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.175 -0.953 . . . . 0.0 110.598 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -148.2 -46.66 0.16 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.722 -0.611 . . . . 0.0 109.354 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.626 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.8 mm-40 -67.77 -32.16 72.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.593 -0.692 . . . . 0.0 109.32 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.782 HD22 HD22 ' A' ' 90' ' ' LEU . 1.3 tt -78.95 -28.17 43.66 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.762 ' CD1' HD11 ' A' ' 90' ' ' LEU . 49.6 mm -70.6 -31.41 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.652 -0.655 . . . . 0.0 109.418 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 52.9 tp60 -71.07 -28.22 64.2 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.666 -0.646 . . . . 0.0 109.939 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.722 ' O ' HG23 ' B' ' 179' ' ' VAL . 70.7 m-20 -70.34 -28.62 65.28 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.622 -0.674 . . . . 0.0 110.151 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 1.106 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -75.27 -31.84 60.87 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.49 -0.757 . . . . 0.0 110.049 179.845 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -73.18 -30.02 63.25 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.614 -0.679 . . . . 0.0 109.967 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -77.69 -30.52 51.94 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.645 -0.659 . . . . 0.0 109.865 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.722 HG23 ' O ' ' B' ' 175' ' ' ASN . 65.7 t -76.8 -30.31 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.698 -0.626 . . . . 0.0 109.738 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -76.98 -29.64 55.61 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.7 -0.625 . . . . 0.0 109.989 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.5 -28.32 59.13 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.655 -0.653 . . . . 0.0 109.971 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -74.96 -33.85 61.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.613 -0.68 . . . . 0.0 110.052 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.761 ' HA ' HD23 ' A' ' 79' ' ' LEU . 89.1 mt -71.47 -28.23 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.589 -0.694 . . . . 0.0 109.817 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.7 m -71.51 -34.73 70.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.57 -0.706 . . . . 0.0 109.918 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -39.21 62.87 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.597 -0.689 . . . . 0.0 109.775 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 60.2 t -74.34 -29.89 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.569 -0.707 . . . . 0.0 109.564 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -76.34 -28.48 56.89 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.623 -0.673 . . . . 0.0 109.958 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -75.13 -28.06 60.04 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.539 -0.725 . . . . 0.0 110.11 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.89 -29.22 61.95 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.585 -0.697 . . . . 0.0 110.022 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.613 HG12 HD22 ' A' ' 72' ' ' LEU . 81.0 mt -76.04 -34.28 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.632 -0.667 . . . . 0.0 109.71 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 86.9 p -70.57 -30.95 67.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.74 -0.6 . . . . 0.0 109.501 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 25.2 mmtt -77.36 -33.86 55.2 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.638 -0.664 . . . . 0.0 109.591 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.816 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -72.5 -31.52 65.42 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.594 -0.691 . . . . 0.0 109.27 179.283 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -66.96 -41.27 87.18 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.614 -0.679 . . . . 0.0 109.476 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -71.32 -31.77 67.81 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.676 -0.64 . . . . 0.0 109.284 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 9.7 ttpt -67.88 -32.39 72.85 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -64.77 -30.07 71.06 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.706 -0.621 . . . . 0.0 109.485 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.77 -46.07 91.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.652 -0.655 . . . . 0.0 109.81 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -61.92 -37.72 85.71 Favored 'General case' 0 N--CA 1.496 1.842 0 C-N-CA 120.228 -0.589 . . . . 0.0 109.807 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.6 tp -73.59 -33.61 64.69 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.583 -0.698 . . . . 0.0 109.673 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.499 ' CG ' HD11 ' A' ' 62' ' ' LEU . 8.4 mt-10 -76.94 -33.87 57.67 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.684 -0.635 . . . . 0.0 109.707 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.27 -29.99 48.31 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.703 -0.623 . . . . 0.0 109.594 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -77.6 -27.49 51.27 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.626 -0.671 . . . . 0.0 109.796 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.14 -23.61 51.69 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.547 -0.721 . . . . 0.0 110.338 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -82.15 -24.78 34.86 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.425 -0.797 . . . . 0.0 110.189 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt -58.64 165.37 3.16 Favored Pre-proline 0 N--CA 1.496 1.859 0 O-C-N 121.479 -0.763 . . . . 0.0 110.372 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 C--N 1.317 -1.125 0 O-C-N 123.427 1.225 . . . . 0.0 110.376 179.994 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.4 ttmt . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.125 0.488 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -153.95 -168.06 2.85 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.506 -0.746 . . . . 0.0 110.198 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -82.7 -27.72 31.02 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.625 -0.672 . . . . 0.0 110.356 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.1 mtt -73.31 -30.2 63.22 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.563 -0.71 . . . . 0.0 110.158 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.6 -29.3 62.3 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.667 -0.645 . . . . 0.0 110.039 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -72.1 -27.53 62.71 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.627 -0.671 . . . . 0.0 110.114 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.7 mtt85 -71.21 -29.27 64.95 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.49 -0.756 . . . . 0.0 110.115 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 49.8 mtt -70.93 -41.04 71.7 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.631 -0.668 . . . . 0.0 109.847 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.2 p -62.46 -28.33 69.74 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.74 -0.6 . . . . 0.0 109.747 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.654 ' HG ' HD23 ' B' ' 200' ' ' LEU . 0.5 OUTLIER -64.34 -30.38 71.43 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.613 -0.679 . . . . 0.0 110.059 179.726 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -72.23 -34.29 68.2 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.035 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -75.06 -31.33 61.24 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.635 -0.665 . . . . 0.0 109.779 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 56.7 m -72.52 -29.79 63.91 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.717 -0.614 . . . . 0.0 109.76 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -69.15 -26.98 65.14 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.619 -0.676 . . . . 0.0 110.149 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -70.36 -31.89 69.35 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.586 -0.697 . . . . 0.0 110.328 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.1 tp60 -77.51 -34.25 54.12 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.492 -0.755 . . . . 0.0 109.847 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.762 HG12 HD22 ' B' ' 193' ' ' LEU . 81.1 mt -74.08 -26.98 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.721 -0.612 . . . . 0.0 109.56 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.9 mt -72.38 -37.27 68.8 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.5 -0.75 . . . . 0.0 109.882 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -65.26 -30.63 71.53 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.585 -0.697 . . . . 0.0 109.846 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.699 HD12 HG12 ' B' ' 190' ' ' ILE . 1.6 mm? -68.72 -29.27 67.65 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.65 -0.656 . . . . 0.0 110.049 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.514 ' O ' HD13 ' A' ' 77' ' ' LEU . 22.8 mt-10 -69.44 -33.74 73.39 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.546 -0.721 . . . . 0.0 110.033 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -30.0 58.56 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.646 -0.659 . . . . 0.0 109.87 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -76.19 -29.42 57.66 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.686 -0.634 . . . . 0.0 109.986 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.687 HD13 HD12 ' B' ' 190' ' ' ILE . 13.5 tp -76.76 -32.12 57.51 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.585 -0.697 . . . . 0.0 109.863 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 73' ' ' GLU . 5.6 mp -76.55 -32.56 58.27 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.747 -0.595 . . . . 0.0 109.782 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.1 -28.73 61.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.698 -0.626 . . . . 0.0 109.811 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.529 HD12 HG12 ' B' ' 183' ' ' ILE . 0.8 OUTLIER -74.0 -36.69 64.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.619 -0.676 . . . . 0.0 109.89 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -69.25 -28.37 66.27 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.593 -0.692 . . . . 0.0 110.014 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -70.94 -27.92 64.11 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.564 -0.71 . . . . 0.0 110.052 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -44.18 64.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.532 -0.73 . . . . 0.0 109.804 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.6 ttpp -62.78 -27.66 69.45 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.513 -0.742 . . . . 0.0 109.673 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -63.95 -32.95 74.66 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.565 -0.71 . . . . 0.0 110.023 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -64.49 -34.88 79.24 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.534 -0.729 . . . . 0.0 109.792 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' B' ' 176' ' ' MET . 0.6 OUTLIER -64.22 -35.22 80.1 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.599 -0.688 . . . . 0.0 109.896 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -60.75 -35.45 76.42 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.585 -0.697 . . . . 0.0 110.029 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mt -62.81 -30.31 71.38 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.637 -0.664 . . . . 0.0 109.674 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -96.77 -26.79 15.01 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.693 -0.63 . . . . 0.0 110.095 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.759 HD11 ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.005 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.494 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . 0.716 ' HA2' HD22 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.75 HD12 ' N ' ' B' ' 168' ' ' SER . 0.5 OUTLIER -119.5 -28.62 5.29 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.589 -0.947 . . . . 0.0 110.615 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.75 ' N ' HD12 ' B' ' 167' ' ' LEU . 8.3 t -165.84 18.12 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.349 -0.845 . . . . 0.0 111.62 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 48.66 26.58 1.26 Allowed 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.095 -1.003 . . . . 0.0 111.291 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -154.44 -46.56 0.09 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.723 -0.611 . . . . 0.0 110.109 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.465 ' HB2' HD13 ' B' ' 167' ' ' LEU . 5.2 mt-10 -74.12 -35.38 64.12 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.921 -0.712 . . . . 0.0 109.291 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.735 ' N ' HD11 ' B' ' 167' ' ' LEU . 19.3 tp -76.01 -26.48 56.71 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.759 ' CD1' HD11 ' A' ' 90' ' ' LEU . 49.1 mm -69.22 -32.85 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -70.44 -30.18 66.96 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.716 -0.615 . . . . 0.0 109.869 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.416 ' O ' HG23 ' B' ' 179' ' ' VAL . 89.8 m-20 -67.22 -32.24 73.16 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.612 -0.68 . . . . 0.0 109.858 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.562 ' HE1' ' HG ' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -71.14 -31.51 67.81 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.713 -0.617 . . . . 0.0 109.746 179.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.79 -30.27 63.96 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.707 -0.621 . . . . 0.0 109.856 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -39.94 61.96 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.619 -0.676 . . . . 0.0 109.926 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.416 HG23 ' O ' ' B' ' 175' ' ' ASN . 61.2 t -72.09 -30.97 38.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.675 -0.641 . . . . 0.0 109.458 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.73 -30.09 65.25 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.664 -0.648 . . . . 0.0 109.748 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -67.33 -32.75 73.92 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.645 -0.659 . . . . 0.0 109.768 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . 0.525 ' O ' HG23 ' B' ' 186' ' ' VAL . 16.4 tt0 -74.14 -35.87 64.1 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.58 -0.7 . . . . 0.0 109.942 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.529 HG12 HD12 ' A' ' 79' ' ' LEU . 82.5 mt -72.99 -29.76 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.703 -0.623 . . . . 0.0 109.705 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 53.7 m -74.15 -32.7 63.24 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.633 -0.667 . . . . 0.0 109.806 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.0 mtt -74.33 -39.27 62.94 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.669 -0.644 . . . . 0.0 109.705 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . 0.525 HG23 ' O ' ' B' ' 182' ' ' GLU . 57.3 t -72.33 -30.83 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.586 -0.696 . . . . 0.0 109.511 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -72.72 -29.7 63.58 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.711 -0.618 . . . . 0.0 109.905 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -29.89 66.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.641 -0.662 . . . . 0.0 109.899 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.06 -34.05 63.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.706 -0.621 . . . . 0.0 109.989 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.699 HG12 HD12 ' A' ' 72' ' ' LEU . 72.9 mt -73.86 -31.77 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.583 -0.698 . . . . 0.0 109.742 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 89.8 p -72.21 -34.88 68.69 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.615 -0.678 . . . . 0.0 109.462 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 4.0 mmmt -76.35 -32.51 58.69 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.366 179.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.762 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -71.08 -31.37 67.73 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 179.276 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.9 tptt -68.83 -46.68 67.94 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.592 -0.693 . . . . 0.0 109.651 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 3.2 tptp -66.58 -31.47 72.19 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.563 -0.71 . . . . 0.0 109.287 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -65.25 -34.87 79.37 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . 0.446 HE22 HD12 ' A' ' 69' ' ' ILE . 5.1 tt0 -65.3 -29.11 69.84 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.688 -0.633 . . . . 0.0 109.676 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -62.16 -40.19 95.16 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.629 -0.669 . . . . 0.0 109.76 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -62.49 -34.63 77.22 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.79 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.654 HD23 ' HG ' ' A' ' 62' ' ' LEU . 11.0 tp -76.88 -30.69 56.33 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.653 -0.655 . . . . 0.0 109.702 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.514 ' HG2' HD11 ' A' ' 62' ' ' LEU . 8.8 mt-10 -79.2 -31.18 43.67 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.613 -0.68 . . . . 0.0 109.713 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -78.99 -29.76 43.96 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.719 -0.613 . . . . 0.0 109.79 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -78.28 -28.14 47.53 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.623 -0.673 . . . . 0.0 109.924 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.51 -27.72 46.14 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.598 -0.689 . . . . 0.0 110.072 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -86.76 -33.29 19.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.59 -0.694 . . . . 0.0 110.172 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 9.9 mmtp 51.85 94.71 0.05 OUTLIER Pre-proline 0 N--CA 1.502 2.129 0 O-C-N 121.546 -0.721 . . . . 0.0 110.906 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.316 -1.184 0 O-C-N 123.365 1.192 . . . . 0.0 110.404 179.944 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.0 mtpt . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.194 0.521 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.72 -172.8 3.83 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.46 -0.775 . . . . 0.0 110.151 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -111.3 -29.25 7.9 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.608 -0.682 . . . . 0.0 110.154 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.8 mtt -87.81 -28.07 21.89 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.607 -0.683 . . . . 0.0 110.26 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -61.0 -28.08 68.78 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.539 -0.726 . . . . 0.0 110.256 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.5 -28.1 63.67 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.611 -0.68 . . . . 0.0 110.199 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -73.28 -29.61 62.85 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.56 -0.713 . . . . 0.0 110.123 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -34.13 68.59 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.525 -0.735 . . . . 0.0 109.843 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 t -67.53 -29.89 69.41 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.61 -0.681 . . . . 0.0 109.901 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.907 HD22 HD23 ' B' ' 200' ' ' LEU . 1.5 mm? -65.49 -29.22 69.85 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.618 -0.676 . . . . 0.0 109.842 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -63.24 -41.82 99.13 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.666 -0.646 . . . . 0.0 109.997 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -72.16 -37.55 69.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.667 -0.646 . . . . 0.0 109.642 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.49 HG22 ' CD1' ' A' ' 69' ' ' ILE . 89.7 m -73.62 -30.9 63.25 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.757 -0.59 . . . . 0.0 109.413 179.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -69.9 -27.66 64.98 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 120.166 -0.614 . . . . 0.0 109.92 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.47 -38.54 81.16 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.587 -0.695 . . . . 0.0 110.084 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -75.99 -36.02 59.36 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.612 -0.68 . . . . 0.0 109.606 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.738 HG12 HD23 ' B' ' 193' ' ' LEU . 86.1 mt -75.61 -26.2 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.777 -0.577 . . . . 0.0 109.644 179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.419 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.0 tt -76.03 -33.89 59.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.549 -0.72 . . . . 0.0 109.812 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.9 mmtm -70.41 -32.97 70.82 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.601 -0.687 . . . . 0.0 109.655 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.704 HD22 HG12 ' B' ' 190' ' ' ILE . 6.9 mt -65.8 -29.96 70.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.679 -0.638 . . . . 0.0 109.707 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.11 -44.18 96.39 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.648 -0.658 . . . . 0.0 109.82 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.08 -32.5 72.87 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.693 -0.63 . . . . 0.0 109.428 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -67.53 -35.2 78.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.773 -0.579 . . . . 0.0 109.743 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -71.19 -31.64 67.88 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.719 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.65 -38.72 67.58 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.718 -0.614 . . . . 0.0 109.572 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.17 -30.57 71.08 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.714 -0.617 . . . . 0.0 109.742 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.418 ' HA ' HD13 ' A' ' 79' ' ' LEU . 1.1 mm? -70.33 -46.75 63.55 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.708 -0.62 . . . . 0.0 109.734 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -64.28 -31.04 72.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.633 -0.667 . . . . 0.0 109.602 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.75 -29.43 69.95 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.688 -0.633 . . . . 0.0 109.781 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -64.62 -47.65 77.78 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.656 -0.653 . . . . 0.0 109.669 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 tptm -63.1 -30.77 71.86 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.671 -0.643 . . . . 0.0 109.619 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.6 t60 -64.93 -34.31 78.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.744 -0.598 . . . . 0.0 109.832 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -70.52 -37.35 74.11 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.709 -0.619 . . . . 0.0 109.745 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.641 HD23 HD21 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -66.1 -29.42 69.74 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.711 -0.618 . . . . 0.0 109.763 179.557 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -29.53 69.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.57 -0.706 . . . . 0.0 109.829 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.0 mp -76.62 -28.83 56.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.702 -0.624 . . . . 0.0 110.044 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -95.72 1.61 53.51 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.578 -0.701 . . . . 0.0 111.071 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.533 HD11 ' CD1' ' B' ' 173' ' ' ILE . 55.1 tp . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.272 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.852 HD21 HD12 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -146.26 -79.48 0.16 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.561 -0.964 . . . . 0.0 110.471 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 35.5 t -134.35 18.85 3.66 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.19 -0.944 . . . . 0.0 110.799 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 7.4 tptm 50.76 25.9 2.32 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.222 -0.924 . . . . 0.0 110.558 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -148.44 -46.49 0.15 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.612 -0.68 . . . . 0.0 109.417 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.619 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.3 mm-40 -67.39 -33.08 74.44 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.286 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.852 HD12 HD21 ' B' ' 167' ' ' LEU . 1.2 tt -78.5 -28.42 46.33 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 178.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.533 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.7 mm -68.5 -30.82 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -71.76 -30.27 65.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.648 -0.658 . . . . 0.0 109.979 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.744 ' O ' HG23 ' B' ' 179' ' ' VAL . 96.6 m-20 -74.72 -32.9 62.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.636 -0.665 . . . . 0.0 109.716 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.456 ' CE ' HD13 ' A' ' 90' ' ' LEU . 1.4 mtt -70.13 -29.77 66.78 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.692 -0.63 . . . . 0.0 109.983 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -73.81 -35.12 64.83 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.584 -0.697 . . . . 0.0 110.044 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -75.55 -29.93 59.54 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.636 -0.665 . . . . 0.0 109.876 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.744 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.4 t -76.05 -29.88 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.608 -0.682 . . . . 0.0 109.653 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . 0.406 ' HA ' HD12 ' B' ' 183' ' ' ILE . 17.8 t70 -75.73 -35.93 60.09 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.653 -0.654 . . . . 0.0 109.834 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 2.4 mtt85 -71.46 -28.45 63.96 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.632 -0.668 . . . . 0.0 109.723 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -70.19 -32.96 71.14 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.531 -0.731 . . . . 0.0 109.953 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' B' ' 180' ' ' ASP . 76.0 mt -70.88 -29.05 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.568 -0.707 . . . . 0.0 109.766 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.9 m -71.34 -34.73 70.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.574 -0.704 . . . . 0.0 109.742 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.22 -43.85 66.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.615 -0.678 . . . . 0.0 109.731 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 73.4 t -71.95 -31.53 40.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.577 -0.702 . . . . 0.0 109.426 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.49 -30.18 59.79 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.659 -0.651 . . . . 0.0 109.704 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 12.0 tp-100 -73.03 -30.13 63.52 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.643 -0.66 . . . . 0.0 109.843 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -37.44 73.73 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.683 -0.636 . . . . 0.0 109.823 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.704 HG12 HD22 ' A' ' 72' ' ' LEU . 75.8 mt -71.26 -31.15 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.63 -0.668 . . . . 0.0 109.554 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 6.4 m -68.49 -35.0 76.9 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.679 -0.638 . . . . 0.0 109.517 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 3.5 mmmm -74.73 -37.05 62.64 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.702 -0.624 . . . . 0.0 109.393 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.738 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -70.92 -31.82 68.56 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.635 -0.665 . . . . 0.0 109.367 179.297 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.7 tptm -66.56 -40.25 88.92 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.724 -0.61 . . . . 0.0 109.446 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -64.37 -31.62 72.9 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.666 -0.646 . . . . 0.0 109.43 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -63.74 -36.39 83.73 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.671 -0.643 . . . . 0.0 109.462 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . 0.485 ' NE2' HD12 ' A' ' 69' ' ' ILE . 35.2 tt0 -62.83 -30.03 71.18 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.774 -0.579 . . . . 0.0 109.632 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.54 -44.24 97.41 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.646 -0.659 . . . . 0.0 109.894 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -63.55 -39.98 95.82 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.699 -0.626 . . . . 0.0 109.699 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.907 HD23 HD22 ' A' ' 62' ' ' LEU . 3.6 tp -70.8 -40.64 72.4 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.655 -0.653 . . . . 0.0 109.721 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -73.12 -30.5 63.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.656 -0.653 . . . . 0.0 109.668 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -74.84 -29.97 61.22 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.69 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -69.79 -30.25 67.75 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.663 -0.648 . . . . 0.0 109.659 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -64.07 -30.28 71.36 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.651 -0.656 . . . . 0.0 109.762 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -110.57 28.46 8.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.698 -0.626 . . . . 0.0 110.086 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -107.63 88.3 4.16 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.535 -0.728 . . . . 0.0 110.178 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo . . . . . 0 C--N 1.318 -1.071 0 O-C-N 123.354 1.186 . . . . 0.0 110.404 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 19.0 pttp . . . . . 0 N--CA 1.493 1.699 0 CA-C-O 121.141 0.496 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -126.4 -169.63 2.05 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.552 -0.717 . . . . 0.0 110.187 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 52.87 38.74 27.59 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.465 -0.772 . . . . 0.0 110.758 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 7.0 mtt -135.03 -43.71 0.72 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.608 -0.682 . . . . 0.0 110.413 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.66 -28.65 68.75 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.63 -0.669 . . . . 0.0 110.269 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -77.24 -32.32 55.67 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.637 -0.665 . . . . 0.0 109.982 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -74.94 -27.05 60.04 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.698 -0.626 . . . . 0.0 110.01 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 20.0 mtp -75.74 -28.74 58.61 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.6 -0.688 . . . . 0.0 110.096 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.2 t -74.33 -29.23 61.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.565 -0.71 . . . . 0.0 110.135 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.0 tp -75.41 -28.34 59.37 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.663 -0.648 . . . . 0.0 110.084 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.16 -32.38 61.28 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.534 -0.729 . . . . 0.0 110.127 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -75.89 -36.79 59.36 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.629 -0.669 . . . . 0.0 109.735 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.412 HG22 HD11 ' A' ' 69' ' ' ILE . 89.6 m -71.87 -30.51 65.5 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.734 -0.603 . . . . 0.0 109.446 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -67.1 -28.91 68.56 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.593 -0.692 . . . . 0.0 109.767 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -63.49 -40.17 96.38 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.623 -0.673 . . . . 0.0 110.058 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -74.22 -34.54 63.71 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.653 -0.654 . . . . 0.0 109.609 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.486 HG12 HD22 ' B' ' 193' ' ' LEU . 73.8 mt -74.63 -27.05 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.744 -0.598 . . . . 0.0 109.578 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.481 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.3 tt -73.01 -31.56 64.55 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.544 -0.723 . . . . 0.0 109.843 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -30.88 70.94 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.509 -0.744 . . . . 0.0 109.843 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.663 HD22 HG12 ' B' ' 190' ' ' ILE . 18.9 mt -65.02 -29.1 69.99 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.624 -0.673 . . . . 0.0 110.036 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.605 ' O ' HD13 ' A' ' 77' ' ' LEU . 2.6 tp10 -66.76 -35.32 79.83 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.653 -0.654 . . . . 0.0 110.076 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.5 -32.8 58.53 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.603 -0.686 . . . . 0.0 109.826 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.7 tmtm? -77.73 -30.19 51.53 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.729 -0.607 . . . . 0.0 109.586 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.552 HD13 HD12 ' B' ' 190' ' ' ILE . 27.8 tp -79.16 -30.19 43.42 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.665 -0.647 . . . . 0.0 109.78 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.605 HD13 ' O ' ' A' ' 73' ' ' GLU . 1.4 mp -77.68 -31.28 52.41 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.634 -0.666 . . . . 0.0 109.719 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.26 -28.66 59.9 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.655 -0.653 . . . . 0.0 109.875 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.75 HD23 ' HA ' ' B' ' 183' ' ' ILE . 4.6 tp -76.48 -36.24 57.94 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.603 -0.686 . . . . 0.0 109.893 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -73.04 -30.46 63.74 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.614 -0.679 . . . . 0.0 109.694 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -70.85 -27.95 64.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.677 -0.64 . . . . 0.0 109.875 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -39.67 81.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.571 -0.706 . . . . 0.0 109.935 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -68.99 -29.72 67.98 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.592 -0.693 . . . . 0.0 109.91 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -69.91 -29.75 67.01 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.7 -0.625 . . . . 0.0 109.943 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -67.15 -36.27 81.48 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.66 -0.65 . . . . 0.0 109.861 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.413 HD13 ' HG2' ' B' ' 176' ' ' MET . 3.7 mt -59.99 -36.59 77.51 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.659 -0.651 . . . . 0.0 110.01 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -63.6 -51.66 64.31 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.618 -0.676 . . . . 0.0 109.666 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.6 mt -62.14 -27.36 68.89 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.696 -0.627 . . . . 0.0 109.611 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -107.78 21.12 17.88 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.621 -0.674 . . . . 0.0 110.417 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.698 ' HA ' HD23 ' B' ' 172' ' ' LEU . 3.4 mt . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.445 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 1.022 HD21 HD13 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -49.67 -61.9 1.86 Allowed 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.545 -0.974 . . . . 0.0 111.596 -179.658 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 5.3 t -149.14 14.74 0.9 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.995 -1.065 . . . . 0.0 111.328 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 19.6 tptt 49.94 26.21 1.92 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.081 -1.012 . . . . 0.0 110.867 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -150.86 -46.48 0.12 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.695 -0.628 . . . . 0.0 109.753 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.76 -42.64 85.8 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.355 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 1.022 HD13 HD21 ' B' ' 167' ' ' LEU . 9.8 tp -71.44 -28.78 64.21 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.0 mm -66.35 -32.1 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -74.94 -31.17 61.43 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.734 -0.604 . . . . 0.0 109.637 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.797 ' O ' HG23 ' B' ' 179' ' ' VAL . 89.3 m-20 -71.64 -29.95 65.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.692 -0.63 . . . . 0.0 109.805 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.466 ' HE1' HD11 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -68.06 -32.31 72.57 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.657 -0.652 . . . . 0.0 109.938 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -72.65 -34.49 67.3 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.616 -0.677 . . . . 0.0 109.933 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.41 -29.68 61.62 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.823 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.797 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.6 t -74.44 -30.17 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.638 -0.664 . . . . 0.0 109.75 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -71.94 -30.84 65.73 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.671 -0.643 . . . . 0.0 110.045 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -28.8 61.31 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.635 -0.666 . . . . 0.0 109.933 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -74.63 -37.24 62.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.587 -0.696 . . . . 0.0 109.928 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.75 ' HA ' HD23 ' A' ' 79' ' ' LEU . 90.3 mt -71.19 -29.66 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.689 -0.632 . . . . 0.0 109.592 179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . 0.405 HG22 ' OE1' ' B' ' 188' ' ' GLN . 65.5 m -70.71 -33.79 71.23 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.664 -0.648 . . . . 0.0 109.664 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.0 mtt -70.18 -44.54 68.52 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.637 -0.664 . . . . 0.0 109.686 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 67.4 t -66.92 -30.98 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.676 -0.64 . . . . 0.0 109.563 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.88 -30.69 68.19 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.654 -0.653 . . . . 0.0 109.808 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . 0.405 ' OE1' HG22 ' B' ' 184' ' ' THR . 0.0 OUTLIER -67.97 -36.59 80.32 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.663 -0.648 . . . . 0.0 109.712 179.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -38.56 82.06 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.633 -0.667 . . . . 0.0 109.85 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.663 HG12 HD22 ' A' ' 72' ' ' LEU . 72.9 mt -70.62 -37.09 68.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.623 -0.673 . . . . 0.0 109.667 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 32.5 m -68.87 -33.39 73.72 Favored 'General case' 0 N--CA 1.496 1.842 0 C-N-CA 120.192 -0.603 . . . . 0.0 109.605 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -77.01 -33.03 57.51 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.629 -0.67 . . . . 0.0 109.488 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.65 HD13 HD11 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -73.31 -33.14 65.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.68 -0.638 . . . . 0.0 109.324 179.186 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 16.5 tptt -65.4 -38.69 90.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.567 -0.708 . . . . 0.0 109.394 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -67.57 -31.24 71.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.627 -0.67 . . . . 0.0 109.336 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -37.1 86.01 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.664 -0.648 . . . . 0.0 109.422 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -62.79 -30.35 71.4 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.702 -0.624 . . . . 0.0 109.691 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -61.52 -41.2 96.95 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.672 -0.643 . . . . 0.0 109.874 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -62.29 -41.83 98.83 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.24 -0.584 . . . . 0.0 109.849 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.3 tp -72.36 -30.66 64.91 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.69 -0.631 . . . . 0.0 109.765 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -77.37 -30.67 53.87 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.679 -0.638 . . . . 0.0 109.832 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -77.07 -29.04 54.9 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.699 -0.626 . . . . 0.0 109.852 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -77.68 -29.27 51.36 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.637 -0.665 . . . . 0.0 110.012 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.94 -28.32 43.72 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.549 -0.719 . . . . 0.0 110.121 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -97.65 -25.69 15.02 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.626 -0.671 . . . . 0.0 110.278 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 24.3 mttt 52.89 87.07 0.14 Allowed Pre-proline 0 N--CA 1.501 2.107 0 O-C-N 121.369 -0.832 . . . . 0.0 110.807 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo . . . . . 0 C--N 1.317 -1.099 0 O-C-N 123.448 1.236 . . . . 0.0 110.409 179.951 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 121.009 0.433 . . . . 0.0 110.363 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 170.45 3.26 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.547 -0.72 . . . . 0.0 110.272 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -82.54 -28.81 30.78 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.674 -0.641 . . . . 0.0 110.221 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.1 mtm -61.91 -24.41 66.95 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.601 -0.687 . . . . 0.0 110.455 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.15 -39.01 81.09 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.496 -0.752 . . . . 0.0 110.364 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.93 -34.01 66.3 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.664 -0.648 . . . . 0.0 109.762 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -73.54 -28.03 61.66 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.71 -0.618 . . . . 0.0 109.771 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 48.4 mtp -72.21 -29.38 63.91 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.576 -0.703 . . . . 0.0 109.941 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.9 p -69.06 -30.73 69.13 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.648 -0.658 . . . . 0.0 109.897 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.682 HD12 HD23 ' B' ' 200' ' ' LEU . 1.6 tp -67.56 -28.69 68.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.68 -0.637 . . . . 0.0 109.923 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -65.75 -30.0 70.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.53 -0.731 . . . . 0.0 110.009 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -48.99 66.1 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.59 -0.694 . . . . 0.0 109.976 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.429 HG23 ' NZ ' ' B' ' 196' ' ' LYS . 26.6 m -67.02 -30.61 70.75 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.612 -0.68 . . . . 0.0 109.472 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -68.97 -28.12 66.34 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.681 -0.637 . . . . 0.0 109.883 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -65.19 -39.08 92.37 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.553 -0.717 . . . . 0.0 109.943 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.73 -41.09 65.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.615 -0.678 . . . . 0.0 109.42 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.439 HG12 HD23 ' B' ' 193' ' ' LEU . 87.4 mt -66.43 -27.21 39.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 mt -62.65 -41.32 98.99 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.588 -0.695 . . . . 0.0 109.629 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -65.14 -30.35 71.27 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.53 -0.731 . . . . 0.0 109.621 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.727 ' CD1' HD13 ' B' ' 193' ' ' LEU . 12.3 mt -73.05 -29.02 62.66 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.691 -0.63 . . . . 0.0 109.95 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.78 -34.71 72.07 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.599 -0.688 . . . . 0.0 109.881 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -74.03 -29.94 62.18 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.619 -0.676 . . . . 0.0 109.73 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -73.66 -30.02 62.67 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.637 -0.664 . . . . 0.0 109.916 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.945 HD13 HD12 ' B' ' 190' ' ' ILE . 13.0 tp -75.32 -32.51 60.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.638 -0.664 . . . . 0.0 109.935 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.54 -30.94 57.32 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.633 -0.667 . . . . 0.0 109.748 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.23 -28.84 60.06 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.688 -0.632 . . . . 0.0 109.845 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.432 ' HA ' HD13 ' A' ' 79' ' ' LEU . 1.1 mm? -75.08 -36.95 61.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.536 -0.728 . . . . 0.0 109.823 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -70.63 -29.85 66.34 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.538 -0.726 . . . . 0.0 109.802 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -69.78 -27.85 65.25 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.693 -0.629 . . . . 0.0 109.973 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -40.37 83.8 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.544 -0.723 . . . . 0.0 109.849 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -69.14 -30.46 68.72 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.474 -0.766 . . . . 0.0 109.627 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.4 t-80 -67.19 -29.62 69.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.655 -0.653 . . . . 0.0 109.826 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -63.06 -36.17 82.7 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.624 -0.672 . . . . 0.0 109.936 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.693 HD23 HD21 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -67.52 -32.56 73.44 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.582 -0.699 . . . . 0.0 109.887 179.814 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -66.9 -29.48 69.37 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.658 -0.651 . . . . 0.0 109.996 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.0 mt -66.86 -29.29 69.17 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.601 -0.687 . . . . 0.0 110.049 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -120.14 29.28 7.59 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.58 -0.7 . . . . 0.0 110.161 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.705 HD13 ' CE ' ' B' ' 176' ' ' MET . 27.7 tp . . . . . 0 N--CA 1.497 1.906 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.053 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.764 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.0 OUTLIER -141.74 -82.62 0.21 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.681 -0.893 . . . . 0.0 110.413 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 59.8 p -129.5 19.52 5.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.13 -0.981 . . . . 0.0 110.825 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 5.7 tptm 50.61 25.99 2.26 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.272 -0.893 . . . . 0.0 110.616 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -148.79 -46.0 0.15 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.648 -0.657 . . . . 0.0 109.605 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.604 ' HB2' HD12 ' B' ' 167' ' ' LEU . 0.8 OUTLIER -68.33 -33.16 73.79 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.92 -0.712 . . . . 0.0 109.322 179.467 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.764 ' N ' HD11 ' B' ' 167' ' ' LEU . 2.7 tt -78.11 -28.37 48.59 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 178.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.426 HD13 HD11 ' A' ' 90' ' ' LEU . 50.8 mm -67.54 -30.76 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.736 -0.602 . . . . 0.0 109.381 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -72.04 -29.73 64.46 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.668 -0.645 . . . . 0.0 109.926 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -75.44 -30.95 60.16 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.611 -0.681 . . . . 0.0 109.8 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.705 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.9 OUTLIER -71.92 -29.14 63.99 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.734 -0.604 . . . . 0.0 109.84 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -70.42 -29.96 66.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.592 -0.692 . . . . 0.0 110.027 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.9 ttp180 -71.99 -36.36 69.75 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.617 -0.677 . . . . 0.0 109.923 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 58.4 t -67.22 -29.82 47.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.707 -0.62 . . . . 0.0 109.881 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -69.12 -28.95 66.92 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.632 -0.667 . . . . 0.0 110.141 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.36 -30.0 63.01 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.654 -0.654 . . . . 0.0 110.066 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -74.63 -35.74 62.9 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.597 -0.689 . . . . 0.0 109.956 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.9 mt -71.82 -30.85 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.705 -0.622 . . . . 0.0 109.56 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.7 m -69.71 -35.14 74.78 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.63 -0.669 . . . . 0.0 109.617 179.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.7 ttp -66.61 -44.84 81.0 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.654 -0.654 . . . . 0.0 109.815 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 64.6 t -68.96 -30.65 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.628 -0.67 . . . . 0.0 109.476 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -70.18 -28.51 65.38 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.67 -0.644 . . . . 0.0 110.021 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -67.47 -32.86 73.99 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.582 -0.699 . . . . 0.0 110.041 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.05 -33.65 57.22 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.663 -0.648 . . . . 0.0 109.67 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.945 HD12 HD13 ' A' ' 76' ' ' LEU . 75.2 mt -76.01 -27.91 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.615 -0.678 . . . . 0.0 109.705 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.33 -30.48 63.38 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.632 -0.667 . . . . 0.0 109.572 179.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 19.8 mmtt -76.27 -37.11 58.0 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.596 -0.69 . . . . 0.0 109.749 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.727 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.1 OUTLIER -71.03 -30.79 67.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.615 -0.678 . . . . 0.0 109.428 179.355 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.1 tptm -67.56 -38.26 83.88 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.635 -0.665 . . . . 0.0 109.614 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.3 tptt -69.62 -30.28 67.98 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.575 -0.703 . . . . 0.0 109.533 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.429 ' NZ ' HG23 ' A' ' 65' ' ' THR . 31.2 ttpt -67.52 -32.77 73.8 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.603 -0.685 . . . . 0.0 109.606 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -65.27 -30.91 71.82 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.692 -0.63 . . . . 0.0 109.684 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -43.42 98.88 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.765 -0.584 . . . . 0.0 109.93 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -46.76 87.84 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.696 -0.627 . . . . 0.0 109.942 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.682 HD23 HD12 ' A' ' 62' ' ' LEU . 4.8 tp -70.27 -32.87 70.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.649 -0.657 . . . . 0.0 109.725 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -77.22 -29.68 54.3 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.642 -0.661 . . . . 0.0 109.878 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -78.41 -28.8 46.93 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.648 -0.657 . . . . 0.0 109.875 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -79.58 -29.46 41.26 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.582 -0.699 . . . . 0.0 109.977 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -81.05 -27.62 35.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.667 -0.646 . . . . 0.0 110.108 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -91.82 -26.38 18.54 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.548 -0.72 . . . . 0.0 110.349 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 16.0 mmtp 53.06 84.33 0.21 Allowed Pre-proline 0 N--CA 1.501 2.108 0 O-C-N 121.298 -0.876 . . . . 0.0 110.769 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo . . . . . 0 C--N 1.318 -1.052 0 O-C-N 123.49 1.258 . . . . 0.0 110.428 -179.989 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.066 0.46 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.4 pttt -164.47 169.0 17.79 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.554 -0.716 . . . . 0.0 110.251 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -154.28 28.2 0.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.594 -0.691 . . . . 0.0 110.205 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -155.79 -44.03 0.08 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.565 -0.709 . . . . 0.0 110.072 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.7 mp0 -60.17 -27.71 67.34 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.634 -0.666 . . . . 0.0 110.262 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -72.5 -29.21 63.42 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.553 -0.717 . . . . 0.0 110.094 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -70.67 -28.7 64.98 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.696 -0.628 . . . . 0.0 110.053 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.2 ttp -69.04 -29.27 67.39 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.575 -0.703 . . . . 0.0 110.001 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.9 t -72.37 -29.58 63.91 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.568 -0.707 . . . . 0.0 110.023 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.606 HD21 ' HG2' ' B' ' 201' ' ' GLU . 0.5 OUTLIER -70.85 -27.44 63.85 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.626 -0.671 . . . . 0.0 110.168 179.869 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -70.68 -29.32 65.6 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.55 -0.719 . . . . 0.0 110.184 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -74.74 -40.22 61.39 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.58 -0.7 . . . . 0.0 109.973 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.7 m -71.48 -29.75 65.19 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.729 -0.607 . . . . 0.0 109.723 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.421 ' HA ' HD12 ' A' ' 69' ' ' ILE . 3.5 mmtp -72.5 -28.48 62.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.649 -0.657 . . . . 0.0 109.925 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -34.6 73.12 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.59 -0.694 . . . . 0.0 109.979 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -37.17 65.64 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.668 -0.645 . . . . 0.0 109.706 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.518 HG22 ' OE2' ' A' ' 73' ' ' GLU . 66.5 mt -68.77 -27.77 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.714 -0.616 . . . . 0.0 109.619 179.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.22 -35.93 80.62 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.58 -0.7 . . . . 0.0 109.936 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.0 mttt -70.03 -30.18 67.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.6 -0.687 . . . . 0.0 109.96 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.705 HD12 HG12 ' B' ' 190' ' ' ILE . 2.9 mm? -70.86 -28.7 64.76 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.61 -0.681 . . . . 0.0 109.964 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.518 ' OE2' HG22 ' A' ' 69' ' ' ILE . 0.4 OUTLIER -69.34 -35.82 76.3 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.535 -0.728 . . . . 0.0 110.099 179.863 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -73.11 -31.7 64.49 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.716 -0.615 . . . . 0.0 109.827 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -75.04 -34.71 61.89 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.687 -0.633 . . . . 0.0 109.788 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.855 HD13 HD12 ' B' ' 190' ' ' ILE . 10.0 tp -74.19 -30.42 62.21 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.663 -0.648 . . . . 0.0 109.703 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.5 tp -74.8 -35.34 62.5 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.74 -0.6 . . . . 0.0 109.69 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.97 -29.82 68.12 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.707 -0.621 . . . . 0.0 109.758 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.75 HD23 ' HA ' ' B' ' 183' ' ' ILE . 2.8 mp -69.81 -43.1 72.76 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.767 -0.583 . . . . 0.0 109.813 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -66.64 -29.14 69.09 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.657 -0.652 . . . . 0.0 109.89 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -69.33 -30.46 68.51 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.557 -0.714 . . . . 0.0 109.826 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.4 -48.26 50.99 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.619 -0.676 . . . . 0.0 109.729 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.5 tttp -63.87 -29.52 70.7 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.587 -0.696 . . . . 0.0 109.568 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -66.08 -29.98 70.41 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.675 -0.641 . . . . 0.0 109.948 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -64.15 -40.62 96.52 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.638 -0.664 . . . . 0.0 109.86 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.835 HD23 HD21 ' B' ' 172' ' ' LEU . 2.8 mt -60.41 -33.5 72.58 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.557 -0.715 . . . . 0.0 110.066 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -63.8 -47.13 82.09 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.59 -0.694 . . . . 0.0 109.786 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.54 -28.63 68.69 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.722 -0.611 . . . . 0.0 109.678 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.48 13.06 36.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.679 -0.638 . . . . 0.0 110.81 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.52 HD11 ' CD1' ' B' ' 173' ' ' ILE . 27.7 tp . . . . . 0 N--CA 1.499 1.984 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.315 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.956 HD21 HD12 ' B' ' 172' ' ' LEU . 0.1 OUTLIER -144.64 -68.93 0.3 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.556 -0.967 . . . . 0.0 110.67 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 13.1 t -145.44 16.41 1.48 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.225 -0.922 . . . . 0.0 110.974 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.7 tptm 50.65 26.06 2.32 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.119 -0.988 . . . . 0.0 110.615 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -149.14 -46.58 0.14 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.606 -0.684 . . . . 0.0 109.491 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.607 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.8 mt-10 -66.26 -37.13 84.76 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.979 -0.688 . . . . 0.0 109.395 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.956 HD12 HD21 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -75.2 -28.66 60.08 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.859 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.52 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.5 mm -66.84 -30.49 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.67 -0.644 . . . . 0.0 109.341 179.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -74.56 -30.12 61.62 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.68 -0.638 . . . . 0.0 109.847 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.58 ' O ' HG23 ' B' ' 179' ' ' VAL . 83.7 m-20 -74.38 -29.3 61.49 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.639 -0.663 . . . . 0.0 109.979 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.456 ' HE2' ' C ' ' A' ' 86' ' ' LEU . 0.8 OUTLIER -72.49 -29.63 63.8 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.68 -0.638 . . . . 0.0 109.952 179.764 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -75.79 -28.96 58.58 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.657 -0.652 . . . . 0.0 110.138 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.91 -31.76 56.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.582 -0.699 . . . . 0.0 109.898 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.58 HG23 ' O ' ' B' ' 175' ' ' ASN . 66.4 t -74.93 -29.29 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.668 -0.645 . . . . 0.0 109.774 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . 0.403 ' O ' ' OG1' ' B' ' 184' ' ' THR . 14.6 t70 -73.7 -28.26 61.63 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.59 -0.694 . . . . 0.0 110.089 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.09 -31.38 64.32 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.625 -0.672 . . . . 0.0 110.101 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -73.53 -37.65 65.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.609 -0.682 . . . . 0.0 110.004 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.75 ' HA ' HD23 ' A' ' 79' ' ' LEU . 85.1 mt -68.57 -28.1 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.704 -0.623 . . . . 0.0 109.702 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' B' ' 180' ' ' ASP . 2.7 m -67.46 -34.54 77.39 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.492 -0.755 . . . . 0.0 109.85 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -48.26 69.41 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.552 -0.718 . . . . 0.0 109.833 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . 0.441 HG21 HD21 ' A' ' 79' ' ' LEU . 58.5 t -64.44 -28.93 45.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.61 -0.681 . . . . 0.0 109.816 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -70.81 -28.94 65.0 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.638 -0.664 . . . . 0.0 110.068 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -68.95 -31.31 70.09 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.548 -0.72 . . . . 0.0 110.047 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -40.53 65.48 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.703 -0.623 . . . . 0.0 109.893 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.855 HD12 HD13 ' A' ' 76' ' ' LEU . 77.2 mt -70.5 -28.51 35.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.687 -0.633 . . . . 0.0 109.819 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.0 m -73.85 -36.03 64.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.554 -0.716 . . . . 0.0 109.842 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -77.17 -31.08 55.22 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.615 -0.678 . . . . 0.0 109.611 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.474 HD23 ' HE2' ' B' ' 196' ' ' LYS . 0.2 OUTLIER -77.78 -21.76 51.18 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.576 -0.702 . . . . 0.0 110.159 179.411 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.8 tptm -81.35 -27.54 34.87 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.325 -0.86 . . . . 0.0 109.673 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 27.4 tptt -75.67 -35.3 60.42 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.54 -0.725 . . . . 0.0 109.94 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.474 ' HE2' HD23 ' B' ' 193' ' ' LEU . 13.8 pttt -69.04 -25.42 64.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.511 -0.743 . . . . 0.0 109.892 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -71.8 -29.96 65.01 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.521 -0.737 . . . . 0.0 109.603 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -62.38 -41.91 99.01 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.705 -0.622 . . . . 0.0 109.751 179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.75 -38.79 91.94 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.733 -0.604 . . . . 0.0 109.639 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.513 HD23 HD12 ' A' ' 62' ' ' LEU . 2.6 tp -75.7 -32.33 60.04 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.61 -0.681 . . . . 0.0 109.508 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.606 ' HG2' HD21 ' A' ' 62' ' ' LEU . 2.7 mm-40 -78.45 -30.49 47.53 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.658 -0.651 . . . . 0.0 109.738 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -79.19 -29.11 42.74 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.633 -0.667 . . . . 0.0 109.812 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -79.65 -28.74 40.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.637 -0.664 . . . . 0.0 109.928 179.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -80.86 -28.15 36.16 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.564 -0.71 . . . . 0.0 110.074 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -92.64 -27.07 17.53 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.553 -0.717 . . . . 0.0 110.313 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt 52.61 69.55 2.32 Favored Pre-proline 0 N--CA 1.501 2.077 0 O-C-N 121.428 -0.795 . . . . 0.0 110.73 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.317 -1.112 0 O-C-N 123.306 1.161 . . . . 0.0 110.389 179.998 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.7 mttp . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.113 0.482 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -86.54 -161.2 0.63 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.568 -0.708 . . . . 0.0 110.276 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 52.67 24.78 3.33 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.424 -0.797 . . . . 0.0 110.854 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.1 tpt -103.43 -36.23 8.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.504 -0.747 . . . . 0.0 109.985 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.35 -29.35 68.06 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.689 -0.632 . . . . 0.0 109.943 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -69.12 -29.45 67.51 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.637 -0.664 . . . . 0.0 110.006 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.23 -38.77 88.71 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.589 -0.694 . . . . 0.0 109.804 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.3 mtp -65.9 -31.01 71.7 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.699 -0.625 . . . . 0.0 109.622 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 29.5 t -63.56 -30.03 71.21 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.716 -0.615 . . . . 0.0 109.718 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.7 tp -61.82 -28.96 69.84 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.621 -0.675 . . . . 0.0 110.048 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -69.97 -48.65 57.43 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.479 -0.763 . . . . 0.0 109.982 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.92 -30.94 70.39 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.73 -0.606 . . . . 0.0 109.797 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.55 HG22 HD11 ' A' ' 69' ' ' ILE . 84.1 m -74.67 -30.71 61.68 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.69 -0.631 . . . . 0.0 109.742 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -71.41 -27.18 63.13 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.603 -0.686 . . . . 0.0 110.064 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -72.41 -35.1 68.3 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.598 -0.688 . . . . 0.0 110.22 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 -76.22 -35.07 59.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.69 -0.631 . . . . 0.0 109.792 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.55 HD11 HG22 ' A' ' 65' ' ' THR . 62.2 mt -75.2 -27.14 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.683 -0.636 . . . . 0.0 109.494 179.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.83 -34.55 62.35 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.58 -0.7 . . . . 0.0 109.887 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -71.41 -33.51 69.51 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.564 -0.71 . . . . 0.0 109.613 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.812 HD22 HG12 ' B' ' 190' ' ' ILE . 5.6 mt -66.92 -33.0 74.64 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.655 -0.653 . . . . 0.0 109.853 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -67.67 -36.85 81.47 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.613 -0.679 . . . . 0.0 109.878 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -71.21 -32.0 68.3 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.63 -0.669 . . . . 0.0 109.412 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -67.86 -36.05 79.61 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.701 -0.624 . . . . 0.0 109.825 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 21.4 tp -68.49 -30.09 68.85 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.644 -0.66 . . . . 0.0 109.844 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.5 mt -75.07 -38.84 61.17 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.643 -0.661 . . . . 0.0 109.771 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.75 -28.99 66.25 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.688 -0.633 . . . . 0.0 109.902 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.642 HD23 ' HA ' ' B' ' 183' ' ' ILE . 5.9 tp -72.88 -37.25 67.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.587 -0.696 . . . . 0.0 110.022 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -70.04 -30.65 67.98 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.558 -0.713 . . . . 0.0 109.689 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -28.42 67.46 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.738 -0.601 . . . . 0.0 109.839 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -45.04 80.3 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.641 -0.662 . . . . 0.0 109.778 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.05 -30.86 71.85 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.605 -0.684 . . . . 0.0 109.665 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -65.32 -30.93 71.82 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.723 -0.61 . . . . 0.0 109.823 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -65.27 -32.33 73.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.594 -0.691 . . . . 0.0 109.839 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.529 HD23 HD21 ' B' ' 172' ' ' LEU . 0.5 OUTLIER -66.28 -33.92 76.83 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.642 -0.661 . . . . 0.0 109.71 179.633 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -60.85 -34.8 75.14 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.642 -0.661 . . . . 0.0 109.862 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.7 mp -69.86 -29.38 66.6 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.732 -0.605 . . . . 0.0 109.775 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -95.09 -15.74 23.18 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.631 -0.668 . . . . 0.0 110.634 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.785 ' HA ' HD13 ' B' ' 172' ' ' LEU . 16.8 tp . . . . . 0 N--CA 1.501 2.094 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.746 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.371 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.568 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.6 OUTLIER -50.13 -52.17 37.32 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.581 -0.952 . . . . 0.0 111.746 -179.912 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 25.2 p -153.07 15.23 0.54 Allowed 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.119 -0.988 . . . . 0.0 111.532 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 27.3 tptt 49.78 26.19 1.81 Allowed 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.077 -1.014 . . . . 0.0 110.893 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -150.5 -47.56 0.12 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.674 -0.641 . . . . 0.0 109.739 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.401 ' HB2' ' CD1' ' B' ' 167' ' ' LEU . 1.9 mt-10 -74.54 -31.56 62.16 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.053 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.785 HD13 ' HA ' ' A' ' 90' ' ' LEU . 2.9 tt -76.47 -28.18 56.41 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.627 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.0 mm -68.49 -30.2 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.642 -0.661 . . . . 0.0 109.624 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -70.89 -29.43 65.51 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.67 -0.644 . . . . 0.0 109.984 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.755 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.8 m-20 -75.71 -29.66 59.04 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.674 -0.642 . . . . 0.0 110.065 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.47 ' CE ' HD13 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -75.53 -29.38 59.43 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.625 -0.672 . . . . 0.0 110.023 179.749 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.2 -31.29 58.38 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.617 -0.677 . . . . 0.0 110.05 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -28.51 58.67 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.67 -0.644 . . . . 0.0 110.001 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.755 HG23 ' O ' ' B' ' 175' ' ' ASN . 60.1 t -76.12 -31.94 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.62 -0.675 . . . . 0.0 109.723 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -73.54 -29.92 62.75 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.591 -0.693 . . . . 0.0 109.917 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.2 -29.77 63.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.724 -0.61 . . . . 0.0 109.894 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -72.72 -38.82 67.33 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.653 -0.655 . . . . 0.0 109.953 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.642 ' HA ' HD23 ' A' ' 79' ' ' LEU . 88.1 mt -66.74 -28.02 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.694 -0.629 . . . . 0.0 109.702 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.0 m -67.26 -35.78 80.24 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.601 -0.687 . . . . 0.0 109.889 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 4.8 ttt -72.13 -37.52 69.42 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.648 -0.658 . . . . 0.0 109.856 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . 0.408 HG21 ' CD2' ' A' ' 79' ' ' LEU . 59.3 t -73.0 -30.69 32.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.591 -0.693 . . . . 0.0 109.618 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -74.12 -28.62 61.44 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.726 -0.608 . . . . 0.0 110.077 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -29.33 61.77 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.603 -0.686 . . . . 0.0 110.044 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -37.63 61.15 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.7 -0.625 . . . . 0.0 109.94 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.812 HG12 HD22 ' A' ' 72' ' ' LEU . 81.4 mt -72.51 -30.52 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.602 -0.686 . . . . 0.0 109.635 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 17.8 m -71.65 -34.94 70.18 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.631 -0.668 . . . . 0.0 109.604 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.6 mmtp -75.34 -37.77 60.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.644 -0.66 . . . . 0.0 109.383 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.59 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -71.6 -30.26 65.6 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.743 -0.598 . . . . 0.0 109.455 179.27 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 17.1 tptt -70.29 -41.03 73.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.699 -0.626 . . . . 0.0 109.622 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.9 mmtm -67.14 -31.28 71.6 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.631 -0.668 . . . . 0.0 109.33 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -63.75 -36.15 82.94 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.681 -0.637 . . . . 0.0 109.293 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . 0.4 ' NE2' ' CD1' ' A' ' 69' ' ' ILE . 47.2 tt0 -63.07 -30.23 71.43 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.773 -0.58 . . . . 0.0 109.58 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -60.99 -41.95 97.47 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.691 -0.631 . . . . 0.0 109.911 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -61.75 -49.52 76.06 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.664 -0.647 . . . . 0.0 109.895 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 19.5 tp -68.27 -29.86 68.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.621 -0.675 . . . . 0.0 109.685 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -76.93 -31.37 56.6 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 0.0 109.929 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -78.17 -34.1 49.84 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.729 -0.607 . . . . 0.0 109.709 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -77.17 -27.48 53.76 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.684 -0.635 . . . . 0.0 109.909 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -79.66 -25.32 41.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.538 -0.726 . . . . 0.0 110.305 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -86.13 -27.88 24.35 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.497 -0.752 . . . . 0.0 110.115 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 15.8 mmtp -61.77 149.48 84.93 Favored Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 121.598 -0.689 . . . . 0.0 110.111 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.318 -1.04 0 O-C-N 123.33 1.174 . . . . 0.0 110.403 179.985 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.092 0.472 . . . . 0.0 110.143 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.9 mttp -98.24 173.0 7.22 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.569 -0.707 . . . . 0.0 110.239 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -79.28 -28.88 42.3 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.565 -0.709 . . . . 0.0 110.148 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 21.5 mtt -82.84 -24.71 33.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.613 -0.679 . . . . 0.0 110.428 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -58.6 -27.82 65.02 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.452 -0.78 . . . . 0.0 110.434 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -75.1 -29.67 60.67 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.579 -0.7 . . . . 0.0 109.962 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 24.5 mtt85 -72.62 -28.46 62.78 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 110.031 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 10.3 mmm -70.89 -29.98 66.22 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.66 -0.65 . . . . 0.0 109.998 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.9 m -67.65 -30.38 69.92 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.618 -0.676 . . . . 0.0 109.918 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.613 HD11 ' HG2' ' B' ' 201' ' ' GLU . 0.4 OUTLIER -64.97 -28.44 69.51 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.727 -0.608 . . . . 0.0 110.041 179.733 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -64.28 -31.54 72.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.641 -0.662 . . . . 0.0 110.001 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -70.44 -47.75 59.22 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.598 -0.689 . . . . 0.0 109.92 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.9 m -66.49 -31.36 72.05 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.739 -0.601 . . . . 0.0 109.538 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.92 -27.23 65.58 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.672 -0.642 . . . . 0.0 109.896 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -66.54 -36.02 81.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.498 -0.751 . . . . 0.0 109.988 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.0 tp60 -76.39 -34.56 58.85 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.567 -0.708 . . . . 0.0 109.563 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.9 mt -73.26 -27.51 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.691 -0.63 . . . . 0.0 109.491 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.1 tp -71.77 -38.78 70.29 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.556 -0.715 . . . . 0.0 109.953 179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.3 mmtt -65.64 -35.44 80.79 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.543 -0.723 . . . . 0.0 109.728 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.813 HD22 HG12 ' B' ' 190' ' ' ILE . 3.2 mt -69.54 -27.96 65.61 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.72 -0.612 . . . . 0.0 109.809 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -69.91 -38.91 76.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.579 -0.701 . . . . 0.0 109.975 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -67.38 -41.38 85.11 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.681 -0.637 . . . . 0.0 109.62 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.7 tptt -64.32 -35.23 80.18 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.77 -0.581 . . . . 0.0 109.713 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.546 HD13 HD12 ' B' ' 190' ' ' ILE . 18.5 tp -73.49 -31.41 63.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.679 -0.638 . . . . 0.0 109.529 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 tp -70.51 -34.83 72.76 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.693 -0.629 . . . . 0.0 109.702 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.04 -30.78 62.58 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.721 -0.612 . . . . 0.0 109.68 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.847 HD12 ' CG1' ' B' ' 183' ' ' ILE . 0.2 OUTLIER -76.16 -37.76 57.53 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.649 -0.657 . . . . 0.0 109.643 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -71.96 -29.75 64.59 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.617 -0.677 . . . . 0.0 109.686 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.5 -29.68 66.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 109.72 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -68.48 -43.67 76.41 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.612 -0.68 . . . . 0.0 109.744 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -64.7 -29.93 70.93 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.555 -0.716 . . . . 0.0 109.647 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -64.33 -32.56 74.22 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.699 -0.625 . . . . 0.0 109.829 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -73.57 -35.33 65.43 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.672 -0.642 . . . . 0.0 109.715 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.401 ' CD2' ' CD2' ' B' ' 172' ' ' LEU . 3.2 mt -70.87 -33.32 70.5 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.69 -0.631 . . . . 0.0 109.685 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.469 ' HA ' ' HE1' ' B' ' 176' ' ' MET . 0.2 OUTLIER -68.27 -33.12 73.79 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.715 -0.616 . . . . 0.0 109.718 179.848 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 tp -79.16 -30.0 43.31 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.643 -0.661 . . . . 0.0 109.764 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -89.11 -8.7 53.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.626 -0.672 . . . . 0.0 110.848 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.643 HD13 ' HE3' ' B' ' 176' ' ' MET . 56.4 tp . . . . . 0 N--CA 1.5 2.026 0 O-C-N 121.093 -1.004 . . . . 0.0 110.46 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.307 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.712 HD13 ' HB2' ' B' ' 171' ' ' GLU . 0.3 OUTLIER -117.75 -31.16 5.23 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.684 -0.892 . . . . 0.0 110.32 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.71 ' H ' HD12 ' B' ' 167' ' ' LEU . 1.4 m -167.53 18.08 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.375 -0.828 . . . . 0.0 111.808 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 24.4 tptt 48.3 26.98 1.21 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.04 -1.038 . . . . 0.0 110.99 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.32 -47.24 0.11 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.774 -0.579 . . . . 0.0 109.695 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.712 ' HB2' HD13 ' B' ' 167' ' ' LEU . 0.5 OUTLIER -69.79 -37.02 76.18 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.259 179.499 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.602 ' N ' HD11 ' B' ' 167' ' ' LEU . 3.2 mt -74.2 -28.14 61.13 Favored 'General case' 0 N--CA 1.493 1.679 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.443 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.1 mm -68.25 -31.84 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.687 -0.633 . . . . 0.0 109.404 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -74.43 -31.35 62.25 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.757 -0.589 . . . . 0.0 109.955 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -75.06 -34.21 61.79 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.62 -0.675 . . . . 0.0 109.885 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.643 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -71.42 -27.23 63.15 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.611 -0.681 . . . . 0.0 109.75 179.475 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.05 -31.71 69.47 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.553 -0.717 . . . . 0.0 110.104 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.58 -29.32 46.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.607 -0.683 . . . . 0.0 109.952 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.443 ' O ' HD12 ' B' ' 183' ' ' ILE . 76.0 t -79.29 -25.8 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.639 -0.663 . . . . 0.0 109.53 179.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -78.16 -38.7 43.0 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.463 -0.773 . . . . 0.0 110.073 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 10.3 ptt85 -73.09 -24.8 60.7 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 119.868 -0.733 . . . . 0.0 110.158 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . 0.503 ' O ' HG23 ' B' ' 186' ' ' VAL . 2.4 tp10 -80.78 -37.02 31.02 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.511 -0.743 . . . . 0.0 109.87 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.847 ' CG1' HD12 ' A' ' 79' ' ' LEU . 76.0 mt -76.52 -27.32 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.611 -0.681 . . . . 0.0 109.556 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 72.2 m -76.62 -30.98 57.12 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.496 -0.752 . . . . 0.0 109.676 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.5 mtp -76.07 -39.32 55.68 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.619 -0.676 . . . . 0.0 109.666 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 182' ' ' GLU . 59.3 t -72.98 -29.9 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.628 -0.67 . . . . 0.0 109.499 179.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -72.75 -28.15 62.45 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.539 -0.726 . . . . 0.0 109.984 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.94 -34.48 69.07 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.635 -0.666 . . . . 0.0 109.985 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -40.67 64.04 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.622 -0.674 . . . . 0.0 109.684 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.813 HG12 HD22 ' A' ' 72' ' ' LEU . 84.2 mt -71.04 -30.54 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.654 -0.654 . . . . 0.0 109.477 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 50.9 m -69.26 -35.57 76.21 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.688 -0.633 . . . . 0.0 109.41 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 12.9 mmmt -76.53 -36.4 57.72 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.451 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -71.75 -30.01 65.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.683 -0.636 . . . . 0.0 109.531 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -69.24 -37.75 78.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.613 -0.679 . . . . 0.0 109.764 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.6 -31.23 71.13 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.562 -0.711 . . . . 0.0 109.467 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -64.13 -36.49 84.2 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.659 -0.65 . . . . 0.0 109.742 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -63.77 -30.59 71.67 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.667 -0.646 . . . . 0.0 109.867 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.39 -38.61 90.28 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.59 -0.693 . . . . 0.0 109.897 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -62.22 -41.47 98.42 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.715 -0.615 . . . . 0.0 109.9 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.462 HD23 ' HG ' ' A' ' 62' ' ' LEU . 5.5 tp -73.14 -32.37 64.85 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.587 -0.695 . . . . 0.0 109.687 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.613 ' HG2' HD11 ' A' ' 62' ' ' LEU . 24.6 mt-10 -77.78 -30.14 51.25 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.685 -0.635 . . . . 0.0 109.812 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -77.78 -28.31 50.47 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.626 -0.672 . . . . 0.0 109.8 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -77.23 -28.27 53.67 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.492 -0.755 . . . . 0.0 110.079 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.81 -28.44 44.5 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.561 -0.712 . . . . 0.0 110.176 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -99.22 -28.16 13.47 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.539 -0.725 . . . . 0.0 110.26 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp 52.83 92.07 0.06 OUTLIER Pre-proline 0 N--CA 1.5 2.066 0 O-C-N 121.419 -0.801 . . . . 0.0 110.736 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.317 -1.119 0 O-C-N 123.434 1.228 . . . . 0.0 110.348 -179.994 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.129 0.49 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.4 mttp -102.93 171.73 7.23 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.512 -0.742 . . . . 0.0 110.132 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -78.42 -28.97 46.88 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.536 -0.727 . . . . 0.0 110.164 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -83.72 -23.55 31.59 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.606 -0.684 . . . . 0.0 110.504 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -58.52 -31.42 67.89 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.493 -0.754 . . . . 0.0 110.361 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -71.61 -43.9 65.38 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.597 -0.69 . . . . 0.0 109.805 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -65.32 -28.15 69.1 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.73 -0.606 . . . . 0.0 109.808 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.3 mtt -68.6 -30.62 69.39 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.633 -0.667 . . . . 0.0 110.042 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.4 t -67.51 -29.77 69.27 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.649 -0.657 . . . . 0.0 109.989 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.751 HD11 ' HG2' ' B' ' 201' ' ' GLU . 0.6 OUTLIER -66.93 -29.96 69.97 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.632 -0.668 . . . . 0.0 109.982 179.643 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -64.18 -30.0 71.08 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.66 -0.65 . . . . 0.0 109.954 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -68.45 -51.41 43.91 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.615 -0.678 . . . . 0.0 109.866 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 79.7 m -63.45 -32.08 73.42 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.637 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.41 -29.09 68.5 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.647 -0.658 . . . . 0.0 109.76 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.7 -36.7 84.72 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.66 -0.65 . . . . 0.0 109.956 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 36.6 tp60 -73.46 -35.75 65.76 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.652 -0.655 . . . . 0.0 109.708 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.5 mt -71.0 -28.31 32.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.656 -0.653 . . . . 0.0 109.553 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.418 HD23 ' C ' ' A' ' 70' ' ' LEU . 9.8 tt -68.71 -37.5 79.54 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.492 -0.755 . . . . 0.0 109.806 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -65.01 -37.96 89.35 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.66 -0.65 . . . . 0.0 109.701 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.627 HD22 HG12 ' B' ' 190' ' ' ILE . 12.3 mt -62.37 -29.55 70.55 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.689 -0.632 . . . . 0.0 109.939 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 tm-20 -63.3 -42.84 99.09 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.537 -0.727 . . . . 0.0 109.945 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.19 -34.48 74.97 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.671 -0.643 . . . . 0.0 109.559 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.01 -36.9 69.84 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.733 -0.605 . . . . 0.0 109.595 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.8 tp -75.11 -31.36 61.11 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.626 -0.671 . . . . 0.0 109.582 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tt -76.06 -32.2 59.16 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.738 -0.601 . . . . 0.0 109.604 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.411 ' HA ' ' HG2' ' A' ' 81' ' ' GLU . . . -73.26 -27.09 61.37 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.1 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.48 -27.07 41.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.46 -0.775 . . . . 0.0 109.813 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -76.34 -36.58 58.16 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.582 -0.699 . . . . 0.0 109.976 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.411 ' HG2' ' HA ' ' A' ' 78' ' ' ALA . 7.6 pt-20 -68.76 -24.62 64.46 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 119.889 -0.724 . . . . 0.0 109.822 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.05 -41.8 81.5 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.495 -0.753 . . . . 0.0 109.478 179.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.4 ttpm? -68.29 -31.05 70.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.593 -0.692 . . . . 0.0 109.435 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -65.5 -30.08 70.81 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.687 -0.633 . . . . 0.0 109.734 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -61.79 -34.72 76.41 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.63 -0.669 . . . . 0.0 109.726 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.866 HD23 HD21 ' B' ' 172' ' ' LEU . 0.8 OUTLIER -70.66 -30.31 66.88 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.635 -0.665 . . . . 0.0 109.81 179.571 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -69.79 -30.51 68.07 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.602 -0.686 . . . . 0.0 110.019 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.4 tp -67.5 -31.61 71.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.576 -0.703 . . . . 0.0 109.888 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -117.38 29.84 7.64 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.648 -0.657 . . . . 0.0 109.987 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.612 ' CD2' HD11 ' B' ' 173' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.498 1.945 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.305 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.369 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.784 HD11 ' N ' ' B' ' 172' ' ' LEU . 0.0 OUTLIER -141.35 -82.6 0.22 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.556 -0.967 . . . . 0.0 110.453 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 8.4 t -129.48 20.74 5.64 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.946 . . . . 0.0 110.848 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.459 ' C ' HD13 ' B' ' 173' ' ' ILE . 13.8 tptm 50.76 25.94 2.33 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.238 -0.914 . . . . 0.0 110.729 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -150.99 -45.58 0.12 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.694 -0.628 . . . . 0.0 109.724 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.617 ' HB2' HD12 ' B' ' 167' ' ' LEU . 1.4 mt-10 -67.7 -31.12 70.86 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 120.003 -0.679 . . . . 0.0 109.621 179.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.866 HD21 HD23 ' A' ' 86' ' ' LEU . 2.8 tt -80.94 -30.57 35.22 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.622 -0.674 . . . . 0.0 109.341 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.619 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.0 mp -72.53 -31.29 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -64.7 -32.62 74.38 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.524 ' O ' HG23 ' B' ' 179' ' ' VAL . 76.8 m-20 -74.16 -32.76 63.25 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -65.23 -29.46 70.26 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.785 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -72.12 -31.94 66.48 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.566 -0.709 . . . . 0.0 110.021 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.03 -30.17 58.36 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.617 -0.677 . . . . 0.0 109.838 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.524 HG23 ' O ' ' B' ' 175' ' ' ASN . 66.2 t -74.54 -29.57 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.673 -0.642 . . . . 0.0 109.689 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -72.64 -28.67 62.88 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.591 -0.693 . . . . 0.0 110.049 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -71.92 -29.52 64.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.591 -0.693 . . . . 0.0 110.02 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -72.85 -38.87 66.93 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.542 -0.724 . . . . 0.0 110.044 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 80.8 mt -68.53 -29.03 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 C-N-CA 120.172 -0.611 . . . . 0.0 109.678 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 24.6 m -68.72 -32.88 72.98 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.689 -0.632 . . . . 0.0 109.849 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.92 -47.81 60.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.556 -0.715 . . . . 0.0 109.724 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 65.6 t -70.42 -31.95 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.62 -0.675 . . . . 0.0 109.402 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -74.81 -28.89 60.9 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.771 -0.581 . . . . 0.0 109.715 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -72.59 -29.94 63.95 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.612 -0.68 . . . . 0.0 109.956 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -72.26 -34.72 68.45 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.639 -0.663 . . . . 0.0 109.841 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.627 HG12 HD22 ' A' ' 72' ' ' LEU . 80.5 mt -70.63 -31.3 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.666 -0.646 . . . . 0.0 109.511 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 4.8 m -67.31 -40.17 86.0 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.629 -0.67 . . . . 0.0 109.524 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -72.3 -34.37 68.08 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.678 -0.639 . . . . 0.0 109.337 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.543 HD23 ' HE2' ' B' ' 196' ' ' LYS . 0.3 OUTLIER -78.01 -10.97 59.85 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.682 -0.636 . . . . 0.0 110.558 179.423 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 18.4 tptt -91.72 -28.7 17.26 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.245 -0.91 . . . . 0.0 109.227 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.0 tptm -75.61 -32.68 60.38 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.702 -0.624 . . . . 0.0 109.733 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.543 ' HE2' HD23 ' B' ' 193' ' ' LEU . 0.0 OUTLIER -67.23 -28.58 68.18 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.493 179.335 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -69.27 -29.45 67.35 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.653 -0.654 . . . . 0.0 109.47 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -61.22 -41.72 97.35 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.641 -0.662 . . . . 0.0 109.789 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -62.37 -37.83 87.22 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.727 -0.608 . . . . 0.0 109.641 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.486 HD23 ' HG ' ' A' ' 62' ' ' LEU . 7.2 tp -75.08 -30.67 61.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.683 -0.636 . . . . 0.0 109.527 179.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.751 ' HG2' HD11 ' A' ' 62' ' ' LEU . 1.8 tm-20 -76.38 -32.13 58.4 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.708 -0.62 . . . . 0.0 109.688 179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -75.22 -31.57 60.9 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.638 -0.664 . . . . 0.0 109.746 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -71.46 -30.31 65.87 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.65 -0.656 . . . . 0.0 109.81 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -67.07 -27.94 67.78 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.657 -0.652 . . . . 0.0 109.921 179.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -116.76 30.41 7.35 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.518 -0.739 . . . . 0.0 110.184 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.43 98.46 10.75 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.558 -0.714 . . . . 0.0 110.156 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo . . . . . 0 C--N 1.318 -1.056 0 O-C-N 123.329 1.173 . . . . 0.0 110.368 179.993 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.055 0.455 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.2 mttp -163.41 160.37 23.38 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.569 -0.707 . . . . 0.0 110.227 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -81.8 -28.42 33.17 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.599 -0.688 . . . . 0.0 110.25 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.6 ttt -80.96 -27.79 35.91 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.542 -0.724 . . . . 0.0 110.29 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.74 -28.14 68.46 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.523 -0.736 . . . . 0.0 110.232 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.2 -28.63 67.43 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.564 -0.71 . . . . 0.0 110.186 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.2 mtp85 -75.07 -30.16 60.9 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.535 -0.728 . . . . 0.0 110.002 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.3 mtt -72.67 -29.99 63.88 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.64 -0.662 . . . . 0.0 109.919 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.6 m -69.3 -28.5 66.32 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.619 -0.676 . . . . 0.0 109.936 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.55 ' HG ' HD23 ' B' ' 200' ' ' LEU . 0.8 OUTLIER -68.02 -28.51 67.47 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.582 -0.699 . . . . 0.0 110.163 179.878 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -70.4 -36.1 73.84 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.619 -0.676 . . . . 0.0 110.157 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -74.7 -34.58 62.64 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.63 -0.669 . . . . 0.0 109.773 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.412 HG22 HD11 ' A' ' 69' ' ' ILE . 88.2 m -74.55 -30.55 61.79 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.705 -0.622 . . . . 0.0 109.665 179.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.13 -27.19 62.46 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.669 -0.645 . . . . 0.0 110.012 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -72.1 -36.23 69.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.483 -0.76 . . . . 0.0 110.187 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -72.32 -39.81 67.93 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.641 -0.662 . . . . 0.0 109.717 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.863 HG12 HD23 ' B' ' 193' ' ' LEU . 46.3 mt -66.74 -27.64 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.45 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.49 -41.44 96.46 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.623 -0.673 . . . . 0.0 109.484 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -69.96 -29.62 66.78 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.587 -0.695 . . . . 0.0 109.633 179.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.852 HD12 HD22 ' B' ' 193' ' ' LEU . 3.6 mt -71.11 -28.38 64.27 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.726 -0.609 . . . . 0.0 109.917 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -75.84 -34.49 60.09 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.595 -0.691 . . . . 0.0 109.929 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -31.73 68.7 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 120.182 -0.607 . . . . 0.0 109.543 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -64.58 -33.42 75.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.733 -0.604 . . . . 0.0 109.743 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 20.2 tp -72.07 -28.77 63.54 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.637 -0.665 . . . . 0.0 109.953 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 mt -75.04 -34.89 61.93 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.667 -0.646 . . . . 0.0 109.924 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.48 -31.54 65.47 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.583 -0.698 . . . . 0.0 109.949 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.743 HD23 ' HA ' ' B' ' 183' ' ' ILE . 6.5 tp -75.06 -37.25 61.71 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.711 -0.618 . . . . 0.0 109.812 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -72.26 -30.42 64.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.601 -0.687 . . . . 0.0 109.563 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -69.18 -29.2 67.14 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.208 -0.597 . . . . 0.0 109.795 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.44 -45.13 76.94 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.549 -0.719 . . . . 0.0 109.826 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.4 tttm -62.92 -29.49 70.82 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.495 -0.753 . . . . 0.0 109.563 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -62.57 -32.87 73.92 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.675 -0.641 . . . . 0.0 109.784 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -65.88 -30.8 71.46 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.682 -0.636 . . . . 0.0 109.722 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.2 OUTLIER -67.62 -33.09 74.29 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.607 -0.683 . . . . 0.0 109.65 179.695 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -61.81 -35.69 78.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.541 -0.724 . . . . 0.0 109.89 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.7 mp -74.0 -30.29 62.4 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.735 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -85.04 -21.89 29.23 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.741 -0.599 . . . . 0.0 110.414 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.653 ' HA ' HD23 ' B' ' 172' ' ' LEU . 56.2 tp . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.574 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.33 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.937 HD21 HD13 ' B' ' 172' ' ' LEU . 0.0 OUTLIER -141.32 -83.5 0.21 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.572 -0.958 . . . . 0.0 110.654 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.2 m -128.79 19.62 6.08 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.148 -0.97 . . . . 0.0 110.994 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.3 tptt 50.71 25.81 2.25 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.228 -0.92 . . . . 0.0 110.539 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -147.95 -46.38 0.16 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.714 -0.616 . . . . 0.0 109.394 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.575 ' HB2' HD12 ' B' ' 167' ' ' LEU . 4.0 mm-40 -68.69 -32.93 73.1 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 119.9 -0.72 . . . . 0.0 109.276 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.937 HD13 HD21 ' B' ' 167' ' ' LEU . 13.8 tp -77.5 -29.17 52.41 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 49.3 mm -65.92 -31.6 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.669 -0.644 . . . . 0.0 109.322 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -71.28 -29.65 65.31 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.753 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.793 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.7 m-20 -72.07 -42.35 66.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.636 -0.665 . . . . 0.0 109.772 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.57 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -65.82 -33.99 77.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.684 -0.635 . . . . 0.0 109.651 179.736 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.34 -30.22 57.55 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.643 -0.661 . . . . 0.0 109.807 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -77.19 -30.0 54.59 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.668 -0.645 . . . . 0.0 109.865 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.793 HG23 ' O ' ' B' ' 175' ' ' ASN . 72.2 t -75.83 -30.03 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.587 -0.696 . . . . 0.0 109.592 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -74.08 -29.7 61.99 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.681 -0.637 . . . . 0.0 109.966 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -73.55 -29.43 62.44 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.65 -0.656 . . . . 0.0 109.957 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -73.28 -38.06 66.05 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.568 -0.708 . . . . 0.0 109.949 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.743 ' HA ' HD23 ' A' ' 79' ' ' LEU . 90.2 mt -67.39 -30.0 47.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.633 -0.667 . . . . 0.0 109.634 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.3 m -66.07 -35.69 81.19 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.597 -0.689 . . . . 0.0 109.743 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -50.34 58.24 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.648 -0.658 . . . . 0.0 109.643 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.6 t -63.85 -31.9 54.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.601 -0.687 . . . . 0.0 109.314 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -65.52 -34.85 79.24 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.7 -0.625 . . . . 0.0 109.947 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -63.89 -29.98 71.11 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.642 -0.661 . . . . 0.0 109.824 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.15 -27.68 61.8 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.669 -0.644 . . . . 0.0 109.969 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.713 HD13 HD22 ' A' ' 72' ' ' LEU . 45.0 mm -75.72 -41.99 40.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.606 -0.684 . . . . 0.0 109.525 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 51.8 m -68.66 -29.19 67.61 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.704 -0.622 . . . . 0.0 109.699 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 54.0 mmtt -74.27 -42.81 59.0 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.615 -0.678 . . . . 0.0 109.807 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.863 HD23 HG12 ' A' ' 69' ' ' ILE . 0.0 OUTLIER -72.15 -31.09 65.65 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.471 -0.768 . . . . 0.0 109.283 179.351 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -70.26 -37.76 74.98 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.662 -0.649 . . . . 0.0 109.392 179.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 16.3 mmtt -70.08 -31.52 69.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.592 -0.692 . . . . 0.0 109.319 179.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -65.01 -34.24 77.97 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -64.41 -30.25 71.3 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.661 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -61.83 -43.16 99.41 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.703 -0.623 . . . . 0.0 109.804 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -62.59 -40.15 95.98 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.75 -0.594 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.55 HD23 ' HG ' ' A' ' 62' ' ' LEU . 5.4 tp -73.23 -32.39 64.72 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.69 -0.631 . . . . 0.0 109.687 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -77.35 -30.78 54.02 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.555 -0.716 . . . . 0.0 109.836 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -77.11 -29.13 54.66 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.723 -0.611 . . . . 0.0 109.875 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -76.54 -28.94 56.52 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.578 -0.701 . . . . 0.0 109.977 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -75.54 -28.9 59.24 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.657 -0.652 . . . . 0.0 110.057 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -123.38 28.42 7.06 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.561 -0.712 . . . . 0.0 110.176 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.0 143.61 91.75 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.562 -0.711 . . . . 0.0 110.122 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo . . . . . 0 C--N 1.318 -1.05 0 O-C-N 123.278 1.146 . . . . 0.0 110.423 179.994 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.2 mttm . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.089 0.471 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -91.46 157.04 17.28 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.514 -0.741 . . . . 0.0 110.172 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -169.56 -39.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.556 -0.715 . . . . 0.0 110.527 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 8.5 mtp -70.8 -28.64 64.79 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.562 -0.711 . . . . 0.0 110.278 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.77 -29.66 56.18 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.587 -0.695 . . . . 0.0 110.108 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -76.61 -29.67 56.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.614 -0.679 . . . . 0.0 109.97 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.3 -28.14 59.59 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.619 -0.675 . . . . 0.0 110.019 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 19.4 mmm -74.49 -29.58 61.48 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.594 -0.691 . . . . 0.0 110.04 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 41.3 t -72.68 -28.1 62.49 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.572 -0.705 . . . . 0.0 110.094 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.656 HD11 ' NE2' ' B' ' 197' ' ' GLN . 0.2 OUTLIER -72.51 -27.79 62.47 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.552 -0.718 . . . . 0.0 110.065 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -72.7 -34.67 67.3 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.586 -0.696 . . . . 0.0 110.232 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -75.04 -33.37 61.73 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.671 -0.643 . . . . 0.0 109.9 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.8 m -75.31 -30.37 60.33 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.633 -0.667 . . . . 0.0 109.631 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -73.04 -26.58 61.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.686 -0.634 . . . . 0.0 110.057 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -72.8 -32.48 65.58 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.528 -0.732 . . . . 0.0 110.179 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -76.05 -36.38 59.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.659 -0.65 . . . . 0.0 109.691 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 84.9 mt -70.67 -27.66 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.682 -0.636 . . . . 0.0 109.63 179.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.1 tt -68.43 -36.81 79.59 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.513 -0.742 . . . . 0.0 109.821 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -69.77 -30.09 67.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.64 -0.663 . . . . 0.0 109.843 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.782 HD22 HG12 ' B' ' 190' ' ' ILE . 9.2 mt -70.0 -28.57 65.62 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.702 -0.624 . . . . 0.0 110.028 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.517 ' O ' HD13 ' A' ' 77' ' ' LEU . 6.6 mt-10 -72.35 -32.1 66.19 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.596 -0.69 . . . . 0.0 110.03 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.43 -30.9 60.17 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.604 -0.685 . . . . 0.0 109.78 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.78 -32.5 62.06 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.71 -0.619 . . . . 0.0 109.785 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.717 HD13 ' O ' ' A' ' 76' ' ' LEU . 0.5 OUTLIER -74.94 -31.01 61.4 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.576 -0.702 . . . . 0.0 109.654 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.517 HD13 ' O ' ' A' ' 73' ' ' GLU . 1.1 mp -74.64 -35.29 62.88 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.625 -0.672 . . . . 0.0 109.812 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.37 -30.61 64.86 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.651 -0.655 . . . . 0.0 109.77 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.641 HD23 ' HA ' ' B' ' 183' ' ' ILE . 5.9 tp -73.66 -37.9 65.12 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.642 -0.661 . . . . 0.0 109.817 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 15.6 tp60 -70.46 -30.95 67.91 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.63 -0.668 . . . . 0.0 109.625 179.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.11 -30.13 69.22 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.62 -0.675 . . . . 0.0 109.742 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -66.01 -46.53 77.61 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.664 -0.647 . . . . 0.0 109.698 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.3 tttt -64.0 -28.98 70.17 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.502 -0.749 . . . . 0.0 109.443 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -63.83 -31.38 72.54 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.671 -0.643 . . . . 0.0 109.932 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -65.28 -31.25 72.3 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.508 -0.745 . . . . 0.0 109.704 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' B' ' 176' ' ' MET . 0.6 OUTLIER -68.24 -32.84 73.32 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.674 -0.641 . . . . 0.0 109.588 179.679 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -61.65 -35.18 77.21 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.638 -0.664 . . . . 0.0 109.898 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.3 tp -63.45 -29.63 70.88 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.587 -0.695 . . . . 0.0 109.768 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -94.97 -23.46 17.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.666 -0.646 . . . . 0.0 110.379 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.625 HD11 HD11 ' B' ' 173' ' ' ILE . 56.6 tp . . . . . 0 N--CA 1.502 2.147 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.74 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . 0.504 ' HA2' HD12 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.82 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.5 OUTLIER -109.46 -61.98 1.56 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.677 -0.896 . . . . 0.0 109.2 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 52.1 m -153.53 37.09 0.46 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.322 0.582 . . . . 0.0 109.498 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.495 ' C ' HD13 ' B' ' 173' ' ' ILE . 28.0 tptt 52.44 26.62 4.31 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.606 -0.684 . . . . 0.0 110.346 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -153.72 -43.7 0.09 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.619 -0.675 . . . . 0.0 110.397 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.685 ' HB3' HD13 ' B' ' 167' ' ' LEU . 1.0 OUTLIER -61.77 -29.59 70.23 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.82 ' HG ' HD11 ' B' ' 167' ' ' LEU . 0.6 OUTLIER -85.53 -28.98 24.56 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.933 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.625 HD11 HD11 ' A' ' 90' ' ' LEU . 2.7 mp -76.83 -30.97 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -66.0 -34.6 78.48 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -78.0 -32.57 51.25 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 178.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.466 ' O ' HG12 ' B' ' 179' ' ' VAL . 0.0 OUTLIER -69.31 -29.98 67.94 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 120.184 -0.606 . . . . 0.0 109.526 179.341 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -74.12 -27.48 60.89 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.598 -0.689 . . . . 0.0 110.006 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.2 -41.07 58.6 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.549 -0.719 . . . . 0.0 109.967 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.466 HG12 ' O ' ' B' ' 176' ' ' MET . 10.5 p -70.33 -26.96 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.606 -0.684 . . . . 0.0 109.999 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -76.04 -29.08 57.93 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.519 -0.738 . . . . 0.0 109.961 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 5.6 mtp-105 -73.42 -29.35 62.52 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.653 -0.654 . . . . 0.0 110.05 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -72.56 -36.97 68.35 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.573 -0.704 . . . . 0.0 109.9 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.641 ' HA ' HD23 ' A' ' 79' ' ' LEU . 88.3 mt -66.38 -28.63 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.652 -0.655 . . . . 0.0 109.664 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 4.4 m -65.43 -30.95 71.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.598 -0.689 . . . . 0.0 109.677 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -42.97 61.22 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.783 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.5 t -71.78 -31.23 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.645 -0.659 . . . . 0.0 109.46 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.9 -29.06 60.88 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.648 -0.658 . . . . 0.0 109.836 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -72.87 -29.64 63.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.707 -0.62 . . . . 0.0 109.999 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -73.26 -36.45 66.36 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.597 -0.689 . . . . 0.0 109.842 179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.782 HG12 HD22 ' A' ' 72' ' ' LEU . 78.0 mt -71.49 -31.35 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.674 -0.641 . . . . 0.0 109.584 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 44.8 m -69.95 -37.62 75.88 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.682 -0.636 . . . . 0.0 109.65 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -71.59 -37.42 71.0 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.614 -0.679 . . . . 0.0 109.495 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.575 HD13 HD11 ' A' ' 72' ' ' LEU . 0.3 OUTLIER -75.38 -11.85 60.13 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.731 -0.606 . . . . 0.0 110.601 179.53 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.55 -28.56 19.52 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.17 -0.956 . . . . 0.0 109.41 179.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -32.19 55.68 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.665 -0.647 . . . . 0.0 109.89 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.481 ' HE3' HD23 ' B' ' 193' ' ' LEU . 0.0 OUTLIER -71.96 -28.25 63.32 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.49 -0.756 . . . . 0.0 109.652 179.483 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . 0.656 ' NE2' HD11 ' A' ' 62' ' ' LEU . 1.1 tm0? -68.13 -30.54 69.71 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.642 -0.661 . . . . 0.0 109.657 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -62.65 -44.17 96.95 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.757 -0.589 . . . . 0.0 109.951 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -61.36 -40.63 95.0 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.045 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.565 ' CD2' HD22 ' A' ' 62' ' ' LEU . 29.1 tp -70.38 -40.98 73.65 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.607 -0.683 . . . . 0.0 109.746 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.15 -29.86 62.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.653 -0.654 . . . . 0.0 109.637 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -78.99 -29.31 43.71 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.674 -0.641 . . . . 0.0 109.768 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -77.59 -27.88 51.44 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.523 -0.736 . . . . 0.0 109.993 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.19 -28.33 48.09 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.558 -0.714 . . . . 0.0 110.169 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.69 -31.61 24.02 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.586 -0.696 . . . . 0.0 110.138 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt 51.9 93.96 0.05 OUTLIER Pre-proline 0 N--CA 1.501 2.094 0 O-C-N 121.45 -0.781 . . . . 0.0 110.848 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.317 -1.085 0 O-C-N 123.459 1.242 . . . . 0.0 110.399 179.936 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 19.1 ttmt . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.059 0.457 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.0 mttm -112.36 178.26 4.36 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.645 -0.66 . . . . 0.0 110.209 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -84.87 -28.89 25.7 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.571 -0.705 . . . . 0.0 110.185 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 32.3 mtt -67.01 -29.02 68.73 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.625 -0.672 . . . . 0.0 110.132 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -71.27 -28.28 64.03 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.484 -0.76 . . . . 0.0 110.189 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -71.24 -28.52 64.24 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.563 -0.711 . . . . 0.0 110.238 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 35.4 mtt180 -73.51 -41.13 63.45 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.672 -0.642 . . . . 0.0 110.029 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.9 mtt -70.28 -30.88 68.0 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.703 -0.623 . . . . 0.0 109.771 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.75 -28.72 64.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.724 -0.61 . . . . 0.0 109.807 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.656 HD11 ' CG ' ' B' ' 201' ' ' GLU . 1.2 tt -67.88 -29.13 68.17 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.644 -0.66 . . . . 0.0 110.03 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -70.4 -36.03 73.82 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.608 -0.683 . . . . 0.0 109.981 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.53 -30.67 61.86 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.618 -0.676 . . . . 0.0 109.788 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 83.4 m -73.71 -30.62 62.95 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.655 -0.653 . . . . 0.0 109.587 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -69.81 -28.88 66.09 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.604 -0.685 . . . . 0.0 110.06 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -70.89 -33.22 70.36 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.57 -0.706 . . . . 0.0 110.155 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -72.43 -34.87 68.13 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.674 -0.641 . . . . 0.0 109.941 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.3 mt -68.43 -27.58 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.664 -0.647 . . . . 0.0 109.787 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.471 ' O ' HD23 ' A' ' 70' ' ' LEU . 4.8 tt -69.88 -44.31 70.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.553 -0.717 . . . . 0.0 109.783 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -65.11 -30.9 71.88 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.598 -0.689 . . . . 0.0 109.668 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.842 ' CD1' HD13 ' B' ' 193' ' ' LEU . 1.6 mt -66.54 -29.42 69.49 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.634 -0.666 . . . . 0.0 109.978 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -68.46 -45.8 71.49 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.604 -0.685 . . . . 0.0 110.029 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -63.93 -31.08 72.14 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.662 -0.649 . . . . 0.0 109.593 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.1 tttm -64.37 -35.19 80.07 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.635 -0.665 . . . . 0.0 109.913 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.9 tp -66.18 -33.75 76.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.626 -0.671 . . . . 0.0 109.824 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 mt -73.09 -37.9 66.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.728 -0.607 . . . . 0.0 109.552 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.33 -28.44 68.67 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.701 -0.624 . . . . 0.0 109.884 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.803 HD12 HG12 ' B' ' 183' ' ' ILE . 0.2 OUTLIER -69.07 -43.57 74.31 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.651 -0.655 . . . . 0.0 109.883 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -66.17 -32.81 74.46 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.62 -0.675 . . . . 0.0 109.713 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.9 -28.55 69.03 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.747 -0.596 . . . . 0.0 109.755 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.5 -44.39 94.47 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.664 -0.647 . . . . 0.0 109.735 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -65.81 -29.91 70.46 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.602 -0.686 . . . . 0.0 109.752 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -67.95 -34.17 76.06 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.578 -0.701 . . . . 0.0 109.903 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -68.9 -46.59 67.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.648 -0.658 . . . . 0.0 109.705 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.599 HD22 ' CG ' ' B' ' 176' ' ' MET . 0.2 OUTLIER -62.11 -29.58 70.43 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.658 -0.651 . . . . 0.0 109.832 179.528 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.405 ' HA ' ' HE1' ' B' ' 176' ' ' MET . 0.4 OUTLIER -66.16 -34.15 77.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.62 -0.675 . . . . 0.0 109.822 179.856 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.73 -30.4 71.5 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.6 -0.688 . . . . 0.0 109.858 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -85.26 -17.66 36.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.676 -0.64 . . . . 0.0 110.673 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.698 HD11 HD11 ' B' ' 173' ' ' ILE . 49.4 tp . . . . . 0 N--CA 1.5 2.058 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.743 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.775 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.5 OUTLIER -108.15 -61.71 1.55 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.541 -0.976 . . . . 0.0 109.165 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 88.5 p -154.5 37.3 0.42 Allowed 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.477 ' C ' HD13 ' B' ' 173' ' ' ILE . 36.7 tptt 52.15 26.31 3.81 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.548 -0.72 . . . . 0.0 110.363 -179.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -152.86 -43.9 0.1 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.616 -0.678 . . . . 0.0 110.291 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.699 ' HB3' HD22 ' B' ' 167' ' ' LEU . 1.2 tt0 -61.85 -29.24 70.05 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 119.753 -0.779 . . . . 0.0 109.666 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.775 ' HG ' HD11 ' B' ' 167' ' ' LEU . 0.6 OUTLIER -85.21 -29.09 24.97 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.603 -0.685 . . . . 0.0 109.168 178.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.698 HD11 HD11 ' A' ' 90' ' ' LEU . 2.9 mp -78.38 -31.7 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.307 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -67.58 -33.88 75.91 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.784 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.3 m-20 -78.89 -32.32 45.77 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.599 ' CG ' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -71.78 -30.02 65.1 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.734 -0.604 . . . . 0.0 109.638 179.291 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.27 -33.49 61.27 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.57 -0.707 . . . . 0.0 109.827 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -71.67 -29.03 64.16 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.651 -0.656 . . . . 0.0 109.895 179.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.784 HG23 ' O ' ' B' ' 175' ' ' ASN . 64.6 t -69.51 -32.7 53.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.616 -0.677 . . . . 0.0 109.612 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -63.73 -37.26 86.71 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.666 -0.646 . . . . 0.0 109.81 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 5.7 mtp-105 -69.94 -29.4 66.54 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.748 -0.595 . . . . 0.0 109.722 179.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . 0.534 ' O ' HG23 ' B' ' 186' ' ' VAL . 5.7 tt0 -69.85 -32.35 70.7 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.676 -0.64 . . . . 0.0 109.869 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.803 HG12 HD12 ' A' ' 79' ' ' LEU . 86.6 mt -72.4 -33.17 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.676 -0.64 . . . . 0.0 109.616 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 58.9 m -71.96 -33.23 68.02 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.692 -0.63 . . . . 0.0 109.649 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.74 -41.46 71.78 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.644 -0.66 . . . . 0.0 109.602 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . 0.534 HG23 ' O ' ' B' ' 182' ' ' GLU . 63.2 t -68.28 -37.76 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 119.995 -0.682 . . . . 0.0 109.246 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.4 -33.57 75.83 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.805 -0.559 . . . . 0.0 109.893 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -29.91 70.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.648 -0.658 . . . . 0.0 109.858 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -72.91 -21.55 60.88 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.594 -0.691 . . . . 0.0 110.371 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.774 HD13 HD22 ' A' ' 72' ' ' LEU . 35.3 mm -79.55 -39.04 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.413 -0.804 . . . . 0.0 109.603 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.27 -30.2 64.61 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.623 -0.673 . . . . 0.0 109.734 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 13.8 mmtm -75.28 -36.15 61.23 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.692 -0.63 . . . . 0.0 109.85 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.842 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -74.08 -21.47 59.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.579 -0.7 . . . . 0.0 110.242 179.696 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.6 tptt -80.45 -28.59 37.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 109.575 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 14.9 tptt -74.26 -40.05 62.6 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.638 -0.664 . . . . 0.0 109.76 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.529 ' HE3' HD23 ' B' ' 193' ' ' LEU . 2.6 pttp -64.64 -26.11 68.25 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.532 -0.73 . . . . 0.0 109.639 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -69.81 -30.64 68.21 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.513 -0.742 . . . . 0.0 109.569 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -43.59 98.48 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.684 -0.635 . . . . 0.0 109.764 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -61.71 -31.18 71.32 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.777 -0.577 . . . . 0.0 109.66 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.57 HD23 ' HG ' ' A' ' 62' ' ' LEU . 3.9 tp -77.41 -38.16 50.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.69 -0.631 . . . . 0.0 109.534 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.656 ' CG ' HD11 ' A' ' 62' ' ' LEU . 28.6 mt-10 -76.43 -30.77 57.54 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.687 -0.633 . . . . 0.0 109.598 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -78.88 -29.16 44.25 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.705 -0.622 . . . . 0.0 109.723 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -78.14 -28.28 48.39 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.593 -0.692 . . . . 0.0 109.928 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.99 -28.29 43.43 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.589 -0.694 . . . . 0.0 110.196 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -88.68 -29.13 20.12 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.586 -0.696 . . . . 0.0 110.179 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 4.2 mmtp -60.74 111.32 3.91 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.549 -0.719 . . . . 0.0 110.149 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 N--CA 1.485 0.988 0 O-C-N 123.094 1.05 . . . . 0.0 110.4 179.954 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.7 mttt . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.103 0.478 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.9 pttt -136.77 172.17 13.41 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.579 -0.701 . . . . 0.0 110.355 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -84.03 -28.98 27.27 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.57 -0.706 . . . . 0.0 110.271 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.0 mtm -59.88 -24.51 64.33 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.576 -0.702 . . . . 0.0 110.462 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -71.55 -29.74 65.09 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.53 -0.731 . . . . 0.0 110.123 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -71.96 -27.71 62.96 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.664 -0.647 . . . . 0.0 110.097 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -71.39 -29.08 64.51 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.506 -0.746 . . . . 0.0 110.116 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.8 mtm -69.1 -35.6 76.63 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.641 -0.662 . . . . 0.0 110.049 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.9 m -68.58 -29.1 67.56 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.657 -0.652 . . . . 0.0 109.835 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.587 HD11 ' CG ' ' B' ' 201' ' ' GLU . 5.1 tt -67.11 -29.45 69.2 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.651 -0.656 . . . . 0.0 109.911 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -63.95 -42.77 97.2 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.686 -0.634 . . . . 0.0 109.986 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -72.02 -30.77 65.54 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.72 -0.612 . . . . 0.0 109.636 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 66.7 m -73.59 -28.43 61.83 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.793 -0.567 . . . . 0.0 109.793 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.4 mmtp -72.06 -26.47 62.19 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.489 -0.757 . . . . 0.0 110.382 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -74.94 -31.85 61.6 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.542 -0.724 . . . . 0.0 110.433 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -76.23 -34.4 59.22 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.63 -0.669 . . . . 0.0 109.785 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.768 HG12 HD22 ' B' ' 193' ' ' LEU . 69.3 mt -71.5 -26.13 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.653 -0.655 . . . . 0.0 109.679 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.402 ' O ' HD23 ' A' ' 70' ' ' LEU . 1.6 tt -71.12 -40.77 71.25 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.477 -0.765 . . . . 0.0 109.929 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.5 tppt? -62.62 -31.07 71.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.557 -0.715 . . . . 0.0 109.69 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.8 HD22 HG12 ' B' ' 190' ' ' ILE . 11.3 mt -62.67 -29.6 70.77 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.714 -0.616 . . . . 0.0 109.915 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -66.58 -39.28 88.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.625 -0.672 . . . . 0.0 109.847 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.03 -30.23 63.59 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.654 -0.654 . . . . 0.0 109.53 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -29.72 63.98 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.678 -0.639 . . . . 0.0 109.908 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.454 HD13 HD12 ' B' ' 190' ' ' ILE . 25.9 tp -74.1 -33.67 63.68 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.63 -0.669 . . . . 0.0 109.899 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.8 mt -74.32 -33.1 63.08 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.666 -0.646 . . . . 0.0 109.632 179.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.88 -29.21 66.36 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.725 -0.609 . . . . 0.0 109.706 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.64 -42.75 77.56 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.655 -0.653 . . . . 0.0 109.79 179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -65.73 -29.05 69.52 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.468 -0.77 . . . . 0.0 109.876 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.0 tm-20 -68.41 -28.24 66.91 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.646 -0.659 . . . . 0.0 110.044 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -70.23 -45.76 65.86 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.557 -0.714 . . . . 0.0 109.87 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.1 tttm -63.7 -29.56 70.77 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.509 -0.744 . . . . 0.0 109.945 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -67.38 -29.3 68.78 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.59 -0.694 . . . . 0.0 109.943 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -36.15 83.18 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.533 -0.729 . . . . 0.0 109.945 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.485 HD23 HD21 ' B' ' 172' ' ' LEU . 1.4 mt -64.29 -34.36 77.96 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.638 -0.664 . . . . 0.0 109.992 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -65.59 -26.49 67.87 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.619 -0.676 . . . . 0.0 110.332 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.8 -28.24 64.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.575 -0.703 . . . . 0.0 110.267 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -117.29 26.19 9.93 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.557 -0.714 . . . . 0.0 110.467 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.526 HD11 ' CD1' ' B' ' 173' ' ' ILE . 49.8 tp . . . . . 0 N--CA 1.498 1.943 0 CA-C-O 117.957 -1.02 . . . . 0.0 110.171 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.378 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.739 HD12 ' N ' ' B' ' 168' ' ' SER . 2.5 pp -139.85 -46.35 0.44 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.67 -0.9 . . . . 0.0 110.637 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.739 ' N ' HD12 ' B' ' 167' ' ' LEU . 33.9 p -153.46 14.56 0.5 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.31 -0.868 . . . . 0.0 111.499 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 9.5 tptm 49.53 26.37 1.7 Allowed 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.012 -1.055 . . . . 0.0 111.051 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -152.92 -46.83 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.665 -0.647 . . . . 0.0 110.047 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.456 ' CB ' HD11 ' B' ' 167' ' ' LEU . 1.0 OUTLIER -73.58 -36.73 65.59 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 179.427 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.485 HD21 HD23 ' A' ' 86' ' ' LEU . 1.0 OUTLIER -74.09 -28.05 61.19 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.818 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.526 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.3 mm -67.54 -31.04 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.694 -0.629 . . . . 0.0 109.385 179.397 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -72.38 -29.09 63.44 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.681 -0.637 . . . . 0.0 109.916 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -72.55 -32.17 65.85 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.621 -0.674 . . . . 0.0 110.026 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.464 ' CE ' HD13 ' A' ' 90' ' ' LEU . 1.3 mtt -70.37 -30.19 67.05 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.695 -0.628 . . . . 0.0 109.888 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -69.39 -30.87 68.94 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.644 -0.66 . . . . 0.0 109.863 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.13 -45.48 66.76 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.701 -0.625 . . . . 0.0 109.695 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.419 HG21 ' CD1' ' A' ' 86' ' ' LEU . 58.5 t -61.96 -30.45 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.827 -0.545 . . . . 0.0 109.773 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -67.85 -31.73 71.75 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.658 -0.651 . . . . 0.0 109.863 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.19 -30.39 63.5 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.698 -0.626 . . . . 0.0 109.715 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . 0.604 ' O ' HG23 ' B' ' 186' ' ' VAL . 13.3 tt0 -70.89 -34.69 71.82 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.664 -0.647 . . . . 0.0 109.815 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 82.5 mt -73.66 -30.6 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.721 -0.612 . . . . 0.0 109.654 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 53.1 m -73.31 -34.76 65.88 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.674 -0.641 . . . . 0.0 109.626 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 tpp -72.13 -39.18 69.02 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.605 -0.685 . . . . 0.0 109.677 179.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . 0.604 HG23 ' O ' ' B' ' 182' ' ' GLU . 64.8 t -70.89 -32.07 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.641 -0.662 . . . . 0.0 109.423 179.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -70.77 -30.01 66.39 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.684 -0.635 . . . . 0.0 109.894 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -30.2 62.72 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.694 -0.629 . . . . 0.0 109.871 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -37.11 68.56 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.688 -0.632 . . . . 0.0 109.8 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.8 HG12 HD22 ' A' ' 72' ' ' LEU . 77.3 mt -72.95 -31.29 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.666 -0.646 . . . . 0.0 109.607 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.57 -34.7 65.26 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.656 -0.653 . . . . 0.0 109.662 179.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -73.1 -38.56 66.31 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.655 -0.653 . . . . 0.0 109.536 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.768 HD22 HG12 ' A' ' 69' ' ' ILE . 0.3 OUTLIER -67.34 -32.23 73.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.668 -0.645 . . . . 0.0 109.351 179.316 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -66.76 -47.23 72.86 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.66 -0.65 . . . . 0.0 109.387 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -64.21 -31.09 72.16 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 120.051 -0.66 . . . . 0.0 109.244 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.658 ' HE2' HD23 ' B' ' 193' ' ' LEU . 19.0 ttpt -62.79 -37.22 85.82 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.691 -0.631 . . . . 0.0 109.418 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . 0.405 HE22 HD12 ' A' ' 69' ' ' ILE . 5.5 tt0 -63.12 -30.16 71.37 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.722 -0.611 . . . . 0.0 109.66 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -61.04 -40.96 95.61 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.605 -0.685 . . . . 0.0 109.882 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -36.43 83.97 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.753 -0.592 . . . . 0.0 109.644 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' B' ' 200' ' ' LEU . 14.0 tp -75.68 -31.02 59.55 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.658 -0.651 . . . . 0.0 109.632 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.587 ' CG ' HD11 ' A' ' 62' ' ' LEU . 14.9 mt-10 -77.95 -30.73 50.55 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.638 -0.664 . . . . 0.0 109.723 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -76.13 -31.07 58.42 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.651 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -72.02 -29.08 63.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.679 -0.638 . . . . 0.0 109.923 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -71.13 -26.81 63.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.588 -0.695 . . . . 0.0 110.141 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -118.23 27.35 9.03 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.547 -0.721 . . . . 0.0 110.394 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -77.14 152.67 82.15 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.552 -0.717 . . . . 0.0 110.058 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.316 -1.141 0 O-C-N 123.404 1.213 . . . . 0.0 110.409 179.936 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.0 ttmt . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.094 0.473 . . . . 0.0 110.244 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.2 mtpp -123.65 156.82 35.15 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.569 -0.707 . . . . 0.0 110.165 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -59.96 -26.09 65.72 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.522 -0.736 . . . . 0.0 110.421 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.2 mmt -83.78 -28.6 28.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.432 -0.793 . . . . 0.0 110.248 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -60.89 -28.25 68.75 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.553 -0.717 . . . . 0.0 110.265 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -71.43 -28.87 64.29 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.533 -0.729 . . . . 0.0 110.131 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -72.12 -29.26 63.89 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.653 -0.654 . . . . 0.0 110.039 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.2 ttt -70.54 -29.55 66.05 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.666 -0.646 . . . . 0.0 109.932 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.5 t -68.46 -29.09 67.64 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.604 -0.685 . . . . 0.0 110.016 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.831 HD12 HD23 ' B' ' 200' ' ' LEU . 4.5 tp -67.43 -28.37 67.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.648 -0.658 . . . . 0.0 110.087 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.71 -29.83 69.19 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.583 -0.698 . . . . 0.0 110.119 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -70.5 -46.13 64.3 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.623 -0.673 . . . . 0.0 109.886 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 21.0 m -62.93 -31.12 72.13 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.731 -0.606 . . . . 0.0 109.724 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -65.02 -28.27 69.38 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.628 -0.67 . . . . 0.0 109.93 179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -62.57 -39.75 94.68 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.609 -0.682 . . . . 0.0 110.104 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.4 tp60 -75.41 -30.69 60.15 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.6 -0.687 . . . . 0.0 109.632 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.418 HG12 HD22 ' B' ' 193' ' ' LEU . 73.7 mt -77.37 -27.04 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.785 -0.572 . . . . 0.0 109.712 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.1 mt -75.37 -32.69 60.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.458 -0.776 . . . . 0.0 109.826 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -31.62 70.41 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.567 -0.708 . . . . 0.0 109.822 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.672 HD22 HG12 ' B' ' 190' ' ' ILE . 5.3 mt -69.73 -28.96 66.25 Favored 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.898 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.28 -33.11 73.75 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.6 -0.688 . . . . 0.0 110.003 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -76.48 -33.23 58.68 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.557 -0.715 . . . . 0.0 109.71 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.8 tttt -75.35 -29.93 60.07 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.705 -0.622 . . . . 0.0 109.807 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.638 HD13 HD12 ' B' ' 190' ' ' ILE . 15.7 tp -77.22 -31.03 54.94 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.671 -0.643 . . . . 0.0 109.798 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mp -76.34 -33.57 58.97 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.642 -0.661 . . . . 0.0 109.634 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.92 -29.3 63.02 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.696 -0.627 . . . . 0.0 109.994 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.738 HD23 ' HA ' ' B' ' 183' ' ' ILE . 8.8 tp -75.14 -38.39 61.01 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.592 -0.693 . . . . 0.0 109.922 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.451 ' HG2' HG21 ' B' ' 183' ' ' ILE . 4.3 mm-40 -71.23 -29.69 65.43 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.734 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -69.99 -28.98 65.96 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.688 -0.632 . . . . 0.0 109.861 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -67.61 -43.04 81.42 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.522 -0.736 . . . . 0.0 109.863 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -62.3 -28.46 69.75 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.559 -0.713 . . . . 0.0 109.779 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -62.95 -31.86 73.05 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.619 -0.676 . . . . 0.0 109.875 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -40.04 94.61 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.675 -0.64 . . . . 0.0 109.9 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.702 HD23 HD21 ' B' ' 172' ' ' LEU . 2.9 mt -60.81 -35.5 76.65 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.629 -0.67 . . . . 0.0 110.127 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -61.3 -36.89 81.33 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.517 -0.739 . . . . 0.0 109.968 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mp -77.05 -29.17 55.06 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.703 -0.623 . . . . 0.0 109.684 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -95.18 -0.22 53.45 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.65 -0.656 . . . . 0.0 110.965 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.594 HD11 ' CD1' ' B' ' 173' ' ' ILE . 49.5 tp . . . . . 0 N--CA 1.498 1.964 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.245 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.559 HD12 ' N ' ' B' ' 168' ' ' SER . 1.3 pp -139.03 -48.73 0.5 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.624 -0.927 . . . . 0.0 110.753 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.559 ' N ' HD12 ' B' ' 167' ' ' LEU . 4.0 m -155.22 13.55 0.37 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.261 -0.9 . . . . 0.0 111.752 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 15.1 tptt 49.34 26.28 1.54 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.999 -1.063 . . . . 0.0 111.066 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -151.86 -47.26 0.11 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.684 -0.635 . . . . 0.0 109.829 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.38 -33.5 63.08 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.702 HD21 HD23 ' A' ' 86' ' ' LEU . 1.6 tt -75.56 -26.66 58.15 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.594 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.7 mm -69.4 -30.65 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.561 -0.712 . . . . 0.0 109.523 179.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -73.11 -28.57 62.34 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.714 -0.616 . . . . 0.0 110.15 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.709 ' O ' HG23 ' B' ' 179' ' ' VAL . 86.9 m-20 -74.86 -29.22 60.96 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.6 -0.687 . . . . 0.0 110.079 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -73.4 -29.96 62.95 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.581 -0.699 . . . . 0.0 109.921 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -77.25 -29.98 54.25 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.609 -0.682 . . . . 0.0 109.94 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.49 -31.13 47.63 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.646 -0.659 . . . . 0.0 109.787 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.709 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.0 t -77.96 -31.06 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.633 -0.667 . . . . 0.0 109.521 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -76.31 -29.0 57.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.654 -0.654 . . . . 0.0 109.811 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.38 -29.09 61.4 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.654 -0.654 . . . . 0.0 109.715 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -71.55 -31.4 66.97 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.579 -0.701 . . . . 0.0 110.039 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.738 ' HA ' HD23 ' A' ' 79' ' ' LEU . 83.9 mt -72.62 -29.64 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.628 -0.67 . . . . 0.0 109.706 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.4 -33.13 72.56 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.619 -0.675 . . . . 0.0 109.853 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 49.0 mtp -71.49 -45.76 61.61 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.589 -0.694 . . . . 0.0 109.768 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.1 t -71.57 -31.5 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.648 -0.658 . . . . 0.0 109.383 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . 0.457 ' HB2' HD11 ' A' ' 76' ' ' LEU . 10.7 tm-20 -74.51 -28.8 61.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.73 -0.606 . . . . 0.0 109.782 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -72.62 -29.72 63.72 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.558 -0.714 . . . . 0.0 110.044 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -36.43 65.71 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.683 -0.635 . . . . 0.0 109.935 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.672 HG12 HD22 ' A' ' 72' ' ' LEU . 75.6 mt -71.29 -31.05 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.639 -0.663 . . . . 0.0 109.573 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 3.2 m -67.77 -37.59 82.29 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.704 -0.623 . . . . 0.0 109.541 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -74.94 -32.46 61.76 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.622 -0.674 . . . . 0.0 109.4 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.477 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -71.39 -31.56 67.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.631 -0.668 . . . . 0.0 109.295 179.259 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 11.9 tptm -68.81 -46.3 69.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.629 -0.669 . . . . 0.0 109.407 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.67 -29.67 70.67 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 119.967 -0.693 . . . . 0.0 109.151 179.12 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -62.52 -36.55 82.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.604 -0.685 . . . . 0.0 109.208 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.15 -31.16 72.24 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -58.93 -42.78 90.54 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.684 -0.635 . . . . 0.0 109.986 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.64 -39.46 93.92 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.737 -0.602 . . . . 0.0 109.596 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.831 HD23 HD12 ' A' ' 62' ' ' LEU . 15.1 tp -74.41 -28.54 61.13 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.676 -0.64 . . . . 0.0 109.666 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -78.11 -30.47 49.5 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.544 -0.723 . . . . 0.0 109.906 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -78.04 -29.9 49.57 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.622 -0.674 . . . . 0.0 109.792 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -76.29 -27.86 56.79 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.656 -0.652 . . . . 0.0 110.037 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -76.18 -27.96 57.12 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.534 -0.729 . . . . 0.0 110.203 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -81.09 -34.19 32.82 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.483 -0.761 . . . . 0.0 110.148 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 5.6 mmtm 51.89 93.58 0.05 OUTLIER Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 121.376 -0.827 . . . . 0.0 110.878 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 C--N 1.316 -1.162 0 O-C-N 123.413 1.218 . . . . 0.0 110.374 -179.978 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.144 0.497 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.1 mtpp -95.9 -175.74 3.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.566 -0.709 . . . . 0.0 110.185 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -80.03 -29.49 39.34 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.537 -0.727 . . . . 0.0 110.178 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.8 ttt -88.24 -28.36 21.18 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.646 -0.659 . . . . 0.0 110.232 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -60.64 -28.44 68.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.582 -0.699 . . . . 0.0 110.242 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -66.78 -37.24 84.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.535 -0.728 . . . . 0.0 109.996 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -73.73 -31.38 63.34 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.589 -0.694 . . . . 0.0 109.772 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.2 mtp -74.54 -29.72 61.48 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.689 -0.632 . . . . 0.0 109.762 179.559 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.5 m -71.08 -29.49 65.36 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.664 -0.648 . . . . 0.0 109.825 179.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.542 HD12 HD23 ' B' ' 200' ' ' LEU . 1.0 OUTLIER -68.25 -29.37 68.16 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.697 -0.627 . . . . 0.0 109.999 179.737 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -73.86 -33.1 63.95 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.63 -0.669 . . . . 0.0 109.932 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -74.45 -38.82 62.87 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.66 -0.65 . . . . 0.0 109.752 179.648 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 58.5 m -71.85 -32.62 67.7 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.723 -0.611 . . . . 0.0 109.434 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -68.14 -29.45 68.36 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.581 179.406 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -63.0 -36.86 84.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.611 -0.681 . . . . 0.0 109.827 179.668 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -75.48 -34.69 60.91 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.466 179.501 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.432 HG12 HD22 ' B' ' 193' ' ' LEU . 83.1 mt -72.12 -28.57 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.734 -0.604 . . . . 0.0 109.397 179.274 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.8 tp -69.21 -40.45 78.0 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.589 -0.694 . . . . 0.0 109.748 179.583 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.23 -31.89 73.15 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.533 -0.729 . . . . 0.0 109.696 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.794 HD22 HG12 ' B' ' 190' ' ' ILE . 6.4 mt -69.69 -30.37 68.01 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.685 -0.634 . . . . 0.0 109.773 179.575 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -69.49 -34.24 74.05 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.598 -0.689 . . . . 0.0 109.758 179.631 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -75.25 -31.7 60.88 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.695 -0.628 . . . . 0.0 109.508 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.15 -30.53 66.57 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.523 179.546 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -74.05 -31.3 62.82 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.61 -0.681 . . . . 0.0 109.714 179.605 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 tp -73.26 -37.85 66.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.673 -0.642 . . . . 0.0 109.693 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.36 -30.9 70.83 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.602 179.483 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.619 HD12 HG12 ' B' ' 183' ' ' ILE . 0.5 OUTLIER -70.76 -46.31 63.19 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.676 -0.64 . . . . 0.0 109.639 179.529 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -66.18 -29.3 69.56 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.661 -0.649 . . . . 0.0 109.644 179.453 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -68.95 -30.27 68.68 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.661 -0.649 . . . . 0.0 109.788 179.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -69.93 -47.05 63.93 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.668 -0.645 . . . . 0.0 109.808 179.692 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.4 tttt -62.28 -29.87 70.73 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.522 -0.736 . . . . 0.0 109.603 179.441 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -62.98 -31.83 73.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.662 -0.649 . . . . 0.0 109.743 179.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -67.2 -32.09 72.92 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.661 -0.649 . . . . 0.0 109.744 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.543 HD23 ' CD2' ' B' ' 172' ' ' LEU . 0.5 OUTLIER -67.57 -31.62 71.82 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.6 -0.687 . . . . 0.0 109.755 179.687 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -62.36 -35.45 79.18 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.615 -0.678 . . . . 0.0 109.88 179.659 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.44 -30.5 64.65 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.671 -0.643 . . . . 0.0 109.696 179.569 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.471 ' O ' HD13 ' B' ' 172' ' ' LEU . 18.8 mt-30 -88.72 -18.51 27.69 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.647 -0.658 . . . . 0.0 110.519 179.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.603 HD11 HD11 ' B' ' 173' ' ' ILE . 32.8 tp . . . . . 0 N--CA 1.501 2.097 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.646 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . 0.557 ' HA2' HD12 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.34 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' B' ' 171' ' ' GLU . 0.4 OUTLIER -109.96 -62.51 1.5 Allowed 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.63 -0.923 . . . . 0.0 109.088 179.975 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 6.2 t -154.41 35.99 0.42 Allowed 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.315 0.579 . . . . 0.0 109.528 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 5.9 tptm 51.87 26.07 3.39 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.524 -0.735 . . . . 0.0 110.118 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -147.61 -45.39 0.17 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.707 -0.621 . . . . 0.0 109.962 -179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.696 ' HB3' HD22 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -64.68 -30.27 71.28 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 119.618 -0.833 . . . . 0.0 109.2 179.39 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.557 HD12 ' HA2' ' B' ' 166' ' ' GLY . 0.3 OUTLIER -81.65 -27.53 34.06 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.63 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.603 HD11 HD11 ' A' ' 90' ' ' LEU . 49.9 mm -69.93 -30.82 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.753 -0.592 . . . . 0.0 109.498 179.428 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.95 -30.31 66.56 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.636 -0.665 . . . . 0.0 109.946 179.77 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.77 ' O ' HG23 ' B' ' 179' ' ' VAL . 94.6 m-20 -76.83 -29.25 55.84 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.623 -0.673 . . . . 0.0 109.871 179.59 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.449 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -75.63 -28.31 58.76 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.653 -0.654 . . . . 0.0 110.056 179.761 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.75 -32.22 57.61 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.583 -0.698 . . . . 0.0 110.057 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -75.22 -29.99 60.46 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.611 -0.681 . . . . 0.0 109.889 179.711 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.77 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.9 t -73.75 -29.43 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.646 -0.659 . . . . 0.0 109.717 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.42 -29.21 65.76 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.558 -0.714 . . . . 0.0 110.029 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 -74.36 -28.9 61.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.602 -0.686 . . . . 0.0 110.118 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . 0.436 ' O ' HG23 ' B' ' 186' ' ' VAL . 9.0 tt0 -75.73 -34.34 60.32 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.533 -0.73 . . . . 0.0 110.155 179.954 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.619 HG12 HD12 ' A' ' 79' ' ' LEU . 83.4 mt -74.0 -29.07 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.628 -0.67 . . . . 0.0 109.768 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 3.6 m -73.92 -33.92 64.15 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.613 -0.68 . . . . 0.0 109.714 179.549 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.28 -39.2 78.52 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.664 -0.648 . . . . 0.0 109.77 179.662 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . 0.436 HG23 ' O ' ' B' ' 182' ' ' GLU . 57.6 t -70.66 -29.89 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.673 -0.642 . . . . 0.0 109.598 179.612 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -71.17 -28.63 64.38 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.603 -0.685 . . . . 0.0 110.07 179.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -69.72 -33.96 73.22 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.562 -0.711 . . . . 0.0 109.995 179.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -37.93 62.17 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.64 -0.663 . . . . 0.0 109.702 179.74 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.794 HG12 HD22 ' A' ' 72' ' ' LEU . 78.7 mt -73.29 -28.91 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.659 -0.651 . . . . 0.0 109.683 179.629 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 23.5 p -73.39 -34.76 65.7 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.571 -0.706 . . . . 0.0 109.759 179.504 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -77.36 -33.02 55.38 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.611 -0.681 . . . . 0.0 109.473 179.399 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.584 HD13 ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -74.4 -30.42 61.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.712 -0.617 . . . . 0.0 109.387 179.353 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.0 tptm -68.42 -36.57 79.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.595 -0.691 . . . . 0.0 109.528 179.483 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 8.5 tptp -68.49 -30.25 69.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.663 -0.648 . . . . 0.0 109.547 179.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -35.63 81.24 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.612 -0.68 . . . . 0.0 109.484 179.525 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -63.4 -30.74 71.82 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.747 -0.596 . . . . 0.0 109.8 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.97 -41.73 98.34 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.71 -0.619 . . . . 0.0 109.91 179.71 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -61.99 -45.76 92.2 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.741 -0.599 . . . . 0.0 109.969 179.756 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.542 HD23 HD12 ' A' ' 62' ' ' LEU . 4.4 tp -70.32 -32.84 70.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.621 -0.674 . . . . 0.0 109.716 179.586 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -76.34 -29.32 57.2 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.678 -0.639 . . . . 0.0 109.895 179.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -77.01 -28.27 54.92 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.587 -0.696 . . . . 0.0 110.026 179.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -78.45 -29.25 46.85 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.546 -0.721 . . . . 0.0 109.985 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -79.74 -27.41 40.57 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.592 -0.693 . . . . 0.0 110.132 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.68 -22.66 29.72 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.593 -0.692 . . . . 0.0 110.412 179.886 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.42 147.37 59.41 Favored Pre-proline 0 N--CA 1.498 1.94 0 O-C-N 121.355 -0.841 . . . . 0.0 110.385 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo . . . . . 0 C--N 1.317 -1.087 0 O-C-N 123.343 1.18 . . . . 0.0 110.366 -179.952 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.148 0.499 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.6 mptt -81.68 170.69 15.49 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.553 -0.717 . . . . 0.0 110.23 179.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -100.06 -24.32 14.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.626 -0.671 . . . . 0.0 110.444 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.1 -32.57 63.28 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.437 -0.789 . . . . 0.0 110.102 179.92 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -63.39 -25.59 68.35 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.61 -0.681 . . . . 0.0 110.329 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -73.51 -28.56 61.96 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.512 -0.742 . . . . 0.0 110.128 179.785 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 ttt-85 -69.71 -31.62 69.73 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.642 -0.661 . . . . 0.0 110.054 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.3 -45.01 64.07 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.628 -0.67 . . . . 0.0 109.735 179.791 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.31 -27.97 68.98 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 120.244 -0.582 . . . . 0.0 109.84 179.6 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.541 HD11 ' HA ' ' B' ' 201' ' ' GLU . 0.3 OUTLIER -69.78 -28.87 66.11 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.566 -0.709 . . . . 0.0 110.113 179.858 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -72.94 -33.15 65.75 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.578 -0.701 . . . . 0.0 110.1 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -75.84 -30.03 58.8 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.653 -0.654 . . . . 0.0 109.908 179.762 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.487 HG23 ' NZ ' ' B' ' 196' ' ' LYS . 88.2 m -75.84 -29.59 58.67 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.654 -0.654 . . . . 0.0 109.875 179.621 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -73.83 -26.7 60.73 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.575 -0.703 . . . . 0.0 110.162 179.68 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.86 -33.28 62.08 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.597 -0.689 . . . . 0.0 110.133 -179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -76.38 -37.29 57.41 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.661 -0.649 . . . . 0.0 109.698 179.727 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.694 HG12 HD23 ' B' ' 193' ' ' LEU . 84.3 mt -72.6 -26.82 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.719 -0.613 . . . . 0.0 109.62 179.399 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.5 mt -72.91 -36.51 67.29 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.541 -0.724 . . . . 0.0 109.734 179.587 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -71.18 -31.06 67.2 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.611 -0.68 . . . . 0.0 109.718 179.605 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.41 HD22 HG12 ' B' ' 190' ' ' ILE . 5.0 mt -69.37 -30.57 68.59 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.774 -0.579 . . . . 0.0 109.831 179.667 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -69.21 -31.32 69.84 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.602 -0.686 . . . . 0.0 109.847 179.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.52 -32.73 54.26 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.603 -0.686 . . . . 0.0 109.626 179.583 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -76.06 -33.19 59.58 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.695 -0.628 . . . . 0.0 109.58 179.581 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.487 HD21 ' HG3' ' B' ' 187' ' ' GLU . 14.7 tp -74.96 -30.16 61.13 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.676 -0.64 . . . . 0.0 109.734 179.549 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.46 HD23 ' O ' ' A' ' 77' ' ' LEU . 2.8 tt -75.43 -36.2 60.82 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.667 -0.646 . . . . 0.0 109.71 179.562 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.72 -30.72 67.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.677 -0.639 . . . . 0.0 109.735 179.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.776 HD23 ' HA ' ' B' ' 183' ' ' ILE . 7.2 tp -69.32 -37.27 77.66 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.696 -0.628 . . . . 0.0 109.709 179.619 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -71.65 -30.09 65.35 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.598 -0.689 . . . . 0.0 109.639 179.359 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.52 -29.91 67.63 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.578 -0.701 . . . . 0.0 109.855 179.555 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.62 -42.8 81.76 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.634 -0.666 . . . . 0.0 109.885 179.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.53 ' HD3' HD12 ' B' ' 183' ' ' ILE . 3.3 ttpp -62.03 -29.61 70.4 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.555 -0.716 . . . . 0.0 109.769 179.596 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -62.48 -32.17 73.02 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.737 -0.602 . . . . 0.0 109.874 179.713 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -68.75 -37.7 79.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.639 -0.663 . . . . 0.0 109.714 179.68 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.701 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.3 OUTLIER -64.08 -30.08 71.17 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.678 -0.639 . . . . 0.0 109.711 179.668 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -62.47 -36.1 81.41 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.626 -0.671 . . . . 0.0 109.824 179.794 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.72 -28.86 69.72 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.638 -0.664 . . . . 0.0 110.007 179.703 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -87.68 -23.98 24.03 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.542 -0.723 . . . . 0.0 110.418 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.574 HD13 ' HE3' ' B' ' 176' ' ' MET . 29.4 tp . . . . . 0 N--CA 1.5 2.034 0 CA-C-O 118.018 -0.991 . . . . 0.0 110.575 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.8 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.4 OUTLIER -109.07 -61.98 1.54 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.561 -0.964 . . . . 0.0 109.01 179.897 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 93.7 p -155.27 35.41 0.38 Allowed 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 121.381 0.61 . . . . 0.0 109.451 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 4.8 tptm 51.88 26.16 3.46 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.526 -0.734 . . . . 0.0 110.146 -178.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -148.4 -44.84 0.15 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.679 -0.638 . . . . 0.0 109.916 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.691 ' HB3' HD22 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -63.89 -30.4 71.49 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 119.612 -0.835 . . . . 0.0 109.27 179.514 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.8 ' HG ' HD11 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -83.48 -28.88 28.43 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 178.567 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.553 HD11 HD11 ' A' ' 90' ' ' LEU . 51.0 mm -68.07 -30.96 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.058 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -70.3 -29.96 66.84 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.675 -0.641 . . . . 0.0 109.903 179.617 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.666 ' O ' HG23 ' B' ' 179' ' ' VAL . 56.4 m-20 -77.45 -32.96 54.83 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.618 -0.676 . . . . 0.0 109.771 179.683 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.701 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -75.68 -30.25 59.31 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.675 -0.641 . . . . 0.0 109.746 179.595 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -76.57 -30.53 57.07 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.634 -0.666 . . . . 0.0 109.859 179.767 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -77.43 -33.85 54.79 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.628 -0.67 . . . . 0.0 109.799 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.666 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.5 t -76.84 -30.65 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.632 -0.668 . . . . 0.0 109.476 179.497 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -75.41 -29.25 59.7 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.656 -0.653 . . . . 0.0 109.865 179.503 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -29.64 62.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.609 -0.682 . . . . 0.0 109.992 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -75.06 -33.18 61.68 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.601 -0.687 . . . . 0.0 109.984 179.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.776 ' HA ' HD23 ' A' ' 79' ' ' LEU . 89.2 mt -72.25 -30.05 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.66 -0.65 . . . . 0.0 109.739 179.698 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.63 -35.13 72.76 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.669 -0.644 . . . . 0.0 109.789 179.556 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.5 ttt -67.55 -41.84 83.6 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.567 -0.708 . . . . 0.0 109.802 179.618 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.5 t -70.79 -30.41 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.674 -0.641 . . . . 0.0 109.638 179.629 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . 0.487 ' HG3' HD21 ' A' ' 76' ' ' LEU . 4.0 tt0 -74.0 -29.9 62.2 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.584 -0.698 . . . . 0.0 109.964 179.697 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -72.36 -29.68 64.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.52 -0.738 . . . . 0.0 109.918 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.48 -38.69 65.31 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.677 -0.64 . . . . 0.0 109.843 179.774 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.421 HD12 HD22 ' A' ' 76' ' ' LEU . 76.0 mt -70.82 -30.5 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.745 -0.597 . . . . 0.0 109.616 179.722 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.6 m -71.09 -36.72 72.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.649 -0.657 . . . . 0.0 109.603 179.557 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 16.5 mmtm -74.88 -31.95 61.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.642 -0.661 . . . . 0.0 109.584 179.478 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.694 HD23 HG12 ' A' ' 69' ' ' ILE . 0.3 OUTLIER -78.62 -14.42 59.33 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.694 -0.629 . . . . 0.0 110.438 179.358 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.7 tptp -87.65 -28.27 21.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.236 -0.915 . . . . 0.0 109.404 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.16 -34.92 56.39 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.583 -0.698 . . . . 0.0 109.753 179.523 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.487 ' NZ ' HG23 ' A' ' 65' ' ' THR . 0.0 OUTLIER -69.67 -27.62 65.18 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 119.785 -0.766 . . . . 0.0 109.538 179.454 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -69.29 -29.77 67.71 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.54 -0.725 . . . . 0.0 109.458 179.174 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -61.19 -43.58 98.65 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.705 -0.622 . . . . 0.0 109.707 179.52 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -61.58 -34.05 74.94 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.746 -0.596 . . . . 0.0 109.616 179.369 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 23.5 tp -78.12 -31.97 50.19 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.541 ' HA ' HD11 ' A' ' 62' ' ' LEU . 4.1 mm-40 -78.4 -32.43 48.74 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.715 -0.615 . . . . 0.0 109.581 179.447 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -76.8 -29.62 56.08 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.787 -0.57 . . . . 0.0 109.707 179.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -74.19 -28.34 61.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.65 -0.656 . . . . 0.0 109.882 179.478 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -72.27 -26.61 62.05 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.635 -0.665 . . . . 0.0 110.185 179.832 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -86.1 -28.91 23.74 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.518 -0.739 . . . . 0.0 110.15 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 8.7 mttp -60.69 111.28 3.85 Favored Pre-proline 0 N--CA 1.495 1.819 0 O-C-N 121.612 -0.68 . . . . 0.0 110.179 179.969 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 N--CA 1.486 1.086 0 O-C-N 123.218 1.115 . . . . 0.0 110.394 179.989 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.1 0.476 . . . . 0.0 110.321 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -165.66 -172.36 2.38 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.562 -0.712 . . . . 0.0 110.146 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -89.55 -29.22 19.06 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.64 -0.662 . . . . 0.0 110.247 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -28.87 22.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.618 -0.676 . . . . 0.0 110.211 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -66.66 -28.65 68.63 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.555 -0.715 . . . . 0.0 110.121 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -69.56 -27.87 65.5 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.585 -0.697 . . . . 0.0 110.231 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.6 mtt180 -75.51 -30.55 59.86 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.518 -0.739 . . . . 0.0 110.069 -179.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.2 mtp -74.57 -31.64 62.14 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.656 -0.653 . . . . 0.0 109.911 179.824 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.8 m -71.26 -29.51 65.17 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.634 -0.666 . . . . 0.0 109.84 179.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.604 HD11 ' HG2' ' B' ' 201' ' ' GLU . 2.3 tt -67.95 -29.31 68.33 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.683 -0.635 . . . . 0.0 109.89 179.719 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -64.52 -35.69 81.79 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.573 -0.705 . . . . 0.0 109.9 179.888 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -73.7 -35.43 65.15 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.582 -0.699 . . . . 0.0 109.794 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.437 HG21 ' NZ ' ' B' ' 196' ' ' LYS . 86.6 m -71.72 -31.32 66.58 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.741 -0.6 . . . . 0.0 109.604 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -68.07 -28.34 67.28 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.725 -0.609 . . . . 0.0 109.89 179.625 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -65.99 -34.73 78.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.59 -0.694 . . . . 0.0 110.006 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.6 tp60 -77.64 -31.71 52.87 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.679 -0.638 . . . . 0.0 109.64 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.596 HG12 HD22 ' B' ' 193' ' ' LEU . 82.0 mt -77.01 -28.8 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.732 -0.605 . . . . 0.0 109.562 179.496 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 25.4 tp -74.35 -33.89 63.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.598 -0.689 . . . . 0.0 109.632 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -29.94 70.0 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.574 -0.704 . . . . 0.0 109.745 179.626 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.594 HD11 HD13 ' B' ' 193' ' ' LEU . 14.2 mt -65.02 -30.98 72.0 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.642 -0.661 . . . . 0.0 110.046 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.98 -38.87 92.66 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.565 -0.709 . . . . 0.0 110.004 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -73.9 -31.76 63.26 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.548 179.574 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -76.07 -34.96 59.57 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.706 -0.621 . . . . 0.0 109.663 179.58 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.702 ' O ' HD13 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -74.57 -30.65 61.8 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.58 -0.7 . . . . 0.0 109.607 179.464 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.55 HD23 ' O ' ' A' ' 77' ' ' LEU . 5.9 tt -74.39 -34.69 63.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.634 -0.666 . . . . 0.0 109.726 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.37 69.56 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.676 -0.64 . . . . 0.0 109.723 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 79' ' ' LEU . 1.8 mm? -72.16 -43.17 65.02 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.617 -0.677 . . . . 0.0 109.756 179.709 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -67.62 -29.05 68.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.684 -0.635 . . . . 0.0 109.872 179.486 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -70.1 -30.01 67.11 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.583 -0.698 . . . . 0.0 109.847 179.671 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -69.63 -45.65 68.0 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.599 -0.688 . . . . 0.0 109.711 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -61.87 -27.63 68.93 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.531 -0.731 . . . . 0.0 109.606 179.204 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -62.57 -30.01 71.01 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.592 -0.693 . . . . 0.0 109.771 179.561 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -61.34 -43.93 98.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.535 -0.728 . . . . 0.0 109.856 179.685 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.606 HD23 HD21 ' B' ' 172' ' ' LEU . 0.4 OUTLIER -63.74 -33.65 76.13 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.703 -0.623 . . . . 0.0 109.394 179.436 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -62.03 -35.14 77.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.685 -0.634 . . . . 0.0 109.872 179.817 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.68 -27.17 69.05 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.981 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -106.33 12.73 29.55 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.62 -0.675 . . . . 0.0 110.803 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 58.8 tp . . . . . 0 N--CA 1.499 1.983 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.12 -179.866 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.738 HD12 ' N ' ' B' ' 168' ' ' SER . 2.5 pp -140.43 -46.05 0.42 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.616 -0.932 . . . . 0.0 110.501 -179.808 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.738 ' N ' HD12 ' B' ' 167' ' ' LEU . 38.6 m -153.93 13.99 0.46 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.285 -0.884 . . . . 0.0 111.466 179.925 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 24.3 tptp 49.31 26.6 1.62 Allowed 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.085 -1.01 . . . . 0.0 111.02 -179.825 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -151.4 -47.43 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.735 -0.603 . . . . 0.0 109.738 179.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.453 ' CB ' HD11 ' B' ' 167' ' ' LEU . 2.5 mm-40 -74.01 -35.28 64.39 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.27 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.606 HD21 HD23 ' A' ' 86' ' ' LEU . 0.9 OUTLIER -77.12 -29.72 54.89 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.774 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 51.0 mm -69.51 -29.98 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.393 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -74.1 -31.46 62.81 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.651 -0.656 . . . . 0.0 109.852 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -74.57 -32.76 62.5 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.658 -0.651 . . . . 0.0 109.837 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -29.4 64.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.729 -0.607 . . . . 0.0 109.772 179.523 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.18 -29.76 66.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.557 -0.715 . . . . 0.0 110.054 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 8.0 mtm180 -73.28 -37.08 66.39 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.679 -0.638 . . . . 0.0 109.936 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 59.2 t -73.57 -31.46 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.654 -0.654 . . . . 0.0 109.479 179.594 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -72.2 -29.19 63.74 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.712 -0.617 . . . . 0.0 109.919 179.592 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.52 -31.98 70.53 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.592 -0.692 . . . . 0.0 109.947 179.768 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.06 -35.06 66.63 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.666 -0.646 . . . . 0.0 109.926 179.779 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 86.0 mt -69.51 -30.24 44.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.545 179.6 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.91 -30.98 71.66 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.636 -0.665 . . . . 0.0 109.808 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.6 mtt -68.5 -50.24 53.72 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.685 -0.634 . . . . 0.0 109.843 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -68.21 -30.89 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.578 -0.701 . . . . 0.0 109.564 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -75.23 -28.4 59.88 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.655 -0.653 . . . . 0.0 109.94 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -74.15 -28.89 61.53 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.564 -0.71 . . . . 0.0 110.036 179.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.03 -36.6 64.43 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.545 -0.722 . . . . 0.0 109.97 179.801 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.59 HG12 HD22 ' A' ' 72' ' ' LEU . 84.0 mt -68.99 -30.48 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.669 -0.644 . . . . 0.0 109.668 179.698 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.7 m -68.37 -40.94 81.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.63 -0.669 . . . . 0.0 109.559 179.513 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt -73.31 -33.44 65.17 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.682 -0.636 . . . . 0.0 109.4 179.426 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.596 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -72.37 -30.44 64.7 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.701 -0.625 . . . . 0.0 109.398 179.322 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 3.4 tppt? -69.75 -42.42 73.9 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.644 -0.66 . . . . 0.0 109.727 179.587 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.41 -31.83 73.19 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.561 -0.712 . . . . 0.0 109.383 179.493 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.437 ' NZ ' HG21 ' A' ' 65' ' ' THR . 2.0 ttpp -63.75 -37.12 86.16 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.697 -0.627 . . . . 0.0 109.452 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -62.28 -29.9 70.75 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.763 -0.586 . . . . 0.0 109.767 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -61.97 -44.97 95.62 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.707 -0.62 . . . . 0.0 109.886 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -63.1 -37.9 89.06 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.698 -0.626 . . . . 0.0 109.82 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.4 tp -73.22 -36.22 66.44 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.612 -0.68 . . . . 0.0 109.719 179.696 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.604 ' HG2' HD11 ' A' ' 62' ' ' LEU . 6.1 mt-10 -76.33 -30.62 57.75 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.599 -0.688 . . . . 0.0 109.76 179.639 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -78.64 -29.85 46.06 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.591 -0.693 . . . . 0.0 109.702 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.7 -28.2 55.8 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.628 -0.67 . . . . 0.0 109.952 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -76.0 -26.61 56.89 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.636 -0.665 . . . . 0.0 110.192 179.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -85.63 -26.14 26.22 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.55 -0.719 . . . . 0.0 110.263 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -59.9 166.52 3.51 Favored Pre-proline 0 N--CA 1.496 1.873 0 O-C-N 121.501 -0.749 . . . . 0.0 110.22 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo . . . . . 0 C--N 1.318 -1.073 0 O-C-N 123.369 1.194 . . . . 0.0 110.407 179.976 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.182 0.515 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.8 ptpt -62.87 -164.33 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.545 -0.722 . . . . 0.0 110.171 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 53.51 27.9 7.08 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.33 -0.856 . . . . 0.0 110.73 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.1 mtp -145.79 -53.25 0.26 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.551 -0.718 . . . . 0.0 110.141 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -60.98 -28.0 68.69 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.684 -0.635 . . . . 0.0 110.039 179.762 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -69.6 -29.43 66.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.672 -0.643 . . . . 0.0 109.928 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -66.06 -41.72 90.41 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.604 -0.685 . . . . 0.0 109.973 179.716 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.7 mtm -71.84 -30.84 65.89 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.585 -0.697 . . . . 0.0 109.631 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.65 -28.28 63.65 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.745 -0.597 . . . . 0.0 109.767 179.377 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.808 HD11 ' HG2' ' B' ' 201' ' ' GLU . 7.6 tt -68.06 -29.32 68.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.61 -0.681 . . . . 0.0 110.019 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -66.45 -39.33 88.79 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.6 -0.688 . . . . 0.0 109.93 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -71.95 -29.88 64.73 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.729 -0.607 . . . . 0.0 109.811 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 74.9 m -73.06 -29.77 63.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.625 -0.672 . . . . 0.0 109.884 179.658 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.79 -27.47 63.93 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.568 -0.707 . . . . 0.0 110.1 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -76.11 -28.1 57.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.508 -0.745 . . . . 0.0 110.235 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 72.8 tp60 -77.7 -33.24 53.24 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.566 -0.709 . . . . 0.0 109.852 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.62 HG12 HD22 ' B' ' 193' ' ' LEU . 68.1 mt -74.12 -28.42 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.718 -0.613 . . . . 0.0 109.577 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.24 -37.22 66.44 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.547 -0.72 . . . . 0.0 109.647 179.537 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.9 tptt -62.8 -29.58 70.82 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.535 -0.728 . . . . 0.0 109.633 179.443 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.629 HD22 HG12 ' B' ' 190' ' ' ILE . 10.9 mt -61.47 -29.6 70.07 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.684 -0.635 . . . . 0.0 109.903 179.593 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.2 -38.55 89.57 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.6 -0.688 . . . . 0.0 109.719 179.603 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.04 -31.68 58.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.636 -0.665 . . . . 0.0 109.268 179.259 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -75.38 -31.97 60.65 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.763 -0.585 . . . . 0.0 109.702 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.439 HD13 HD12 ' B' ' 190' ' ' ILE . 22.3 tp -76.36 -31.41 58.05 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.606 -0.684 . . . . 0.0 109.647 179.469 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 tp -74.81 -33.95 62.29 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 120.263 -0.575 . . . . 0.0 109.61 179.485 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.4 -31.42 69.77 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.721 -0.612 . . . . 0.0 109.735 179.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.405 ' HA ' HD13 ' A' ' 79' ' ' LEU . 1.2 mm? -70.34 -44.01 69.04 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.678 -0.639 . . . . 0.0 109.668 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.441 ' NE2' HG21 ' B' ' 183' ' ' ILE . 32.7 mm-40 -66.42 -30.5 70.87 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.715 179.505 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -67.77 -31.7 71.77 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.682 -0.636 . . . . 0.0 109.779 179.709 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.07 -44.72 88.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.614 -0.679 . . . . 0.0 109.636 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.3 tttm -64.05 -28.82 70.05 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 120.044 -0.662 . . . . 0.0 109.543 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -65.78 -28.69 69.2 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.689 -0.632 . . . . 0.0 110.118 179.749 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -37.51 78.62 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.526 -0.734 . . . . 0.0 109.748 179.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.561 HD23 ' CD1' ' B' ' 172' ' ' LEU . 2.6 mt -62.87 -29.06 70.46 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.663 -0.648 . . . . 0.0 109.845 179.635 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -62.14 -42.32 99.13 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.5 -0.75 . . . . 0.0 109.508 179.64 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.86 -30.58 69.12 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-O 121.382 0.61 . . . . 0.0 109.515 179.152 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -85.9 -19.54 30.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.675 -0.641 . . . . 0.0 110.53 179.565 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.823 HD11 HD11 ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.03 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.712 -179.815 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.872 HD13 ' CB ' ' B' ' 171' ' ' GLU . 0.1 OUTLIER -131.19 -63.17 0.86 Allowed 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.616 -0.932 . . . . 0.0 109.158 179.95 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 4.2 m -144.56 37.08 1.2 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 121.343 0.592 . . . . 0.0 109.559 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 17.0 tptt 51.92 25.74 3.25 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.483 -0.761 . . . . 0.0 110.17 -179.009 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -146.7 -45.11 0.18 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.661 -0.649 . . . . 0.0 109.953 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.872 ' CB ' HD13 ' B' ' 167' ' ' LEU . 5.3 mm-40 -64.62 -32.43 74.08 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.554 -0.859 . . . . 0.0 109.148 179.399 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.654 HD23 HD11 ' B' ' 167' ' ' LEU . 0.1 OUTLIER -80.35 -28.35 38.09 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.583 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.823 HD11 HD11 ' A' ' 90' ' ' LEU . 47.2 mm -73.9 -30.7 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.641 -0.662 . . . . 0.0 109.623 179.698 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -73.69 -29.26 62.18 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.619 -0.676 . . . . 0.0 110.13 179.897 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.5 ' O ' HG23 ' B' ' 179' ' ' VAL . 42.6 m-20 -73.35 -27.54 61.55 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.603 -0.685 . . . . 0.0 110.204 179.875 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.799 ' HE3' HD23 ' A' ' 90' ' ' LEU . 1.2 mtt -74.51 -28.94 61.21 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.553 -0.717 . . . . 0.0 110.276 179.95 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.77 -28.42 55.67 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.577 -0.702 . . . . 0.0 110.163 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 8.4 ttp180 -77.93 -34.45 51.24 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.595 -0.69 . . . . 0.0 109.918 179.861 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 175' ' ' ASN . 84.2 t -73.58 -29.17 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.671 -0.643 . . . . 0.0 109.479 179.445 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -68.82 -29.56 67.93 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.69 -0.631 . . . . 0.0 109.919 179.592 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 30.8 mtp180 -75.39 -27.78 59.21 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.59 -0.694 . . . . 0.0 109.969 179.681 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -75.49 -34.27 60.85 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.557 -0.715 . . . . 0.0 110.064 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.441 HG21 ' NE2' ' A' ' 80' ' ' GLN . 88.1 mt -71.49 -28.76 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.824 179.675 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -33.53 71.94 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.584 -0.697 . . . . 0.0 109.771 179.555 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 5.0 ttm -69.53 -45.49 68.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.651 -0.656 . . . . 0.0 109.856 179.794 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 61.6 t -70.18 -31.03 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.609 -0.682 . . . . 0.0 109.611 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -74.91 -28.98 60.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.672 -0.643 . . . . 0.0 109.876 179.598 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -73.3 -28.94 62.38 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.607 -0.683 . . . . 0.0 110.001 179.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -35.55 65.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.662 -0.649 . . . . 0.0 110.013 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.629 HG12 HD22 ' A' ' 72' ' ' LEU . 77.2 mt -70.57 -29.76 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.628 -0.67 . . . . 0.0 109.834 179.931 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.12 -39.66 68.67 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.672 -0.643 . . . . 0.0 109.791 179.664 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -73.92 -30.81 62.77 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.598 -0.689 . . . . 0.0 109.487 179.481 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.626 HD13 HD11 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -72.11 -31.03 65.66 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.614 -0.679 . . . . 0.0 109.38 179.282 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -46.63 66.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.602 -0.686 . . . . 0.0 109.456 179.411 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -68.03 -31.54 71.28 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.597 -0.689 . . . . 0.0 109.203 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.41 ' HE2' HD23 ' B' ' 193' ' ' LEU . 15.3 ttpt -65.7 -33.34 75.66 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.703 -0.623 . . . . 0.0 109.436 179.267 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 19.3 tp60 -65.16 -29.98 70.86 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.751 -0.593 . . . . 0.0 109.707 179.544 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -62.83 -42.5 99.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.65 -0.656 . . . . 0.0 109.916 179.743 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -61.13 -45.46 94.57 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.67 -0.644 . . . . 0.0 109.927 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 13.4 tp -72.2 -30.14 64.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.581 -0.7 . . . . 0.0 109.673 179.638 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.808 ' HG2' HD11 ' A' ' 62' ' ' LEU . 6.0 mt-10 -79.15 -30.63 43.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.622 -0.674 . . . . 0.0 109.725 179.587 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -78.82 -30.28 45.23 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.72 -0.613 . . . . 0.0 109.701 179.547 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -76.85 -29.48 55.89 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.66 -0.65 . . . . 0.0 109.66 179.401 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -72.0 -29.74 64.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.656 -0.653 . . . . 0.0 109.765 179.569 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -113.86 26.32 10.44 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.619 -0.675 . . . . 0.0 110.184 179.738 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 11.5 tptt -80.85 135.29 52.15 Favored Pre-proline 0 N--CA 1.494 1.774 0 O-C-N 121.434 -0.791 . . . . 0.0 110.096 179.988 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo . . . . . 0 C--N 1.318 -1.037 0 O-C-N 123.195 1.103 . . . . 0.0 110.405 179.936 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.115 0.484 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.2 mttt -136.47 159.44 41.78 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.65 -0.656 . . . . 0.0 110.185 -179.953 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -65.89 -23.99 66.76 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.662 -0.649 . . . . 0.0 110.488 179.978 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.9 ttm -76.0 -28.3 57.75 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.555 -0.716 . . . . 0.0 110.306 -179.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -63.07 -29.63 70.97 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.573 -0.705 . . . . 0.0 110.118 -179.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.07 -28.66 64.51 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.599 -0.688 . . . . 0.0 110.071 179.84 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -69.55 -29.27 66.81 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.588 -0.695 . . . . 0.0 110.08 179.874 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -67.35 -37.08 82.67 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.54 -0.725 . . . . 0.0 109.954 179.84 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 53.6 p -69.5 -29.81 67.53 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.67 -0.643 . . . . 0.0 109.735 179.612 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.598 HD11 ' OE1' ' B' ' 197' ' ' GLN . 4.1 tp -68.53 -28.91 67.41 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.59 -0.694 . . . . 0.0 109.973 179.632 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.29 -38.79 88.58 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.552 -0.717 . . . . 0.0 110.035 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -73.44 -36.41 65.92 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.725 -0.609 . . . . 0.0 109.704 179.575 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.629 HG21 ' NZ ' ' B' ' 196' ' ' LYS . 90.8 m -74.06 -31.03 62.69 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.697 -0.627 . . . . 0.0 109.517 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -70.88 -26.67 63.35 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.677 -0.639 . . . . 0.0 109.965 179.51 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -69.11 -35.61 76.61 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.554 -0.716 . . . . 0.0 110.206 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -75.95 -37.06 59.05 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.551 -0.718 . . . . 0.0 109.681 179.665 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.443 HG12 HD22 ' B' ' 193' ' ' LEU . 90.1 mt -71.96 -26.61 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.692 -0.63 . . . . 0.0 109.603 179.256 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.4 tt -70.73 -37.21 73.47 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.493 -0.755 . . . . 0.0 109.884 179.591 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -67.85 -38.04 82.64 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.613 -0.679 . . . . 0.0 109.688 179.649 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.632 HD22 ' CG1' ' B' ' 190' ' ' ILE . 5.4 mt -63.95 -29.6 70.75 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.733 -0.604 . . . . 0.0 109.898 179.714 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.454 ' O ' HD23 ' A' ' 77' ' ' LEU . 2.9 mt-10 -65.22 -38.34 90.12 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.645 -0.659 . . . . 0.0 109.798 179.767 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -73.36 -32.87 64.76 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.383 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.9 tttt -69.76 -36.37 75.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.68 -0.638 . . . . 0.0 109.593 179.529 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.401 HD13 HD12 ' B' ' 190' ' ' ILE . 32.1 tp -70.39 -30.01 66.79 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.626 -0.671 . . . . 0.0 109.731 179.421 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 73' ' ' GLU . 1.9 mm? -73.29 -37.76 66.13 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.716 -0.615 . . . . 0.0 109.727 179.625 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.16 -30.26 70.19 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.716 -0.615 . . . . 0.0 109.826 179.675 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.767 HD23 ' HA ' ' B' ' 183' ' ' ILE . 3.3 mp -70.99 -43.79 67.27 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.687 -0.633 . . . . 0.0 109.829 179.863 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -66.2 -29.59 69.88 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.618 -0.676 . . . . 0.0 109.785 179.755 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -68.78 -30.5 69.1 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.572 -0.705 . . . . 0.0 109.77 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -48.72 56.81 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.635 -0.666 . . . . 0.0 109.777 179.729 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -63.69 -30.34 71.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.556 -0.715 . . . . 0.0 109.591 179.462 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -65.59 -34.6 78.62 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.676 -0.64 . . . . 0.0 109.817 179.613 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.444 ' HA ' HD12 ' A' ' 88' ' ' LEU . 29.8 tp60 -67.25 -37.76 84.05 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.725 -0.609 . . . . 0.0 109.713 179.61 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.635 HD23 HD21 ' B' ' 172' ' ' LEU . 1.3 mt -62.3 -38.45 89.44 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.646 -0.659 . . . . 0.0 109.762 179.66 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -60.9 -42.58 98.29 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.544 -0.722 . . . . 0.0 109.963 179.917 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 85' ' ' GLN . 15.8 mt -67.47 -30.08 69.7 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.742 -0.599 . . . . 0.0 109.676 179.465 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.53 -15.7 34.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.689 -0.632 . . . . 0.0 110.692 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.653 HD13 ' HE3' ' B' ' 176' ' ' MET . 30.5 tp . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.521 -179.859 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.593 HD12 ' N ' ' B' ' 168' ' ' SER . 1.6 pp -50.32 -46.37 55.51 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.793 -0.827 . . . . 0.0 111.607 179.868 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.593 ' N ' HD12 ' B' ' 167' ' ' LEU . 34.8 t -151.74 16.36 0.68 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.258 -0.902 . . . . 0.0 111.115 -179.987 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.473 ' C ' HD13 ' B' ' 173' ' ' ILE . 26.0 tptt 49.94 26.36 1.97 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.131 -0.981 . . . . 0.0 111.021 -179.96 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -153.37 -46.4 0.09 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.648 -0.657 . . . . 0.0 110.03 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.587 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -74.64 -30.29 61.58 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.904 -0.718 . . . . 0.0 109.294 179.59 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.635 HD21 HD23 ' A' ' 86' ' ' LEU . 1.3 tt -79.13 -28.88 42.93 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.711 -0.618 . . . . 0.0 109.672 179.117 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.648 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.3 mp -76.82 -35.25 24.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -64.44 -31.39 72.58 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.905 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.807 ' O ' HG23 ' B' ' 179' ' ' VAL . 77.2 m-20 -75.83 -34.58 60.11 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.109 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.653 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -68.48 -31.76 71.28 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.645 179.524 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -76.93 -30.65 56.19 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.545 -0.722 . . . . 0.0 109.851 179.588 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 -74.8 -30.11 61.31 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.661 -0.65 . . . . 0.0 109.781 179.579 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.807 HG23 ' O ' ' B' ' 175' ' ' ASN . 66.5 t -72.12 -29.47 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.691 -0.63 . . . . 0.0 109.831 179.843 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.94 -31.38 67.95 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.543 -0.723 . . . . 0.0 109.985 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -30.03 63.61 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.739 -0.601 . . . . 0.0 109.828 179.746 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 47.6 tt0 -74.04 -41.17 62.19 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.639 -0.663 . . . . 0.0 109.901 179.716 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.767 ' HA ' HD23 ' A' ' 79' ' ' LEU . 84.0 mt -67.89 -28.37 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.674 -0.641 . . . . 0.0 109.505 179.482 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 35.2 m -66.74 -32.13 73.23 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.55 -0.719 . . . . 0.0 109.691 179.475 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.4 mtt -67.28 -50.28 60.97 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.716 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 58.9 t -65.13 -30.25 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.653 -0.655 . . . . 0.0 109.565 179.568 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -71.12 -29.61 65.46 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.672 -0.643 . . . . 0.0 109.932 179.734 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -30.5 69.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.618 -0.676 . . . . 0.0 109.861 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -37.42 56.75 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.604 -0.685 . . . . 0.0 109.612 179.689 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.632 ' CG1' HD22 ' A' ' 72' ' ' LEU . 70.9 mt -73.38 -28.98 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.651 -0.656 . . . . 0.0 109.593 179.673 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.2 m -73.18 -34.29 65.92 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.544 -0.722 . . . . 0.0 109.548 179.508 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -37.38 62.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.677 -0.639 . . . . 0.0 109.491 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.443 HD22 HG12 ' A' ' 69' ' ' ILE . 0.5 OUTLIER -69.54 -30.69 68.56 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.58 -0.7 . . . . 0.0 109.403 179.238 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -67.49 -42.93 82.1 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.633 -0.667 . . . . 0.0 109.663 179.54 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -68.74 -33.54 74.09 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.577 -0.702 . . . . 0.0 109.338 179.397 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.629 ' NZ ' HG21 ' A' ' 65' ' ' THR . 0.9 OUTLIER -64.42 -32.62 74.31 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.032 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . 0.598 ' OE1' HD11 ' A' ' 62' ' ' LEU . 6.8 mm-40 -65.49 -30.24 70.98 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.477 179.288 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -60.48 -42.47 96.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.684 -0.635 . . . . 0.0 109.868 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -45.42 93.6 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.679 -0.638 . . . . 0.0 109.689 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.429 HD23 HD12 ' A' ' 62' ' ' LEU . 5.0 tp -72.95 -30.9 64.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.707 -0.621 . . . . 0.0 109.422 179.231 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -77.0 -28.58 55.11 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.69 -0.631 . . . . 0.0 109.928 179.511 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -76.95 -28.89 55.35 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.605 -0.685 . . . . 0.0 109.99 179.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -78.65 -28.91 45.54 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.472 -0.768 . . . . 0.0 110.042 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -80.23 -27.86 38.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.642 -0.661 . . . . 0.0 110.208 179.795 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -90.0 -27.23 19.89 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.584 -0.697 . . . . 0.0 110.285 179.894 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -70.96 151.89 95.01 Favored Pre-proline 0 N--CA 1.495 1.783 0 O-C-N 121.505 -0.747 . . . . 0.0 110.213 179.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.317 -1.089 0 O-C-N 123.449 1.236 . . . . 0.0 110.42 179.943 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.6 tttt . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.099 0.476 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.2 mttt -85.22 -169.47 2.66 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.604 -0.685 . . . . 0.0 110.162 179.956 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -67.83 -29.11 68.18 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.585 -0.697 . . . . 0.0 110.149 -179.99 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.2 mmm -61.84 -28.19 69.31 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.623 -0.673 . . . . 0.0 110.235 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -71.8 -28.25 63.47 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.582 -0.699 . . . . 0.0 110.219 -179.976 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -72.23 -32.87 67.12 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.648 -0.657 . . . . 0.0 110.184 179.985 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 ttp180 -69.06 -30.09 68.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.682 -0.636 . . . . 0.0 109.902 179.717 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 10.3 mmt -66.28 -30.33 70.73 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.663 -0.648 . . . . 0.0 109.841 179.667 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 t -62.72 -29.93 71.04 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.727 -0.608 . . . . 0.0 109.926 179.695 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.923 HD12 HD23 ' B' ' 200' ' ' LEU . 18.6 tp -62.26 -28.94 70.06 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.628 -0.67 . . . . 0.0 110.046 179.791 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.82 -32.61 69.72 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.555 -0.716 . . . . 0.0 110.02 179.964 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -75.16 -34.19 61.57 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.638 -0.664 . . . . 0.0 109.816 179.669 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.414 HG21 ' OE1' ' B' ' 197' ' ' GLN . 35.9 m -73.53 -30.41 63.06 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.703 -0.623 . . . . 0.0 109.677 179.608 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -71.59 -27.76 63.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.611 -0.68 . . . . 0.0 110.05 179.611 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -70.0 -30.19 67.45 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.571 -0.706 . . . . 0.0 110.156 179.886 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.41 -37.14 60.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.578 -0.701 . . . . 0.0 109.914 179.797 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.447 HD12 HE21 ' B' ' 197' ' ' GLN . 84.9 mt -70.26 -27.77 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.671 -0.643 . . . . 0.0 109.697 179.611 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 21.4 tp -69.75 -35.06 74.64 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.563 -0.711 . . . . 0.0 109.895 179.679 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -67.98 -28.78 67.73 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.526 -0.734 . . . . 0.0 109.911 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.728 HD22 HG12 ' B' ' 190' ' ' ILE . 11.7 mt -68.57 -31.4 70.58 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.599 -0.688 . . . . 0.0 110.108 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -66.42 -37.31 84.92 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.583 -0.698 . . . . 0.0 110.039 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -74.9 -28.53 60.67 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.608 -0.682 . . . . 0.0 109.916 179.662 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -77.53 -29.8 52.52 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.64 -0.662 . . . . 0.0 109.899 179.78 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.1 tp -77.05 -30.71 55.73 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.602 -0.686 . . . . 0.0 109.97 179.837 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.4 mt -79.3 -31.03 43.16 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.625 -0.672 . . . . 0.0 109.74 179.666 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -77.08 -28.4 54.57 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.699 -0.625 . . . . 0.0 109.827 179.487 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.764 HD23 ' HA ' ' B' ' 183' ' ' ILE . 6.8 tp -76.06 -33.75 59.59 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.62 -0.675 . . . . 0.0 109.918 179.704 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -72.45 -31.16 65.22 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.578 -0.701 . . . . 0.0 109.586 179.372 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -67.89 -29.04 68.05 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.719 -0.613 . . . . 0.0 109.787 179.416 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.17 -44.98 82.48 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.544 -0.722 . . . . 0.0 109.864 179.772 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -62.89 -29.48 70.8 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.568 -0.707 . . . . 0.0 109.799 179.686 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -65.69 -38.59 89.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.616 -0.678 . . . . 0.0 109.844 179.721 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -64.99 -46.64 80.6 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.656 -0.653 . . . . 0.0 109.67 179.596 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.817 HD11 ' HB3' ' B' ' 175' ' ' ASN . 0.4 OUTLIER -61.52 -29.28 69.89 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.645 -0.659 . . . . 0.0 109.776 179.493 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.38 -35.58 81.36 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.59 -0.694 . . . . 0.0 109.537 179.619 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.93 -30.59 64.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.724 -0.61 . . . . 0.0 109.409 179.294 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.411 ' HB3' HD11 ' B' ' 172' ' ' LEU . 2.6 tt0 -75.44 -18.51 59.86 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.711 -0.618 . . . . 0.0 110.494 179.55 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.553 HD11 ' CD1' ' B' ' 173' ' ' ILE . 28.0 tp . . . . . 0 N--CA 1.5 2.068 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.643 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.881 HD13 ' CB ' ' B' ' 171' ' ' GLU . 0.2 OUTLIER -126.96 -62.91 1.09 Allowed 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.537 -0.978 . . . . 0.0 109.132 179.901 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 9.0 t -144.36 37.2 1.23 Allowed 'General case' 0 N--CA 1.489 1.484 0 CA-C-O 121.238 0.542 . . . . 0.0 109.576 179.747 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 10.1 tptt 51.76 26.14 3.32 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.569 -0.707 . . . . 0.0 110.138 -178.976 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -147.19 -44.99 0.17 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.691 -0.63 . . . . 0.0 109.834 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.881 ' CB ' HD13 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -65.12 -32.32 73.97 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.383 179.599 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.595 HD23 HD11 ' B' ' 167' ' ' LEU . 0.1 OUTLIER -79.45 -27.34 41.64 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.438 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.553 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.6 mm -70.07 -30.37 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.629 -0.67 . . . . 0.0 109.605 179.501 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -74.93 -27.82 60.36 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.566 -0.709 . . . . 0.0 110.225 179.97 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.817 ' HB3' HD11 ' A' ' 86' ' ' LEU . 55.3 m-20 -77.37 -29.42 53.26 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.543 -0.723 . . . . 0.0 110.14 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.522 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -76.99 -29.64 55.58 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.627 -0.671 . . . . 0.0 109.93 179.771 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.08 -29.37 54.94 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.66 -0.65 . . . . 0.0 110.026 179.914 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.11 -29.05 54.62 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.547 -0.72 . . . . 0.0 109.971 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.723 HG23 ' O ' ' B' ' 175' ' ' ASN . 67.3 t -76.04 -29.32 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.582 -0.699 . . . . 0.0 109.792 179.701 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -74.69 -28.64 60.91 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.608 -0.682 . . . . 0.0 110.176 179.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -29.2 60.82 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.609 -0.682 . . . . 0.0 110.026 179.925 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . 0.54 ' O ' HG23 ' B' ' 186' ' ' VAL . 8.1 tt0 -76.6 -36.18 57.66 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.61 -0.681 . . . . 0.0 110.058 179.833 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.764 ' HA ' HD23 ' A' ' 79' ' ' LEU . 87.6 mt -73.77 -27.88 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.715 -0.616 . . . . 0.0 109.762 179.604 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 29.5 m -73.98 -33.02 63.69 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.502 -0.748 . . . . 0.0 109.769 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 2.9 tpt -76.6 -36.75 57.31 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.626 -0.671 . . . . 0.0 109.585 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . 0.54 HG23 ' O ' ' B' ' 182' ' ' GLU . 73.1 t -75.15 -31.17 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.689 -0.632 . . . . 0.0 109.455 179.343 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -74.74 -29.17 61.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.644 -0.66 . . . . 0.0 109.847 179.678 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -73.72 -29.55 62.32 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.621 -0.674 . . . . 0.0 109.937 179.726 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -71.53 -35.43 70.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.706 -0.621 . . . . 0.0 109.819 179.798 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.728 HG12 HD22 ' A' ' 72' ' ' LEU . 79.0 mt -68.74 -37.89 78.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.576 -0.703 . . . . 0.0 109.849 179.832 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 56.1 p -66.9 -35.07 79.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.629 -0.67 . . . . 0.0 109.446 179.442 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 6.2 mmmm -75.86 -36.05 59.71 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.316 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.66 HD23 ' HE2' ' B' ' 196' ' ' LYS . 0.3 OUTLIER -75.81 -14.61 60.3 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.682 -0.636 . . . . 0.0 110.458 179.358 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 6.9 tppt? -87.08 -29.25 22.03 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.238 -0.914 . . . . 0.0 109.355 179.334 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -76.53 -35.15 58.46 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 120.192 -0.603 . . . . 0.0 109.88 179.475 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.66 ' HE2' HD23 ' B' ' 193' ' ' LEU . 0.0 OUTLIER -69.77 -28.04 65.42 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 119.769 -0.773 . . . . 0.0 109.555 179.41 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . 0.447 HE21 HD12 ' A' ' 69' ' ' ILE . 4.9 tp60 -72.04 -30.28 65.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.597 -0.689 . . . . 0.0 109.223 179.032 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -35.79 80.55 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.73 -0.606 . . . . 0.0 109.786 179.637 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.06 -44.24 94.85 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.523 -0.736 . . . . 0.0 109.045 179.096 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.923 HD23 HD12 ' A' ' 62' ' ' LEU . 18.0 tp -68.02 -29.06 67.97 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.355 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -32.99 74.76 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.72 -0.613 . . . . 0.0 109.872 179.505 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -75.72 -30.07 59.14 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 110.046 179.928 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.03 -30.11 43.98 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.618 -0.676 . . . . 0.0 109.985 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -81.06 -27.68 35.61 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.672 -0.642 . . . . 0.0 110.025 179.718 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -96.11 -26.56 15.44 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.562 -0.711 . . . . 0.0 110.307 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 18.4 mmtm 52.86 69.42 2.36 Favored Pre-proline 0 N--CA 1.501 2.084 0 O-C-N 121.412 -0.805 . . . . 0.0 110.692 179.948 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 C--N 1.317 -1.117 0 O-C-N 123.35 1.184 . . . . 0.0 110.343 -179.983 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 33.2 mttp . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.071 0.462 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -130.99 178.02 7.0 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.534 -0.729 . . . . 0.0 110.19 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 52.14 25.96 3.59 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.484 -0.76 . . . . 0.0 110.886 179.975 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.6 mtm -160.48 -43.88 0.05 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.54 -0.725 . . . . 0.0 110.08 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -68.33 -28.39 67.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.62 -0.675 . . . . 0.0 110.096 179.8 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -75.24 -29.66 60.29 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.544 -0.722 . . . . 0.0 110.026 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.3 mtt85 -74.27 -30.54 62.16 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.594 -0.691 . . . . 0.0 109.959 179.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.7 mtt -71.49 -30.16 65.65 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.672 -0.642 . . . . 0.0 109.768 179.693 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 5.1 p -67.5 -29.51 68.95 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.601 -0.687 . . . . 0.0 109.912 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.531 HD21 ' HG2' ' B' ' 201' ' ' GLU . 0.9 OUTLIER -65.1 -30.27 71.2 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.597 -0.69 . . . . 0.0 109.95 179.795 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -76.05 -31.98 59.08 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.655 -0.653 . . . . 0.0 109.933 179.82 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.28 -34.71 59.1 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.716 -0.615 . . . . 0.0 109.675 179.565 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.1 m -74.82 -34.17 62.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.651 -0.656 . . . . 0.0 109.454 179.4 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.529 ' HA ' HD12 ' A' ' 69' ' ' ILE . 26.4 mttt -69.68 -27.78 65.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.686 -0.634 . . . . 0.0 109.746 179.405 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -67.19 -34.55 77.75 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.513 -0.742 . . . . 0.0 109.912 179.726 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -76.24 -32.44 58.88 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.661 -0.649 . . . . 0.0 109.557 179.544 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.778 HG12 HD22 ' B' ' 193' ' ' LEU . 75.1 mt -72.66 -28.3 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.719 -0.613 . . . . 0.0 109.557 179.335 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.4 tt -69.27 -38.4 78.37 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.621 -0.674 . . . . 0.0 109.846 179.659 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.2 tmtm? -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.592 -0.693 . . . . 0.0 109.846 179.728 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.641 HD12 ' CG1' ' B' ' 190' ' ' ILE . 1.7 mm? -64.55 -32.84 74.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.711 -0.618 . . . . 0.0 109.912 179.79 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -38.89 91.71 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.594 -0.691 . . . . 0.0 109.83 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.34 -32.07 64.34 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.642 -0.662 . . . . 0.0 109.518 179.455 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.3 tptm -73.19 -33.63 65.52 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.717 -0.614 . . . . 0.0 109.659 179.577 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 20.8 tp -76.02 -32.09 59.2 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.671 -0.643 . . . . 0.0 109.587 179.491 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -76.73 -34.48 58.11 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.747 -0.596 . . . . 0.0 109.558 179.396 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.42 -29.14 62.38 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.708 -0.62 . . . . 0.0 109.79 179.472 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.738 HD23 ' HA ' ' B' ' 183' ' ' ILE . 8.1 tp -75.8 -36.6 59.69 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.662 -0.649 . . . . 0.0 109.817 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.403 ' HA ' ' HG2' ' A' ' 83' ' ' LYS . 20.1 tt0 -76.2 -23.09 54.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.68 -0.637 . . . . 0.0 110.138 179.439 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -81.32 -26.75 35.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.455 -0.778 . . . . 0.0 109.573 179.187 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -76.43 -41.46 47.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.577 -0.702 . . . . 0.0 110.003 179.632 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.403 ' HG2' ' HA ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -68.28 -24.84 64.92 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.627 179.339 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -66.29 -31.04 71.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.552 -0.717 . . . . 0.0 109.446 179.184 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.01 -31.46 72.6 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.616 -0.677 . . . . 0.0 109.595 179.465 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.437 HD21 HD23 ' B' ' 172' ' ' LEU . 0.3 OUTLIER -68.07 -34.96 77.41 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.672 -0.643 . . . . 0.0 109.755 179.548 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -61.87 -36.36 81.02 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.596 -0.69 . . . . 0.0 109.975 179.684 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 tp -64.16 -29.86 70.95 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.677 -0.64 . . . . 0.0 109.95 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -82.41 -13.1 57.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.652 -0.655 . . . . 0.0 110.799 179.822 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.847 HD13 ' HE3' ' B' ' 176' ' ' MET . 38.5 tp . . . . . 0 N--CA 1.501 2.098 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.598 -179.946 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . 0.552 ' HA2' HD12 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.784 HD11 ' HG ' ' B' ' 172' ' ' LEU . 0.1 OUTLIER -118.98 -63.13 1.44 Allowed 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.583 -0.951 . . . . 0.0 108.946 -179.957 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . . . . . . . . . 7.6 t -152.83 33.55 0.49 Allowed 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.277 0.56 . . . . 0.0 109.543 179.684 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 9.6 tptm 51.34 26.73 3.22 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.515 -0.741 . . . . 0.0 110.072 -179.065 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -149.03 -43.21 0.14 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.633 -0.667 . . . . 0.0 110.339 -179.785 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.706 ' HB3' HD22 ' B' ' 167' ' ' LEU . 0.2 OUTLIER -62.0 -40.83 96.98 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.667 179.77 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.784 ' HG ' HD11 ' B' ' 167' ' ' LEU . 1.4 mt -76.18 -28.53 57.33 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.464 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . . . . . . . . . 50.8 mm -67.5 -31.06 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.328 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -75.53 -32.73 60.58 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.714 179.766 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -73.78 -35.0 64.89 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.67 -0.644 . . . . 0.0 109.566 179.45 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.847 ' HE3' HD13 ' A' ' 90' ' ' LEU . 0.8 OUTLIER -67.44 -29.54 69.04 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.729 -0.607 . . . . 0.0 109.966 179.628 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -77.17 -25.34 51.8 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.625 -0.672 . . . . 0.0 110.132 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -77.86 -31.5 51.45 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.562 -0.711 . . . . 0.0 110.194 179.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.535 HG22 ' O ' ' B' ' 176' ' ' MET . 34.5 m -77.21 -24.53 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.573 -0.705 . . . . 0.0 110.294 179.966 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -82.44 -29.71 30.5 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.405 -0.809 . . . . 0.0 109.836 179.653 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -77.49 -27.93 52.03 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.696 -0.627 . . . . 0.0 109.842 179.576 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -77.54 -34.54 53.86 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.537 -0.727 . . . . 0.0 110.021 179.705 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.738 ' HA ' HD23 ' A' ' 79' ' ' LEU . 76.9 mt -74.26 -27.0 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.551 -0.718 . . . . 0.0 109.692 179.574 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 28.1 m -71.61 -31.43 66.89 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.525 -0.735 . . . . 0.0 109.552 179.256 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.26 -44.37 53.17 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.61 -0.681 . . . . 0.0 109.497 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 70.5 t -71.45 -31.83 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.679 -0.638 . . . . 0.0 109.289 179.331 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -72.99 -29.06 62.75 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.704 -0.623 . . . . 0.0 109.797 179.565 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -72.43 -32.17 66.09 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.677 -0.639 . . . . 0.0 109.918 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.46 -29.85 67.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.715 -0.616 . . . . 0.0 109.983 179.803 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.641 ' CG1' HD12 ' A' ' 72' ' ' LEU . 79.7 mt -73.95 -30.27 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.602 -0.686 . . . . 0.0 109.762 179.775 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 97.7 p -71.73 -40.28 69.53 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.627 -0.671 . . . . 0.0 109.519 179.315 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 9.8 mtpp -71.35 -30.19 65.87 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.589 -0.695 . . . . 0.0 109.455 179.341 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.778 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -71.19 -37.65 72.13 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.668 -0.645 . . . . 0.0 109.341 179.366 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.93 -42.37 97.39 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.625 -0.672 . . . . 0.0 109.486 179.453 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.04 -30.64 71.2 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.46 179.337 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.574 ' HE2' HD23 ' B' ' 193' ' ' LEU . 28.5 ttpt -64.35 -34.31 77.85 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.686 -0.634 . . . . 0.0 109.33 179.296 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . 0.478 ' HG2' HD11 ' A' ' 69' ' ' ILE . 4.0 mm-40 -64.49 -31.35 72.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.77 -0.581 . . . . 0.0 109.465 179.38 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -60.22 -40.47 90.27 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.655 -0.653 . . . . 0.0 109.894 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -62.03 -39.64 93.0 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 120.286 -0.566 . . . . 0.0 109.793 179.605 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.78 -31.88 65.2 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.689 -0.632 . . . . 0.0 109.59 179.575 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.531 ' HG2' HD21 ' A' ' 62' ' ' LEU . 4.8 mm-40 -77.41 -34.61 54.7 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.623 -0.673 . . . . 0.0 109.753 179.645 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -77.64 -30.19 52.06 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.738 -0.602 . . . . 0.0 109.606 179.447 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -77.23 -27.92 53.51 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.622 -0.674 . . . . 0.0 109.897 179.513 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.4 -24.8 50.43 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.586 -0.696 . . . . 0.0 110.318 179.773 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -85.21 -28.18 25.59 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.498 -0.751 . . . . 0.0 110.063 179.882 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 17.9 mmtt -61.82 166.27 6.37 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.562 -0.711 . . . . 0.0 110.125 -179.98 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 C--N 1.316 -1.147 0 O-C-N 123.388 1.204 . . . . 0.0 110.361 -179.985 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.107 0.479 . . . . 0.0 110.26 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 19.9 mtpt -62.37 169.39 2.93 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.575 -0.703 . . . . 0.0 110.169 179.909 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -88.71 11.9 16.33 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.541 -0.724 . . . . 0.0 110.923 179.967 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 8.0 mtt -116.64 -30.86 5.69 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.255 -0.903 . . . . 0.0 110.439 179.961 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -66.52 -43.04 86.34 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.518 -0.739 . . . . 0.0 110.161 -179.966 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -61.66 -28.0 69.08 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.642 -0.661 . . . . 0.0 110.296 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.8 mtt-85 -69.58 -27.91 65.51 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.593 -0.692 . . . . 0.0 110.293 179.9 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.3 mmm -70.51 -29.44 65.94 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.599 -0.688 . . . . 0.0 110.145 179.883 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.11 -29.07 65.93 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.627 -0.671 . . . . 0.0 110.09 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tp -69.39 -28.03 65.83 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.67 -0.644 . . . . 0.0 110.161 179.903 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.1 tp10 -70.46 -30.16 66.91 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.563 -0.711 . . . . 0.0 110.111 179.985 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -73.55 -43.1 60.72 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.637 -0.664 . . . . 0.0 109.84 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.488 HG22 HD11 ' A' ' 69' ' ' ILE . 73.8 m -67.45 -30.55 70.3 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.701 -0.625 . . . . 0.0 109.596 179.503 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -67.6 -27.9 67.29 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.628 -0.67 . . . . 0.0 109.909 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.84 -40.6 91.92 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.507 -0.745 . . . . 0.0 110.119 179.872 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -73.75 -36.99 65.2 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.609 -0.682 . . . . 0.0 109.579 179.64 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.552 HG12 HD22 ' B' ' 193' ' ' LEU . 75.7 mt -73.02 -27.98 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.707 -0.62 . . . . 0.0 109.399 179.261 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.58 -34.91 72.7 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.61 -0.681 . . . . 0.0 109.764 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -62.96 -36.13 82.43 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.557 -0.714 . . . . 0.0 109.753 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.581 HD22 HG12 ' B' ' 190' ' ' ILE . 15.5 mt -63.05 -28.61 70.21 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.61 -0.681 . . . . 0.0 109.919 179.696 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.02 -41.16 99.47 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.575 -0.703 . . . . 0.0 110.002 179.822 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.46 -32.19 66.06 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.683 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -77.17 -33.97 56.4 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.728 -0.607 . . . . 0.0 109.631 179.635 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.4 tp -75.72 -29.67 59.0 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.651 -0.656 . . . . 0.0 109.706 179.454 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tt -76.27 -34.77 59.14 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.716 -0.615 . . . . 0.0 109.649 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.31 -29.69 65.32 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.634 -0.666 . . . . 0.0 109.792 179.49 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.588 HD12 ' CG1' ' B' ' 183' ' ' ILE . 0.4 OUTLIER -71.83 -40.19 69.26 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.63 -0.669 . . . . 0.0 109.725 179.736 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -69.45 -30.39 68.29 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.579 -0.7 . . . . 0.0 109.696 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -69.02 -29.5 67.67 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.738 -0.601 . . . . 0.0 109.769 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -65.75 -41.62 91.91 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.642 -0.661 . . . . 0.0 109.826 179.879 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -67.9 -29.69 68.84 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.59 -0.694 . . . . 0.0 109.791 179.623 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -68.29 -31.42 70.85 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.687 -0.633 . . . . 0.0 109.861 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 51.6 tp60 -68.15 -35.83 78.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.594 -0.691 . . . . 0.0 109.731 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.601 HD13 ' HA ' ' B' ' 176' ' ' MET . 2.8 mt -63.43 -32.2 73.58 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.661 -0.649 . . . . 0.0 109.851 179.702 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -61.5 -38.85 88.81 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.555 -0.716 . . . . 0.0 109.789 179.73 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 44.4 mt -73.73 -30.66 62.96 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.709 -0.619 . . . . 0.0 109.663 179.492 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -86.9 -16.99 34.32 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.59 -0.694 . . . . 0.0 110.688 179.65 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.465 HD11 ' CD1' ' B' ' 173' ' ' ILE . 53.4 tp . . . . . 0 N--CA 1.5 2.061 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.646 179.996 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.737 HD12 ' N ' ' B' ' 168' ' ' SER . 2.9 pp -139.54 -44.59 0.45 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.617 -0.931 . . . . 0.0 110.54 -179.911 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.737 ' N ' HD12 ' B' ' 167' ' ' LEU . 20.5 t -153.85 15.16 0.49 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.407 -0.808 . . . . 0.0 111.299 -179.99 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 13.9 tptm 49.51 26.44 1.7 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.095 -1.003 . . . . 0.0 111.059 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.63 -46.77 0.1 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.695 -0.628 . . . . 0.0 110.064 179.991 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.563 ' CB ' HD11 ' B' ' 167' ' ' LEU . 2.6 mm-40 -73.49 -37.29 65.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.575 -0.703 . . . . 0.0 109.119 179.483 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.466 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.3 tt -74.39 -27.59 60.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.746 -0.597 . . . . 0.0 109.408 178.821 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.465 ' CD1' HD11 ' A' ' 90' ' ' LEU . 51.3 mm -69.53 -33.68 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.591 -0.693 . . . . 0.0 109.277 179.388 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -70.7 -30.56 67.15 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.711 -0.618 . . . . 0.0 109.722 179.538 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -70.03 -41.37 74.37 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.68 -0.637 . . . . 0.0 109.86 179.594 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.601 ' HA ' HD13 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -62.35 -32.63 73.44 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.704 -0.623 . . . . 0.0 109.888 179.669 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -73.07 -29.41 62.93 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.71 -0.619 . . . . 0.0 109.969 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -73.03 -33.13 65.53 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.627 -0.671 . . . . 0.0 109.966 179.863 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.568 HG21 ' CD1' ' A' ' 86' ' ' LEU . 61.3 t -71.23 -30.68 41.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.622 -0.674 . . . . 0.0 109.668 179.788 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.26 -30.45 68.57 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 120.123 -0.631 . . . . 0.0 109.891 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -76.16 -28.35 57.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.678 -0.639 . . . . 0.0 109.941 179.585 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -76.35 -34.16 58.96 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.564 -0.71 . . . . 0.0 110.016 179.771 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.588 ' CG1' HD12 ' A' ' 79' ' ' LEU . 85.1 mt -74.34 -29.97 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.673 -0.642 . . . . 0.0 109.653 179.676 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 26.3 m -72.52 -30.75 64.75 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.549 -0.72 . . . . 0.0 109.778 179.479 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.4 mtp -73.64 -44.64 56.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.625 -0.672 . . . . 0.0 109.688 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.3 t -72.08 -30.84 37.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.585 -0.697 . . . . 0.0 109.399 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -74.4 -29.33 61.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.625 -0.672 . . . . 0.0 109.747 179.358 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.23 -30.95 68.15 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.695 -0.628 . . . . 0.0 109.81 179.609 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -36.04 68.9 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.632 -0.667 . . . . 0.0 109.824 179.638 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.581 HG12 HD22 ' A' ' 72' ' ' LEU . 75.7 mt -71.57 -31.05 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.687 -0.633 . . . . 0.0 109.439 179.704 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 11.5 m -68.41 -37.89 80.75 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.633 -0.667 . . . . 0.0 109.474 179.519 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 39.2 mttm -74.85 -36.25 62.35 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 120.098 -0.641 . . . . 0.0 109.37 179.349 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.552 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -72.18 -31.32 65.81 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.167 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? -67.56 -39.75 84.92 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.664 -0.648 . . . . 0.0 109.489 179.407 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -31.74 73.0 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.689 -0.632 . . . . 0.0 109.317 179.284 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -63.48 -37.03 85.75 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.71 -0.619 . . . . 0.0 109.411 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -62.05 -29.8 70.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.775 -0.578 . . . . 0.0 109.66 179.458 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -61.69 -46.28 90.39 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.683 -0.635 . . . . 0.0 109.906 179.662 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -63.87 -40.8 97.4 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.752 -0.592 . . . . 0.0 109.863 179.751 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 21.9 tp -71.71 -32.68 68.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.632 -0.668 . . . . 0.0 109.814 179.692 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -76.22 -32.49 58.95 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.569 -0.707 . . . . 0.0 109.814 179.718 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -75.07 -30.41 60.96 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.643 -0.661 . . . . 0.0 109.599 179.525 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -69.86 -30.41 67.87 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.624 -0.673 . . . . 0.0 109.571 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -63.03 -30.01 71.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.643 -0.661 . . . . 0.0 109.732 179.5 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -105.98 24.91 11.61 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.661 -0.649 . . . . 0.0 110.345 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 11.9 mttm -129.3 74.24 81.12 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.489 -0.757 . . . . 0.0 110.173 179.904 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.317 -1.08 0 O-C-N 123.31 1.163 . . . . 0.0 110.407 179.962 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.8 mttt . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.089 0.471 . . . . 0.0 110.3 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -94.04 -168.51 1.88 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.633 -0.667 . . . . 0.0 110.206 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -81.76 -27.8 33.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.615 -0.678 . . . . 0.0 110.336 179.959 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.4 mmm -70.83 -28.54 64.68 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.533 -0.729 . . . . 0.0 110.163 -179.984 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.38 -29.62 59.9 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.604 -0.685 . . . . 0.0 110.06 179.946 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -74.53 -29.08 61.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.645 -0.659 . . . . 0.0 109.984 179.814 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -73.37 -28.71 62.18 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.565 -0.709 . . . . 0.0 110.047 179.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.6 mtt -71.72 -29.84 64.99 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.539 -0.726 . . . . 0.0 109.972 179.824 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.0 m -68.8 -30.09 68.59 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.706 -0.621 . . . . 0.0 109.907 179.747 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.734 HD12 HD23 ' B' ' 200' ' ' LEU . 1.7 tp -65.55 -28.88 69.48 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.659 -0.651 . . . . 0.0 109.965 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -63.62 -32.19 73.59 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.653 -0.654 . . . . 0.0 110.081 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -67.8 -52.0 42.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.61 -0.681 . . . . 0.0 109.946 179.667 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.2 m -62.95 -31.92 73.12 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.701 -0.624 . . . . 0.0 109.484 179.504 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -65.46 -28.38 69.17 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.647 -0.658 . . . . 0.0 109.773 179.415 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -62.21 -42.41 99.27 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.572 -0.705 . . . . 0.0 109.935 179.814 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -75.5 -33.26 60.75 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.584 -0.698 . . . . 0.0 109.403 179.417 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -75.63 -26.52 18.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.212 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.8 tp -72.2 -34.04 68.08 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.576 -0.703 . . . . 0.0 109.825 179.657 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -66.21 -37.48 85.65 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.525 -0.735 . . . . 0.0 109.808 179.696 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.65 HD22 HG12 ' B' ' 190' ' ' ILE . 8.0 mt -64.88 -29.19 70.13 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.695 -0.628 . . . . 0.0 109.92 179.737 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.435 ' O ' HD13 ' A' ' 77' ' ' LEU . 14.3 mt-10 -66.52 -34.37 77.76 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.58 -0.7 . . . . 0.0 109.897 179.837 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -76.61 -31.83 57.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.707 -0.621 . . . . 0.0 109.558 179.589 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -76.2 -30.32 57.95 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.811 -0.555 . . . . 0.0 109.716 179.712 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.928 HD13 HD12 ' B' ' 190' ' ' ILE . 6.1 tp -77.11 -31.99 56.21 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.628 -0.67 . . . . 0.0 109.661 179.581 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.435 HD13 ' O ' ' A' ' 73' ' ' GLU . 0.7 OUTLIER -74.98 -34.6 62.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.622 -0.674 . . . . 0.0 109.558 179.502 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.85 -29.99 67.36 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.784 179.452 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.767 HD12 HG12 ' B' ' 183' ' ' ILE . 0.3 OUTLIER -71.03 -44.27 66.19 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.636 -0.665 . . . . 0.0 109.609 179.575 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -66.81 -30.85 71.14 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.588 -0.695 . . . . 0.0 109.664 179.445 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.8 -30.2 69.57 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.772 -0.58 . . . . 0.0 109.802 179.593 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.68 -44.26 86.79 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.643 -0.661 . . . . 0.0 109.805 179.765 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -62.83 -33.06 74.44 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.574 -0.704 . . . . 0.0 109.619 179.556 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -62.66 -31.26 72.1 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.703 -0.623 . . . . 0.0 109.962 179.772 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -70.9 -35.95 72.51 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.712 -0.617 . . . . 0.0 109.785 179.689 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.648 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.2 OUTLIER -64.89 -30.52 71.52 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.684 -0.635 . . . . 0.0 109.671 179.611 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -62.43 -36.46 82.47 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.661 -0.649 . . . . 0.0 109.8 179.726 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.437 HD12 ' N ' ' A' ' 88' ' ' LEU . 8.6 mp -73.07 -29.51 63.01 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.756 -0.59 . . . . 0.0 109.965 179.656 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -85.86 -23.86 26.93 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.67 -0.644 . . . . 0.0 110.345 179.829 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.522 HD22 ' CE ' ' B' ' 176' ' ' MET . 53.2 tp . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.471 -179.977 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . 0.441 ' HA2' HD13 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.734 HD12 ' N ' ' B' ' 168' ' ' SER . 3.0 pp -140.76 -43.65 0.39 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.607 -0.937 . . . . 0.0 110.597 -179.77 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.734 ' N ' HD12 ' B' ' 167' ' ' LEU . 33.3 t -153.21 16.55 0.55 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.344 -0.848 . . . . 0.0 111.141 179.851 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.462 ' C ' HD13 ' B' ' 173' ' ' ILE . 10.6 tptm 49.84 26.37 1.9 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.133 -0.979 . . . . 0.0 111.12 179.982 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -154.58 -45.86 0.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.628 -0.67 . . . . 0.0 110.331 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.632 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.6 OUTLIER -74.21 -31.04 62.47 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.436 179.8 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.562 HD12 HD23 ' B' ' 167' ' ' LEU . 1.5 tt -79.69 -29.77 40.88 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.671 -0.643 . . . . 0.0 109.606 179.182 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.638 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.3 mp -75.83 -34.33 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 179.322 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -65.09 -32.73 74.58 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.748 ' O ' HG23 ' B' ' 179' ' ' VAL . 76.8 m-20 -75.56 -33.43 60.64 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.03 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.648 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -70.14 -35.89 74.39 Favored 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.54 179.549 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -72.86 -30.5 64.04 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.651 -0.656 . . . . 0.0 109.81 179.708 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -29.63 64.47 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.641 -0.662 . . . . 0.0 109.888 179.7 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.748 HG23 ' O ' ' B' ' 175' ' ' ASN . 65.5 t -69.76 -29.91 42.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.589 -0.694 . . . . 0.0 109.805 179.728 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -68.72 -30.4 69.03 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.61 -0.681 . . . . 0.0 109.841 179.819 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.04 -29.49 61.93 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.643 -0.661 . . . . 0.0 109.897 179.783 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -74.81 -37.45 62.32 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.685 -0.634 . . . . 0.0 109.949 179.699 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.767 HG12 HD12 ' A' ' 79' ' ' LEU . 85.9 mt -72.08 -29.25 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 O-C-N 121.698 -0.626 . . . . 0.0 109.674 179.606 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 25.2 m -72.49 -31.76 65.64 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.56 -0.713 . . . . 0.0 109.847 179.555 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -42.52 65.74 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.592 -0.693 . . . . 0.0 109.796 179.631 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.69 -31.44 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.695 -0.628 . . . . 0.0 109.457 179.584 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -72.13 -29.75 64.37 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.63 -0.669 . . . . 0.0 109.818 179.579 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -30.86 69.54 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.569 -0.707 . . . . 0.0 109.803 179.739 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -75.59 -35.16 60.63 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.666 -0.646 . . . . 0.0 109.766 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.928 HD12 HD13 ' A' ' 76' ' ' LEU . 79.1 mt -73.39 -31.55 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.58 -0.7 . . . . 0.0 109.43 179.616 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 1.9 m -70.02 -35.94 74.7 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.7 -0.625 . . . . 0.0 109.327 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -75.2 -37.22 61.24 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.594 -0.691 . . . . 0.0 109.283 179.299 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.75 -30.96 66.16 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.677 -0.639 . . . . 0.0 109.436 179.196 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -68.83 -36.93 78.79 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.697 -0.627 . . . . 0.0 109.753 179.587 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -62.8 -30.28 71.35 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.584 -0.698 . . . . 0.0 109.628 179.571 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -39.33 94.45 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.692 -0.63 . . . . 0.0 109.621 179.443 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -62.69 -29.19 70.47 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.716 -0.615 . . . . 0.0 109.704 179.494 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -61.75 -38.12 86.8 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.665 -0.647 . . . . 0.0 109.771 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -68.01 -39.68 83.13 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.707 -0.62 . . . . 0.0 109.727 179.635 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.734 HD23 HD12 ' A' ' 62' ' ' LEU . 11.0 tp -74.07 -30.75 62.53 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.632 -0.667 . . . . 0.0 109.685 179.552 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.613 ' HG2' HD11 ' A' ' 62' ' ' LEU . 3.8 mm-40 -77.24 -29.5 54.05 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.604 -0.685 . . . . 0.0 109.852 179.544 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -76.35 -29.21 57.12 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.6 -0.688 . . . . 0.0 109.926 179.647 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.0 -28.03 57.64 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.613 -0.679 . . . . 0.0 110.044 179.778 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.15 -25.96 52.53 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.565 -0.709 . . . . 0.0 110.362 179.87 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -89.7 -27.51 20.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.507 -0.746 . . . . 0.0 110.211 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -78.46 158.95 75.7 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.504 -0.748 . . . . 0.0 110.245 179.964 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 C--N 1.317 -1.112 0 O-C-N 123.388 1.204 . . . . 0.0 110.37 -179.965 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.121 0.486 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -98.44 -174.27 2.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.58 -0.7 . . . . 0.0 110.207 179.965 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 52.85 26.71 4.8 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.508 -0.745 . . . . 0.0 110.858 -179.968 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.5 tmm? -144.0 -46.05 0.27 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.583 -0.698 . . . . 0.0 110.22 179.836 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -66.8 -30.01 70.1 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.643 -0.661 . . . . 0.0 109.92 179.903 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.44 -28.37 61.93 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.652 -0.655 . . . . 0.0 109.946 179.752 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -72.09 -28.58 63.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.565 -0.709 . . . . 0.0 110.06 179.817 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 13.0 mtp -70.33 -34.91 73.24 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.559 -0.713 . . . . 0.0 109.942 179.887 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 t -64.55 -30.14 71.16 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.626 -0.671 . . . . 0.0 109.858 179.727 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.491 ' HG ' HD23 ' B' ' 200' ' ' LEU . 1.5 tt -63.17 -29.36 70.72 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.68 -0.638 . . . . 0.0 109.953 179.673 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -61.78 -33.25 73.77 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.546 -0.721 . . . . 0.0 110.063 179.911 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.29 -48.84 63.9 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.615 -0.678 . . . . 0.0 109.796 179.782 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.4 m -63.04 -33.53 75.63 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 120.266 -0.573 . . . . 0.0 109.599 179.523 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.89 -28.74 69.75 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.66 -0.65 . . . . 0.0 109.819 179.651 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -63.21 -36.78 84.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.601 -0.687 . . . . 0.0 110.056 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -75.0 -35.85 62.0 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.66 -0.65 . . . . 0.0 109.65 179.656 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.57 ' CD1' HD22 ' B' ' 193' ' ' LEU . 50.8 mm -72.82 -28.46 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.679 -0.638 . . . . 0.0 109.545 179.434 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.5 tp -73.18 -40.16 65.02 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.555 -0.716 . . . . 0.0 109.875 179.516 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.6 ttpp -69.36 -32.57 71.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.622 -0.674 . . . . 0.0 109.597 179.54 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.78 HD12 HG12 ' B' ' 190' ' ' ILE . 1.5 mm? -69.42 -36.28 76.55 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.721 -0.612 . . . . 0.0 109.719 179.55 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -64.54 -33.46 75.96 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.629 -0.67 . . . . 0.0 109.727 179.712 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -74.38 -31.74 62.48 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.673 -0.642 . . . . 0.0 109.448 179.505 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -68.62 -30.47 69.2 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.768 -0.582 . . . . 0.0 109.747 179.599 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.501 HD13 HD12 ' B' ' 190' ' ' ILE . 14.2 tp -73.0 -34.36 66.35 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.56 -0.713 . . . . 0.0 109.696 179.664 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.82 -36.71 64.99 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.253 -0.579 . . . . 0.0 109.611 179.51 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.54 -29.98 67.7 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.708 -0.62 . . . . 0.0 109.723 179.565 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.568 HD12 HG12 ' B' ' 183' ' ' ILE . 0.3 OUTLIER -73.64 -44.01 58.02 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.67 -0.644 . . . . 0.0 109.624 179.607 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -68.68 -30.79 69.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.619 -0.675 . . . . 0.0 109.538 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.56 -29.56 68.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.602 -0.686 . . . . 0.0 109.703 179.527 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -67.42 -45.91 74.74 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.693 -0.629 . . . . 0.0 109.88 179.703 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.2 tttm -62.86 -29.98 71.16 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.529 -0.732 . . . . 0.0 109.682 179.466 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -64.18 -29.41 70.52 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.669 -0.644 . . . . 0.0 109.863 179.595 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.97 -39.22 79.58 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.521 -0.737 . . . . 0.0 109.797 179.74 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.478 HD23 HD21 ' B' ' 172' ' ' LEU . 2.6 mt -61.86 -31.06 71.3 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.544 -0.722 . . . . 0.0 109.873 179.727 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -61.84 -40.41 95.2 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.535 -0.728 . . . . 0.0 109.78 179.748 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.4 mt -72.5 -31.38 65.31 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.684 -0.635 . . . . 0.0 109.486 179.392 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -86.15 -14.76 43.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.756 -0.59 . . . . 0.0 110.634 179.533 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.425 HD11 HD11 ' B' ' 173' ' ' ILE . 50.7 tp . . . . . 0 N--CA 1.5 2.062 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.572 -179.895 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.353 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.75 HD12 ' N ' ' B' ' 168' ' ' SER . 2.6 pp -139.83 -45.98 0.44 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.614 -0.933 . . . . 0.0 110.458 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.75 ' N ' HD12 ' B' ' 167' ' ' LEU . 37.4 t -156.82 12.38 0.25 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.343 -0.848 . . . . 0.0 111.931 -179.945 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 39.5 tptt 49.24 26.48 1.53 Allowed 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.085 -1.01 . . . . 0.0 111.197 -179.826 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -152.23 -47.77 0.1 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.761 -0.587 . . . . 0.0 109.647 179.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.406 ' HB2' ' CD1' ' B' ' 167' ' ' LEU . 3.5 mm-40 -74.29 -34.0 63.41 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.374 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.565 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.7 tt -75.18 -27.91 59.85 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.798 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.425 HD11 HD11 ' A' ' 90' ' ' LEU . 50.6 mm -68.54 -31.5 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.6 -0.688 . . . . 0.0 109.374 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -68.52 -30.11 68.84 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.746 -0.596 . . . . 0.0 109.789 179.657 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -74.94 -29.26 60.89 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.63 -0.669 . . . . 0.0 109.924 179.808 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.03 -24.34 55.19 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.641 -0.662 . . . . 0.0 110.243 179.889 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.75 -27.05 31.33 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.451 -0.781 . . . . 0.0 109.691 179.464 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -37.82 37.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.564 -0.71 . . . . 0.0 109.868 179.729 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 11.3 p -73.92 -25.62 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 C-N-CA 119.88 -0.728 . . . . 0.0 109.831 179.508 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -73.97 -30.5 62.55 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.564 -0.71 . . . . 0.0 109.688 179.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 12.3 mtp180 -72.73 -29.91 63.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.618 -0.676 . . . . 0.0 109.784 179.62 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . 0.464 ' O ' HG23 ' B' ' 186' ' ' VAL . 0.6 OUTLIER -69.09 -31.0 69.42 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.598 -0.689 . . . . 0.0 109.872 179.705 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.568 HG12 HD12 ' A' ' 79' ' ' LEU . 82.9 mt -70.39 -31.39 46.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.696 -0.628 . . . . 0.0 109.629 179.695 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.33 -38.09 71.69 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.678 -0.639 . . . . 0.0 109.708 179.582 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 7.2 ttm -67.66 -39.34 84.54 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.612 -0.68 . . . . 0.0 109.746 179.621 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . 0.464 HG23 ' O ' ' B' ' 182' ' ' GLU . 70.1 t -72.34 -30.86 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.604 -0.685 . . . . 0.0 109.543 179.622 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -73.13 -28.44 62.25 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.654 -0.654 . . . . 0.0 109.977 179.664 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -72.66 -32.29 65.74 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.638 -0.664 . . . . 0.0 109.998 179.855 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -73.88 -38.88 64.26 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.715 -0.615 . . . . 0.0 109.823 179.807 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.78 HG12 HD12 ' A' ' 72' ' ' LEU . 79.4 mt -71.52 -31.52 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.468 179.577 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 2.0 m -67.91 -35.36 78.32 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.662 -0.649 . . . . 0.0 109.256 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 11.3 mmtp -77.92 -33.0 52.0 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 179.181 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.57 HD22 ' CD1' ' A' ' 69' ' ' ILE . 0.9 OUTLIER -74.85 -31.5 61.67 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.135 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . 0.427 ' HE3' HG21 ' A' ' 69' ' ' ILE . 0.0 OUTLIER -69.54 -40.94 76.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.692 -0.63 . . . . 0.0 109.425 179.4 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -31.0 71.47 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.248 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.417 ' HE2' HD23 ' B' ' 193' ' ' LEU . 24.8 ttpt -63.68 -36.5 84.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.666 -0.646 . . . . 0.0 109.375 179.245 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 31.8 tp60 -62.82 -30.45 71.49 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.793 -0.567 . . . . 0.0 109.692 179.504 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -61.28 -42.75 99.17 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.711 -0.618 . . . . 0.0 109.898 179.685 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -62.3 -43.02 99.8 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.707 -0.621 . . . . 0.0 109.84 179.719 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.491 HD23 ' HG ' ' A' ' 62' ' ' LEU . 14.0 tp -72.66 -30.27 64.13 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.659 -0.651 . . . . 0.0 109.656 179.46 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -77.75 -30.71 51.71 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.608 -0.683 . . . . 0.0 109.889 179.548 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -77.59 -29.09 51.83 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.634 -0.667 . . . . 0.0 109.94 179.726 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -78.69 -28.74 45.25 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.62 -0.675 . . . . 0.0 109.941 179.646 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.92 -25.7 43.71 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.661 -0.649 . . . . 0.0 110.259 179.738 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.36 -25.43 29.16 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.54 -0.725 . . . . 0.0 110.244 179.913 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 13.8 mmtt -57.46 110.34 2.4 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.524 -0.735 . . . . 0.0 110.362 -179.954 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 C--N 1.319 -0.993 0 O-C-N 123.231 1.122 . . . . 0.0 110.427 -179.893 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.13 0.49 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -89.73 -169.82 2.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.6 -0.688 . . . . 0.0 110.191 179.955 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 52.89 27.61 5.67 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.48 -0.763 . . . . 0.0 110.844 179.952 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.13 -42.44 1.71 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.562 -0.712 . . . . 0.0 110.242 179.96 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.48 -27.62 69.4 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.68 -0.637 . . . . 0.0 110.205 179.872 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -71.29 -28.63 64.26 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.593 -0.692 . . . . 0.0 110.264 -179.981 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.16 -32.16 69.99 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.553 -0.717 . . . . 0.0 110.05 179.879 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -30.49 70.95 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.632 -0.667 . . . . 0.0 109.939 179.813 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.1 m -65.04 -29.04 69.9 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.672 -0.642 . . . . 0.0 110.044 179.807 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.555 ' HG ' HD23 ' B' ' 200' ' ' LEU . 0.6 OUTLIER -64.83 -28.4 69.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.655 -0.653 . . . . 0.0 110.223 179.93 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -75.42 -36.72 60.76 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.573 -0.705 . . . . 0.0 110.113 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -74.49 -30.54 61.86 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.691 -0.63 . . . . 0.0 109.922 179.735 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 70.4 m -74.81 -29.26 61.03 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.617 -0.677 . . . . 0.0 109.832 179.505 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.0 mmtt -72.47 -26.9 61.98 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.612 -0.68 . . . . 0.0 110.219 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.27 -31.89 64.34 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.521 -0.737 . . . . 0.0 110.305 179.986 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.9 tp60 -75.91 -33.36 59.9 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.525 -0.734 . . . . 0.0 109.877 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.659 HG12 HD23 ' B' ' 193' ' ' LEU . 88.3 mt -74.16 -26.87 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.663 -0.648 . . . . 0.0 109.8 179.706 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.573 ' O ' HD23 ' A' ' 70' ' ' LEU . 6.6 tt -74.93 -37.42 62.04 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.487 -0.758 . . . . 0.0 109.499 179.331 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -62.6 -29.91 70.95 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.646 -0.659 . . . . 0.0 109.521 179.202 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.615 HD22 HG12 ' B' ' 190' ' ' ILE . 12.5 mt -60.72 -30.01 69.71 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.616 -0.678 . . . . 0.0 109.935 179.654 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -61.99 -38.17 87.58 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.647 -0.658 . . . . 0.0 109.776 179.763 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.96 -31.85 56.87 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.217 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.482 ' O ' HD23 ' A' ' 79' ' ' LEU . 4.8 tttm -75.43 -31.56 60.39 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.82 -0.55 . . . . 0.0 109.781 179.561 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 46.9 tp -76.03 -33.36 59.64 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.592 -0.692 . . . . 0.0 109.709 179.633 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.2 tt -75.35 -35.37 61.15 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.728 -0.607 . . . . 0.0 109.473 179.314 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.51 68.19 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 120.228 -0.589 . . . . 0.0 109.656 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.482 HD23 ' O ' ' A' ' 75' ' ' LYS . 1.0 OUTLIER -68.75 -43.92 74.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.616 -0.678 . . . . 0.0 109.828 179.73 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -66.86 -31.12 71.52 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.586 -0.697 . . . . 0.0 109.623 179.586 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -68.05 -28.4 67.35 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.671 -0.643 . . . . 0.0 109.819 179.546 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.5 -43.27 85.76 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.57 -0.706 . . . . 0.0 109.954 179.858 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.51 ' HA ' HG11 ' B' ' 179' ' ' VAL . 8.8 ttpp -62.62 -30.13 71.12 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.593 -0.692 . . . . 0.0 109.822 179.818 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -64.48 -38.6 91.58 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.564 -0.71 . . . . 0.0 109.75 179.799 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -64.7 -29.43 70.42 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.707 -0.621 . . . . 0.0 109.708 179.59 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.442 HD12 ' HG3' ' B' ' 176' ' ' MET . 0.3 OUTLIER -65.1 -31.74 73.1 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.68 -0.637 . . . . 0.0 109.793 179.822 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -66.48 -45.68 78.85 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.663 -0.648 . . . . 0.0 110.143 179.998 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.8 mp -62.21 -32.71 73.4 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.69 -0.631 . . . . 0.0 109.899 179.777 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.416 ' O ' HD13 ' B' ' 172' ' ' LEU . 6.8 mt-30 -86.71 -22.04 26.28 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.732 -0.605 . . . . 0.0 110.372 179.714 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.789 HD11 ' CD1' ' B' ' 173' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.957 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.634 -179.907 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.734 HD12 ' N ' ' B' ' 168' ' ' SER . 2.8 pp -140.16 -44.92 0.42 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.59 -0.947 . . . . 0.0 110.582 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.734 ' N ' HD12 ' B' ' 167' ' ' LEU . 10.5 t -153.81 15.12 0.49 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.354 -0.841 . . . . 0.0 111.35 -179.99 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.0 tptt 49.64 26.41 1.78 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.091 -1.006 . . . . 0.0 111.048 -179.835 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -152.5 -46.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.697 -0.627 . . . . 0.0 110.052 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.549 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.7 OUTLIER -74.44 -34.62 63.24 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.215 179.45 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.563 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.5 tt -75.92 -27.32 57.57 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.864 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.789 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.8 mm -68.76 -32.02 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.627 -0.671 . . . . 0.0 109.336 179.331 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -72.98 -28.51 62.44 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.725 -0.609 . . . . 0.0 109.891 179.542 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.805 ' O ' HG23 ' B' ' 179' ' ' VAL . 78.7 m-20 -71.48 -29.52 64.92 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.682 -0.636 . . . . 0.0 109.994 179.818 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.637 ' HE3' HD23 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -69.28 -30.73 68.88 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.583 -0.698 . . . . 0.0 109.871 179.923 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -77.03 -31.41 56.27 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.707 -0.621 . . . . 0.0 109.718 179.67 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 5.2 tpm_? -74.51 -30.26 61.73 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.675 -0.641 . . . . 0.0 109.784 179.57 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.805 HG23 ' O ' ' B' ' 175' ' ' ASN . 65.4 t -71.79 -29.78 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.685 -0.635 . . . . 0.0 109.735 179.66 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -78.26 -23.46 47.27 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.614 -0.679 . . . . 0.0 110.306 179.751 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.48 -28.41 37.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.437 -0.789 . . . . 0.0 109.087 179.448 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -72.0 -29.4 64.17 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.49 -0.756 . . . . 0.0 109.952 179.613 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . . . . . . . . . 84.8 mt -73.83 -29.66 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.647 -0.658 . . . . 0.0 109.826 179.808 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 12.9 m -72.86 -30.14 63.74 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.622 -0.674 . . . . 0.0 109.96 179.787 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.7 mtt -73.99 -40.71 62.77 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.673 -0.642 . . . . 0.0 109.906 179.767 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.4 t -71.48 -30.37 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.621 -0.674 . . . . 0.0 109.577 179.718 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -73.34 -28.81 62.27 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.616 -0.677 . . . . 0.0 109.991 179.638 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.39 -28.51 63.04 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.575 -0.703 . . . . 0.0 110.085 179.806 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -30.66 58.54 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.565 -0.71 . . . . 0.0 110.082 179.969 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.615 HG12 HD22 ' A' ' 72' ' ' LEU . 76.4 mt -76.79 -31.13 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.583 -0.698 . . . . 0.0 109.789 179.834 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 14.7 m -73.78 -31.27 63.22 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.744 -0.597 . . . . 0.0 109.609 179.37 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 26.1 mmtm -76.63 -34.73 58.31 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.416 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.659 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -70.17 -34.63 73.23 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.307 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -63.96 -45.15 90.42 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.331 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -71.31 -31.11 67.05 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.023 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -69.98 -35.03 74.11 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.222 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.11 -30.1 71.19 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.678 -0.639 . . . . 0.0 109.602 179.464 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -61.41 -43.05 99.53 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.742 -0.598 . . . . 0.0 109.92 179.695 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -61.97 -38.62 89.23 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.673 -0.642 . . . . 0.0 109.908 179.836 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.555 HD23 ' HG ' ' A' ' 62' ' ' LEU . 0.4 OUTLIER -75.08 -29.79 60.75 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.607 -0.683 . . . . 0.0 109.766 179.554 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.414 ' HA ' HD11 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -78.5 -29.45 46.63 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.634 -0.666 . . . . 0.0 109.802 179.676 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -79.12 -29.66 43.32 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.506 -0.746 . . . . 0.0 109.828 179.706 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -78.51 -28.15 46.22 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.573 -0.704 . . . . 0.0 109.87 179.618 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -78.69 -24.17 45.21 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.581 -0.699 . . . . 0.0 110.338 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -84.36 -25.54 29.07 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.38 -0.825 . . . . 0.0 110.268 179.875 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.7 149.85 69.8 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.481 -0.762 . . . . 0.0 110.32 179.993 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 C--N 1.318 -1.072 0 O-C-N 123.339 1.179 . . . . 0.0 110.414 -179.974 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.7 mptt . . . . . 0 N--CA 1.493 1.714 0 CA-C-O 121.161 0.505 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -115.34 -166.37 1.12 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.503 -0.748 . . . . 0.0 110.161 -179.948 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 53.32 26.11 5.01 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.329 -0.857 . . . . 0.0 110.788 -179.969 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.01 -29.34 15.27 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.615 -0.678 . . . . 0.0 110.0 179.804 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.78 -27.52 68.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.589 -0.694 . . . . 0.0 110.266 179.989 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -75.17 -29.08 60.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.572 -0.705 . . . . 0.0 110.108 179.934 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.2 ttm105 -76.3 -31.61 58.3 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.556 -0.715 . . . . 0.0 110.094 179.843 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.0 mtm -75.88 -30.36 58.83 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.6 -0.688 . . . . 0.0 109.886 179.716 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.4 p -75.49 -29.05 59.43 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.61 -0.681 . . . . 0.0 109.946 179.632 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.703 HD11 ' CG ' ' B' ' 201' ' ' GLU . 0.9 OUTLIER -74.06 -29.01 61.68 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.647 -0.658 . . . . 0.0 110.025 179.642 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -72.57 -34.62 67.59 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.552 -0.718 . . . . 0.0 109.917 179.798 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -76.46 -33.54 58.73 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.675 -0.641 . . . . 0.0 109.562 179.521 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.9 m -74.2 -30.8 62.37 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.732 -0.605 . . . . 0.0 109.428 179.351 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -69.76 -27.9 65.32 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.705 -0.622 . . . . 0.0 109.987 179.663 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.94 -37.69 75.93 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.473 -0.767 . . . . 0.0 110.15 179.982 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.13 -40.79 64.64 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.593 -0.692 . . . . 0.0 109.634 179.644 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.699 HG12 HD23 ' B' ' 193' ' ' LEU . 94.7 mt -68.29 -26.92 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.746 -0.596 . . . . 0.0 109.433 179.367 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.4 mt -67.09 -38.55 85.9 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.455 -0.778 . . . . 0.0 109.635 179.433 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -31.15 65.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.532 -0.73 . . . . 0.0 109.614 179.386 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.46 HD12 HD22 ' B' ' 193' ' ' LEU . 8.6 mt -71.69 -34.24 69.47 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.684 -0.635 . . . . 0.0 109.725 179.516 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -67.89 -30.83 70.27 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.587 -0.696 . . . . 0.0 109.746 179.652 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.31 -30.16 57.62 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.678 -0.639 . . . . 0.0 109.674 179.556 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -72.47 -29.15 63.39 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.712 -0.617 . . . . 0.0 109.884 179.667 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.1 tp -70.88 -35.56 72.41 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.515 -0.741 . . . . 0.0 109.838 179.817 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 87.9 mt -75.3 -32.73 61.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.696 -0.628 . . . . 0.0 109.664 179.606 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.83 -30.0 62.45 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.722 -0.611 . . . . 0.0 109.642 179.444 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.406 ' HA ' HD13 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -71.89 -39.7 69.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.677 -0.64 . . . . 0.0 109.694 179.65 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -71.82 -32.17 67.3 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.559 -0.713 . . . . 0.0 109.452 179.404 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -68.15 -29.77 68.74 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.79 -0.569 . . . . 0.0 109.544 179.348 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -62.84 -43.03 99.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.685 -0.635 . . . . 0.0 109.707 179.639 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -66.29 -32.27 73.57 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.554 -0.716 . . . . 0.0 109.484 179.48 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -63.74 -31.61 72.84 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.695 -0.628 . . . . 0.0 109.754 179.459 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -71.08 -35.11 71.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.642 -0.661 . . . . 0.0 109.619 179.566 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.716 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.2 OUTLIER -64.84 -30.18 71.17 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.568 -0.707 . . . . 0.0 109.637 179.559 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -61.93 -40.16 94.56 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.69 -0.631 . . . . 0.0 109.766 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.81 -30.71 71.68 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.704 -0.623 . . . . 0.0 109.738 179.64 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -84.14 -17.41 40.16 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.634 -0.666 . . . . 0.0 110.572 179.696 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.685 HD13 ' HE3' ' B' ' 176' ' ' MET . 53.1 tp . . . . . 0 N--CA 1.501 2.097 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.531 -179.939 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . 0.503 ' HA2' HD13 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.727 HD12 ' N ' ' B' ' 168' ' ' SER . 2.9 pp -139.54 -44.2 0.45 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.647 -0.913 . . . . 0.0 110.534 -179.917 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.727 ' N ' HD12 ' B' ' 167' ' ' LEU . 69.4 m -153.66 15.82 0.51 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.35 -0.843 . . . . 0.0 111.248 179.834 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 8.3 tptt 49.34 26.48 1.6 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.104 -0.998 . . . . 0.0 110.984 -179.789 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -151.65 -46.44 0.11 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.658 -0.651 . . . . 0.0 110.151 -179.926 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.611 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -73.58 -36.55 65.59 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.177 179.609 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.581 HD21 HD23 ' A' ' 86' ' ' LEU . 1.9 tt -74.22 -28.17 61.13 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.894 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.432 ' CD1' HD11 ' A' ' 90' ' ' LEU . 50.0 mm -66.89 -34.58 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 179.264 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -72.57 -29.07 63.21 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.611 179.257 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -70.63 -40.38 73.12 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.685 -0.634 . . . . 0.0 109.958 179.634 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.716 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -62.94 -30.77 71.82 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.655 -0.653 . . . . 0.0 109.749 179.87 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -75.45 -28.73 59.42 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.606 -0.684 . . . . 0.0 109.87 179.535 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -73.52 -31.31 63.62 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.563 -0.71 . . . . 0.0 110.139 179.893 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.557 HG21 ' CD1' ' A' ' 86' ' ' LEU . 57.6 t -72.26 -29.58 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.621 -0.674 . . . . 0.0 109.807 179.784 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . 0.45 ' HA ' HD12 ' B' ' 183' ' ' ILE . 4.0 t70 -72.55 -30.25 64.28 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.55 -0.719 . . . . 0.0 109.928 179.713 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 1.3 tpt85 -74.68 -28.99 61.06 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.757 -0.589 . . . . 0.0 109.913 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -73.96 -33.01 63.73 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.612 -0.68 . . . . 0.0 110.018 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.45 HD12 ' HA ' ' B' ' 180' ' ' ASP . 67.5 mt -71.17 -29.23 35.5 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 O-C-N 121.644 -0.66 . . . . 0.0 109.727 179.742 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -34.58 75.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.621 -0.674 . . . . 0.0 109.783 179.651 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 6.0 ttt -67.99 -46.28 71.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.68 -0.638 . . . . 0.0 109.815 179.674 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 61.3 t -68.54 -30.27 46.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.552 -0.717 . . . . 0.0 109.573 179.66 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -73.7 -29.44 62.28 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.669 -0.644 . . . . 0.0 109.916 179.659 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -72.04 -30.58 65.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.638 -0.664 . . . . 0.0 109.987 179.819 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -40.25 61.99 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.652 -0.655 . . . . 0.0 109.694 179.662 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.455 HG12 HD22 ' A' ' 72' ' ' LEU . 79.7 mt -70.5 -29.78 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.677 -0.639 . . . . 0.0 109.656 179.572 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -34.59 73.79 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.619 -0.675 . . . . 0.0 109.553 179.515 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 55.7 mmtt -75.86 -35.86 59.78 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.677 -0.64 . . . . 0.0 109.654 179.666 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.699 HD23 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -77.14 -19.72 56.52 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.694 -0.628 . . . . 0.0 110.257 179.466 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 22.3 mmtt -84.73 -28.43 26.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.279 -0.888 . . . . 0.0 109.455 179.316 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.4 mmtm -78.61 -36.25 44.42 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.733 -0.604 . . . . 0.0 109.734 179.48 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' B' ' 193' ' ' LEU . 0.0 OUTLIER -71.74 -28.06 63.41 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.494 179.41 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . 0.425 ' NE2' HD12 ' A' ' 69' ' ' ILE . 33.4 tt0 -68.64 -29.22 67.66 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.613 -0.679 . . . . 0.0 109.466 179.253 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -46.69 88.36 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.68 -0.638 . . . . 0.0 109.599 179.525 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -61.38 -35.89 78.75 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.738 -0.601 . . . . 0.0 109.881 179.669 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.675 HD23 HD12 ' A' ' 62' ' ' LEU . 6.8 tp -77.65 -31.86 52.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.574 -0.704 . . . . 0.0 109.601 179.412 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.703 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.3 mt-10 -79.59 -31.1 41.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.717 -0.615 . . . . 0.0 109.681 179.447 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -78.42 -29.01 46.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.593 -0.692 . . . . 0.0 109.662 179.453 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -75.94 -28.09 57.82 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.56 -0.713 . . . . 0.0 109.84 179.446 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -73.99 -24.87 59.66 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.574 -0.704 . . . . 0.0 110.29 179.779 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -89.09 -27.92 20.45 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.524 -0.735 . . . . 0.0 110.053 179.859 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -87.42 150.49 49.09 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.616 -0.678 . . . . 0.0 110.234 179.998 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo . . . . . 0 C--N 1.316 -1.137 0 O-C-N 123.376 1.198 . . . . 0.0 110.363 -179.94 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.6 mmmt . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.086 0.47 . . . . 0.0 110.238 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -95.94 -174.65 3.18 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.604 -0.685 . . . . 0.0 110.214 -179.935 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -101.87 -28.28 12.51 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.571 -0.706 . . . . 0.0 110.276 -179.989 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.78 -28.62 40.29 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.603 -0.686 . . . . 0.0 110.26 179.968 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -69.35 -28.38 66.16 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.636 -0.665 . . . . 0.0 110.162 179.885 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -71.28 -28.07 63.88 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.556 -0.715 . . . . 0.0 110.217 179.971 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.72 -31.09 67.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.626 -0.671 . . . . 0.0 110.123 179.918 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 mmt -73.06 -30.11 63.47 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.645 -0.659 . . . . 0.0 109.958 179.857 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.17 -28.59 64.36 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.655 -0.653 . . . . 0.0 109.942 179.664 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.8 tt -68.97 -29.24 67.43 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.621 -0.674 . . . . 0.0 110.026 179.854 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -67.58 -39.46 84.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.568 -0.708 . . . . 0.0 110.022 179.959 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -73.41 -30.82 63.5 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.675 -0.641 . . . . 0.0 109.753 179.624 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.2 m -74.44 -29.59 61.54 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.632 -0.667 . . . . 0.0 109.714 179.551 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mmtp -71.32 -28.12 63.87 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.655 -0.653 . . . . 0.0 110.047 179.711 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -70.21 -33.63 71.91 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.636 -0.665 . . . . 0.0 110.145 179.911 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -76.46 -34.36 58.7 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.651 -0.655 . . . . 0.0 109.857 179.669 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.739 HG12 HD22 ' B' ' 193' ' ' LEU . 74.5 mt -74.85 -27.87 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.667 -0.645 . . . . 0.0 109.683 179.498 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.467 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.3 tt -74.12 -29.72 61.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.587 -0.696 . . . . 0.0 109.982 179.666 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -74.74 -38.89 62.13 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.517 -0.739 . . . . 0.0 109.931 179.748 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.728 HD22 ' CD1' ' B' ' 193' ' ' LEU . 2.7 tp -70.9 -27.42 63.78 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.603 -0.686 . . . . 0.0 109.922 179.573 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -71.76 -33.25 68.49 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.541 -0.724 . . . . 0.0 109.553 179.371 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -74.31 -30.34 62.01 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.787 -0.571 . . . . 0.0 109.577 179.496 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.8 tttt -72.15 -37.7 69.33 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.586 -0.696 . . . . 0.0 109.824 179.685 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.579 HD13 ' HA ' ' B' ' 187' ' ' GLU . 24.1 tp -66.91 -31.16 71.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.56 -0.712 . . . . 0.0 109.967 179.703 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 tp -76.61 -34.14 58.39 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.683 -0.636 . . . . 0.0 109.849 179.75 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.65 -28.17 60.75 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 120.254 -0.578 . . . . 0.0 109.932 179.558 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.418 HD12 ' CG1' ' B' ' 183' ' ' ILE . 0.3 OUTLIER -76.07 -36.12 59.11 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.581 -0.699 . . . . 0.0 109.81 179.751 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -72.78 -29.06 62.98 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.576 -0.702 . . . . 0.0 109.886 179.618 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -72.36 -28.25 62.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.658 -0.651 . . . . 0.0 109.965 179.564 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.24 -41.21 70.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.673 -0.642 . . . . 0.0 110.033 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 tttm -65.19 -29.52 70.34 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.511 -0.743 . . . . 0.0 109.753 179.742 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -64.79 -33.4 75.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.599 -0.688 . . . . 0.0 109.83 179.662 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -69.27 -29.87 67.85 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.649 -0.657 . . . . 0.0 109.784 179.687 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.608 HD22 ' HG3' ' B' ' 176' ' ' MET . 0.3 OUTLIER -67.15 -37.04 83.09 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.695 -0.628 . . . . 0.0 109.893 179.738 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -61.52 -33.49 73.91 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.585 -0.697 . . . . 0.0 109.97 179.921 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.3 mp -77.99 -29.37 49.6 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.602 -0.686 . . . . 0.0 109.804 179.686 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -88.7 -21.01 24.11 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.655 -0.653 . . . . 0.0 110.545 179.799 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.497 ' HA ' HD22 ' B' ' 172' ' ' LEU . 54.1 tp . . . . . 0 N--CA 1.5 2.049 0 CA-C-O 118.014 -0.994 . . . . 0.0 110.545 -179.931 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . 0.637 ' HA3' HD13 ' B' ' 172' ' ' LEU . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.76 HD11 ' CB ' ' B' ' 171' ' ' GLU . 3.2 pp -143.08 -42.24 0.3 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.687 -0.89 . . . . 0.0 110.761 -179.527 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.734 ' N ' HD12 ' B' ' 167' ' ' LEU . 53.1 m -153.07 17.85 0.57 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.32 -0.863 . . . . 0.0 111.039 179.999 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.461 ' C ' HD13 ' B' ' 173' ' ' ILE . 4.8 tptm 49.73 26.63 1.92 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.244 -0.91 . . . . 0.0 110.884 -179.729 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -151.79 -46.77 0.11 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.7 -0.625 . . . . 0.0 110.133 -179.996 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.76 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.9 OUTLIER -74.48 -30.79 61.98 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.798 -0.761 . . . . 0.0 109.294 179.512 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.637 HD13 ' HA3' ' B' ' 166' ' ' GLY . 2.9 tt -78.31 -30.43 48.27 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.727 -0.608 . . . . 0.0 109.583 179.176 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.616 ' N ' HD12 ' B' ' 173' ' ' ILE . 1.9 mp -73.03 -33.97 44.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.409 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.23 -32.55 72.82 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.955 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.763 ' O ' HG23 ' B' ' 179' ' ' VAL . 84.7 m-20 -73.02 -38.57 66.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.715 -0.615 . . . . 0.0 109.427 179.222 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.608 ' HG3' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -64.79 -30.63 71.65 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.696 -0.628 . . . . 0.0 109.645 179.637 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -78.89 -30.95 45.2 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.655 -0.653 . . . . 0.0 109.831 179.738 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.37 -29.89 47.68 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.744 -0.597 . . . . 0.0 109.684 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.763 HG23 ' O ' ' B' ' 175' ' ' ASN . 68.4 t -76.3 -29.73 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.72 -0.613 . . . . 0.0 109.58 179.57 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -73.43 -30.59 63.32 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.523 -0.735 . . . . 0.0 109.915 179.833 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.21 -29.3 60.27 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.674 -0.642 . . . . 0.0 109.942 179.714 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . 0.664 ' O ' HG23 ' B' ' 186' ' ' VAL . 6.5 tt0 -75.93 -36.7 59.27 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.634 -0.666 . . . . 0.0 109.914 179.831 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.418 ' CG1' HD12 ' A' ' 79' ' ' LEU . 72.8 mt -71.28 -29.92 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.705 -0.622 . . . . 0.0 109.511 179.663 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 86.0 m -72.21 -39.32 68.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.61 -0.681 . . . . 0.0 109.743 179.594 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.6 mtp -72.53 -37.7 68.26 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.635 -0.665 . . . . 0.0 109.495 179.525 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . 0.664 HG23 ' O ' ' B' ' 182' ' ' GLU . 66.5 t -72.56 -34.79 49.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 179.283 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . 0.579 ' HA ' HD13 ' A' ' 76' ' ' LEU . 21.3 tt0 -64.87 -33.27 75.61 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.748 -0.595 . . . . 0.0 109.526 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -67.39 -26.1 66.28 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.677 -0.639 . . . . 0.0 109.933 179.562 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -76.31 -25.34 54.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.52 -0.737 . . . . 0.0 110.361 179.871 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.606 HD13 HD23 ' A' ' 72' ' ' LEU . 25.6 mm -80.38 -35.95 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.484 -0.76 . . . . 0.0 109.398 -179.945 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 14.9 m -76.01 -29.38 58.12 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.755 -0.591 . . . . 0.0 109.839 179.595 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 7.3 mmmt -77.51 -31.58 53.56 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.624 -0.672 . . . . 0.0 109.786 179.708 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.739 HD22 HG12 ' A' ' 69' ' ' ILE . 0.4 OUTLIER -75.68 -29.71 59.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.546 -0.721 . . . . 0.0 109.49 179.491 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -34.52 71.07 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.63 -0.669 . . . . 0.0 109.762 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -71.78 -31.23 66.39 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.676 -0.64 . . . . 0.0 109.71 179.561 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -68.4 -31.51 70.91 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.674 -0.641 . . . . 0.0 109.576 179.509 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -66.7 -30.43 70.67 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.69 -0.631 . . . . 0.0 109.734 179.533 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -62.65 -40.79 98.13 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.651 -0.656 . . . . 0.0 109.794 179.706 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -62.25 -39.73 93.83 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.779 179.681 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 8.7 tp -73.59 -33.21 64.51 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.563 -0.71 . . . . 0.0 109.71 179.473 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.84 -29.94 56.1 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.72 -0.612 . . . . 0.0 109.753 179.553 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -77.55 -29.05 52.02 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.609 -0.682 . . . . 0.0 109.953 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -78.06 -28.26 48.86 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.524 -0.735 . . . . 0.0 110.081 179.71 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -80.07 -26.23 39.72 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.585 -0.697 . . . . 0.0 110.289 179.868 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -89.32 -27.39 20.55 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.415 -0.803 . . . . 0.0 110.258 179.93 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -72.65 148.55 90.18 Favored Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.55 -0.719 . . . . 0.0 110.154 179.943 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo . . . . . 0 C--N 1.317 -1.085 0 O-C-N 123.402 1.211 . . . . 0.0 110.42 179.948 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.1 mttt . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.074 0.464 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -144.71 166.0 26.44 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.639 -0.663 . . . . 0.0 110.241 -179.921 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -94.27 -27.2 16.26 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.581 -0.699 . . . . 0.0 110.371 -179.963 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.7 ttt -74.81 -27.92 60.49 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.494 -0.754 . . . . 0.0 110.332 -179.983 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -66.75 -33.65 76.09 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.531 -0.73 . . . . 0.0 110.141 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -67.97 -29.88 69.02 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.613 -0.68 . . . . 0.0 109.916 179.735 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -66.07 -29.98 70.41 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.656 -0.653 . . . . 0.0 109.898 179.823 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -43.01 98.09 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.681 -0.637 . . . . 0.0 109.892 179.831 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 5.3 p -68.09 -30.82 70.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.655 -0.653 . . . . 0.0 109.78 179.686 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.677 HD11 ' HG2' ' B' ' 201' ' ' GLU . 0.4 OUTLIER -68.86 -29.07 67.3 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.813 179.617 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.92 -32.65 74.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.594 -0.691 . . . . 0.0 109.934 179.81 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -75.48 -36.98 60.52 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.598 -0.689 . . . . 0.0 109.771 179.68 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.47 HG23 ' NZ ' ' B' ' 196' ' ' LYS . 32.3 m -72.91 -30.57 64.02 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.694 -0.628 . . . . 0.0 109.557 179.438 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.488 ' O ' HD23 ' A' ' 70' ' ' LEU . 0.6 OUTLIER -70.04 -28.2 65.28 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.689 -0.632 . . . . 0.0 109.803 179.514 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -66.65 -37.92 85.8 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.585 -0.697 . . . . 0.0 110.081 179.926 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.46 -40.33 67.07 Favored 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.64 179.605 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.835 HG12 HD23 ' B' ' 193' ' ' LEU . 49.1 mt -68.41 -26.84 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.793 -0.567 . . . . 0.0 109.502 179.457 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.488 HD23 ' O ' ' A' ' 66' ' ' LYS . 0.7 OUTLIER -68.67 -37.42 79.6 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.533 -0.729 . . . . 0.0 109.796 179.563 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -68.39 -31.6 71.07 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.588 -0.695 . . . . 0.0 109.846 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.573 HD22 HG12 ' B' ' 190' ' ' ILE . 8.9 mt -68.65 -29.37 67.84 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.655 -0.653 . . . . 0.0 110.039 179.84 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -70.88 -31.16 67.74 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.595 -0.691 . . . . 0.0 109.958 179.824 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -78.12 -31.35 49.89 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.554 -0.716 . . . . 0.0 109.712 179.572 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -74.72 -29.45 61.19 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.707 -0.621 . . . . 0.0 109.771 179.506 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.549 HD13 HD12 ' B' ' 190' ' ' ILE . 14.8 tp -72.29 -34.77 68.41 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.626 -0.671 . . . . 0.0 109.883 179.756 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.8 mt -75.18 -36.45 61.47 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.643 -0.66 . . . . 0.0 109.426 179.513 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.12 -28.45 67.33 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.082 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' B' ' 183' ' ' ILE . 6.1 tp -67.9 -48.16 66.79 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.72 -0.613 . . . . 0.0 110.054 179.698 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -63.06 -25.91 68.6 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.612 -0.68 . . . . 0.0 110.366 179.868 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.57 -29.96 63.99 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.426 -0.796 . . . . 0.0 110.148 179.88 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -76.76 -46.9 23.41 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.591 -0.693 . . . . 0.0 109.603 179.555 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.667 ' HG3' HD11 ' B' ' 183' ' ' ILE . 11.3 mmtt -65.67 -24.34 66.99 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.647 -0.821 . . . . 0.0 108.815 178.686 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -60.82 -26.57 67.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.428 -0.795 . . . . 0.0 109.266 178.403 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.3 tp60 -59.15 -38.92 80.84 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.512 -0.743 . . . . 0.0 109.733 179.191 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.561 HD21 ' HB3' ' B' ' 175' ' ' ASN . 0.2 OUTLIER -67.69 -34.33 76.69 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 179.137 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -61.84 -29.82 70.43 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.741 -0.599 . . . . 0.0 109.818 179.524 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.07 -28.08 65.14 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.657 -0.652 . . . . 0.0 109.993 179.673 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -95.02 -7.24 40.27 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.623 -0.673 . . . . 0.0 111.063 179.946 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.017 HD23 ' HE3' ' B' ' 176' ' ' MET . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.034 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.418 -179.969 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.541 HD11 ' CB ' ' B' ' 171' ' ' GLU . 1.3 pp -50.92 -47.14 61.01 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.848 -0.795 . . . . 0.0 111.594 179.944 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.518 ' N ' HD12 ' B' ' 167' ' ' LEU . 7.6 t -152.96 15.99 0.56 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.228 -0.92 . . . . 0.0 111.278 179.982 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 6.9 tptm 49.7 26.33 1.8 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.179 -0.951 . . . . 0.0 110.985 -179.893 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -151.71 -46.83 0.11 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.659 -0.65 . . . . 0.0 109.974 -179.944 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.541 ' CB ' HD11 ' B' ' 167' ' ' LEU . 1.9 mt-10 -75.08 -32.21 61.41 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 119.881 -0.728 . . . . 0.0 109.182 179.407 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.569 ' O ' HD23 ' B' ' 172' ' ' LEU . 1.5 tt -78.45 -28.23 46.54 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 178.886 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.723 HD13 HD21 ' A' ' 90' ' ' LEU . 49.6 mm -71.69 -32.28 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.655 -0.653 . . . . 0.0 109.433 179.52 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 65.5 mm-40 -68.2 -32.79 73.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.655 -0.653 . . . . 0.0 109.671 179.541 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.676 ' O ' HG23 ' B' ' 179' ' ' VAL . 43.0 m-20 -63.52 -46.04 87.9 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.482 179.384 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 1.017 ' HE3' HD23 ' A' ' 90' ' ' LEU . 8.2 mtt -52.85 -31.86 41.56 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.665 -0.647 . . . . 0.0 110.73 179.765 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -68.8 -52.95 24.67 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.683 -0.635 . . . . 0.0 109.75 179.839 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -28.19 67.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.736 -0.603 . . . . 0.0 109.78 179.48 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.676 HG23 ' O ' ' B' ' 175' ' ' ASN . 94.3 t -77.88 -32.08 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.636 -0.665 . . . . 0.0 109.752 179.703 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -74.92 -31.38 61.52 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.562 -0.711 . . . . 0.0 109.64 179.553 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -25.27 64.18 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.724 -0.61 . . . . 0.0 109.86 179.345 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -68.62 -42.25 78.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.534 -0.729 . . . . 0.0 110.419 179.994 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.667 HD11 ' HG3' ' A' ' 83' ' ' LYS . 69.7 mt -66.94 -28.91 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.429 179.697 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 24.5 m -63.55 -32.05 73.39 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.608 -0.682 . . . . 0.0 109.623 179.43 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 1.2 ttt -68.52 -51.02 47.71 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.59 -0.694 . . . . 0.0 109.783 179.62 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.8 t -68.73 -31.61 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.546 -0.721 . . . . 0.0 109.425 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -75.3 -28.34 59.66 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.735 -0.603 . . . . 0.0 109.895 179.584 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -74.6 -27.87 60.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.605 -0.685 . . . . 0.0 110.085 179.76 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -74.23 -33.28 63.31 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.597 -0.689 . . . . 0.0 109.967 179.852 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.573 HG12 HD22 ' A' ' 72' ' ' LEU . 72.1 mt -73.26 -31.08 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.647 -0.658 . . . . 0.0 109.495 179.769 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.23 -31.81 71.57 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.716 -0.615 . . . . 0.0 109.48 179.377 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 23.7 mmtt -77.25 -34.1 55.87 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.678 -0.639 . . . . 0.0 109.511 179.381 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.835 HD23 HG12 ' A' ' 69' ' ' ILE . 0.1 OUTLIER -72.72 -31.49 65.01 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.294 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 9.9 tptp -66.5 -40.83 89.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.623 -0.673 . . . . 0.0 109.372 179.323 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.92 -30.41 70.55 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.224 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . 0.47 ' NZ ' HG23 ' A' ' 65' ' ' THR . 24.8 ttpt -63.35 -36.93 85.34 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.319 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -63.24 -30.64 71.75 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.692 -0.63 . . . . 0.0 109.519 179.464 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -61.32 -38.52 87.18 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.725 -0.609 . . . . 0.0 109.785 179.684 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.85 -39.83 93.21 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.719 -0.613 . . . . 0.0 109.862 179.772 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.8 tp -72.76 -30.7 64.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.658 -0.651 . . . . 0.0 109.831 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . 0.677 ' HG2' HD11 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -77.15 -30.22 54.97 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.61 -0.682 . . . . 0.0 109.782 179.639 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -75.86 -28.72 58.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.645 -0.659 . . . . 0.0 109.994 179.732 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.88 -27.85 57.9 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.559 -0.713 . . . . 0.0 110.184 179.752 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -77.75 -27.82 50.52 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.501 -0.749 . . . . 0.0 110.268 179.936 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -91.08 -28.11 18.15 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.627 -0.671 . . . . 0.0 110.28 179.991 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 15.2 mmtt -73.63 150.61 88.93 Favored Pre-proline 0 N--CA 1.496 1.832 0 O-C-N 121.518 -0.739 . . . . 0.0 110.18 -179.947 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.317 -1.113 0 O-C-N 123.334 1.176 . . . . 0.0 110.408 179.981 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.09 0.472 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -127.09 178.61 5.9 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.536 -0.727 . . . . 0.0 110.208 -179.986 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 52.93 29.01 7.18 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.434 -0.792 . . . . 0.0 110.84 -179.928 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.7 mtt -148.26 -45.45 0.16 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.588 -0.695 . . . . 0.0 110.222 -179.983 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -62.46 -27.69 69.3 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.706 -0.621 . . . . 0.0 110.352 -179.99 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -72.56 -27.92 62.5 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.534 -0.729 . . . . 0.0 110.359 -179.973 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -74.77 -28.7 60.85 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.54 -0.725 . . . . 0.0 110.218 179.956 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.3 mtt -73.99 -30.15 62.33 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.597 -0.69 . . . . 0.0 110.011 179.766 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.2 m -70.14 -29.07 65.9 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.639 -0.663 . . . . 0.0 109.942 179.606 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.906 HD12 HD23 ' B' ' 200' ' ' LEU . 7.4 tp -67.27 -28.79 68.32 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.621 -0.674 . . . . 0.0 110.066 179.725 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -66.27 -29.49 69.73 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.575 -0.703 . . . . 0.0 110.162 179.997 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -72.72 -44.61 61.48 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.589 -0.694 . . . . 0.0 109.886 179.786 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.499 HG22 HD11 ' A' ' 69' ' ' ILE . 51.6 m -65.27 -30.27 71.12 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.646 -0.659 . . . . 0.0 109.648 179.51 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -66.4 -28.22 68.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.704 -0.623 . . . . 0.0 109.945 179.608 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.15 -44.01 89.98 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.614 -0.679 . . . . 0.0 110.101 179.938 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -39.05 72.7 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.651 -0.656 . . . . 0.0 109.642 179.739 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.546 HG12 HD22 ' B' ' 193' ' ' LEU . 81.5 mt -71.03 -25.89 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.719 -0.613 . . . . 0.0 109.634 179.42 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.454 HD23 ' C ' ' A' ' 70' ' ' LEU . 10.2 tt -72.32 -34.42 68.06 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.534 -0.728 . . . . 0.0 110.001 179.755 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp -67.3 -36.63 81.9 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.491 -0.755 . . . . 0.0 109.91 179.806 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.667 HD22 ' CG1' ' B' ' 190' ' ' ILE . 7.3 mt -64.74 -28.29 69.49 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.669 -0.645 . . . . 0.0 109.944 179.748 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -66.08 -38.3 87.95 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.593 -0.692 . . . . 0.0 110.13 179.962 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.96 -31.08 61.39 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.611 -0.681 . . . . 0.0 109.743 179.654 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -77.9 -30.41 50.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.618 -0.676 . . . . 0.0 109.635 179.691 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -78.78 -30.87 45.82 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.62 -0.675 . . . . 0.0 109.725 179.604 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.5 mt -77.28 -30.54 54.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.642 -0.661 . . . . 0.0 109.753 179.584 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.01 -28.4 60.51 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.667 -0.646 . . . . 0.0 110.032 179.638 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.584 HD12 HG12 ' B' ' 183' ' ' ILE . 0.5 OUTLIER -76.65 -36.06 57.61 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.596 -0.69 . . . . 0.0 109.875 179.796 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -74.72 -27.38 60.35 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.616 -0.677 . . . . 0.0 109.993 179.731 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -76.53 -27.7 56.05 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.565 -0.709 . . . . 0.0 109.782 179.597 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.71 -41.95 59.24 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.663 -0.648 . . . . 0.0 109.886 179.63 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.41 ' HB3' HG11 ' B' ' 179' ' ' VAL . 11.4 ptmt -65.65 -26.31 67.74 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.758 -0.777 . . . . 0.0 109.672 179.362 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -63.8 -29.42 70.63 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.572 -0.705 . . . . 0.0 109.621 179.258 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -63.97 -35.43 80.67 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.6 -0.687 . . . . 0.0 109.877 179.717 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.55 HD22 ' HG2' ' B' ' 176' ' ' MET . 0.5 OUTLIER -66.01 -33.11 75.05 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.6 -0.688 . . . . 0.0 109.605 179.723 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.44 ' HA ' ' HE2' ' B' ' 176' ' ' MET . 6.7 m-85 -62.77 -29.27 70.57 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.609 -0.682 . . . . 0.0 110.049 179.782 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.35 -29.09 59.83 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.589 -0.695 . . . . 0.0 110.14 179.834 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -87.57 -26.66 23.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.653 -0.654 . . . . 0.0 110.371 179.894 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.494 HD22 ' HE3' ' B' ' 176' ' ' MET . 45.4 tp . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.21 -179.978 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' B' B ' 167' ' ' LEU . . . . . 0.718 HD12 ' N ' ' B' ' 168' ' ' SER . 3.0 pp -141.46 -42.94 0.36 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.567 -0.961 . . . . 0.0 110.724 -179.735 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 168' ' ' SER . . . . . 0.718 ' N ' HD12 ' B' ' 167' ' ' LEU . 48.1 t -153.34 16.97 0.54 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.317 -0.864 . . . . 0.0 111.234 179.934 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.469 ' C ' HD13 ' B' ' 173' ' ' ILE . 34.3 tptt 50.03 26.26 1.99 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.099 -1.001 . . . . 0.0 111.084 -179.954 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -154.3 -45.52 0.09 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.6 -0.687 . . . . 0.0 110.409 179.982 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.673 ' CB ' HD11 ' B' ' 167' ' ' LEU . 0.0 OUTLIER -74.48 -30.75 61.97 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.899 -0.72 . . . . 0.0 109.434 179.691 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' B' B ' 172' ' ' LEU . . . . . 0.495 HD21 HD23 ' A' ' 86' ' ' LEU . 3.3 tt -79.29 -29.56 42.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.733 -0.605 . . . . 0.0 109.601 179.18 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 173' ' ' ILE . . . . . 0.643 ' N ' HD12 ' B' ' 173' ' ' ILE . 2.5 mp -77.56 -34.55 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.405 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -65.27 -33.61 76.39 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.832 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.749 ' O ' HG23 ' B' ' 179' ' ' VAL . 81.4 m-20 -75.58 -36.21 60.4 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.976 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 176' ' ' MET . . . . . 0.55 ' HG2' HD22 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -68.05 -30.71 69.99 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.678 -0.638 . . . . 0.0 109.804 179.437 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' B' B ' 177' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -75.34 -34.51 61.2 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.644 -0.66 . . . . 0.0 109.677 179.655 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -30.05 67.99 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.689 -0.632 . . . . 0.0 109.63 179.488 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 179' ' ' VAL . . . . . 0.749 HG23 ' O ' ' B' ' 175' ' ' ASN . 82.4 t -66.28 -32.14 56.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.695 -0.628 . . . . 0.0 109.699 179.711 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.56 -43.18 90.63 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.7 -0.625 . . . . 0.0 109.93 179.882 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 181' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -34.07 75.59 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.733 -0.605 . . . . 0.0 109.97 179.8 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -71.16 -45.91 62.51 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.521 -0.737 . . . . 0.0 109.855 179.842 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 183' ' ' ILE . . . . . 0.584 HG12 HD12 ' A' ' 79' ' ' LEU . 78.0 mt -69.73 -29.45 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.649 -0.657 . . . . 0.0 109.38 179.513 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 87.7 m -70.22 -32.49 70.4 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.633 -0.667 . . . . 0.0 109.43 179.343 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 185' ' ' MET . . . . . . . . . . . . . 3.4 ttm -70.22 -48.33 57.49 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.623 -0.673 . . . . 0.0 109.754 179.511 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 186' ' ' VAL . . . . . . . . . . . . . 57.8 t -69.84 -31.32 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.551 -0.718 . . . . 0.0 109.376 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 187' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -73.99 -29.79 62.14 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.705 -0.622 . . . . 0.0 109.757 179.522 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 188' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.24 -30.7 67.83 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.625 -0.672 . . . . 0.0 109.827 179.54 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 189' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -37.65 67.64 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.673 -0.642 . . . . 0.0 109.621 179.652 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 190' ' ' ILE . . . . . 0.667 ' CG1' HD22 ' A' ' 72' ' ' LEU . 82.1 mt -69.26 -31.43 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.623 -0.673 . . . . 0.0 109.495 179.542 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 191' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.13 -41.59 85.88 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.659 -0.651 . . . . 0.0 109.617 179.55 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 192' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -70.69 -35.87 72.99 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.635 -0.665 . . . . 0.0 109.583 179.528 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 193' ' ' LEU . . . . . 0.546 HD22 HG12 ' A' ' 69' ' ' ILE . 0.2 OUTLIER -70.71 -31.32 68.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.673 -0.642 . . . . 0.0 109.501 179.399 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 10.4 tptp -69.14 -41.13 77.72 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.637 -0.664 . . . . 0.0 109.699 179.482 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -62.79 -31.69 72.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.665 -0.647 . . . . 0.0 109.508 179.518 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -37.16 86.17 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.696 -0.628 . . . . 0.0 109.382 179.256 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -62.72 -29.6 70.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.734 -0.604 . . . . 0.0 109.642 179.496 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.76 -43.61 98.52 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.632 -0.667 . . . . 0.0 109.741 179.695 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -63.09 -44.71 94.96 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.712 -0.618 . . . . 0.0 109.853 179.796 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.906 HD23 HD12 ' A' ' 62' ' ' LEU . 18.4 tp -71.6 -31.28 66.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.589 -0.694 . . . . 0.0 109.809 179.59 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -78.26 -29.92 48.32 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.622 -0.674 . . . . 0.0 109.834 179.595 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -78.07 -29.11 49.03 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.537 -0.727 . . . . 0.0 109.86 179.701 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.91 -28.11 49.65 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.66 -0.65 . . . . 0.0 110.034 179.596 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 204' ' ' ALA . . . . . . . . . . . . . . . -79.3 -24.8 42.61 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.621 -0.674 . . . . 0.0 110.394 179.874 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -86.33 -27.97 23.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.42 -0.8 . . . . 0.0 110.132 179.88 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 5.0 mtmt -65.85 156.1 84.54 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.622 -0.674 . . . . 0.0 110.141 -179.992 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 C--N 1.316 -1.154 0 O-C-N 123.391 1.206 . . . . 0.0 110.394 -179.927 . . . . . . . . 0 0 . 1 stop_ save_