data_1kls_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 1kls _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.46 ' CD1' ' HA ' ' A' ' 14' ' ' ASP . 2.4 m-85 . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 105.149 -2.167 . . . . 0.0 105.149 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -108.57 175.46 5.46 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 124.736 1.273 . . . . 0.0 109.255 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.2 t -89.92 172.73 8.66 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -118.66 13.97 13.43 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 123.862 0.726 . . . . 0.0 111.032 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -129.87 -47.92 1.13 Allowed 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.511 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.1 p -112.78 -116.47 0.32 Allowed 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -164.08 42.76 0.1 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -106.68 131.63 53.59 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.586 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.06 168.81 9.5 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.695 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.6 t -129.15 -83.84 0.56 Allowed 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -164.88 -66.99 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 103.07 -2.937 . . . . 0.0 103.07 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.46 ' HA ' ' CD1' ' A' ' 3' ' ' TYR . 2.4 m-20 -134.44 162.28 32.67 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 124.782 1.301 . . . . 0.0 110.961 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.3 p -36.67 -53.09 0.9 Allowed 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.813 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.6 p -15.39 -50.51 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 126.329 2.268 . . . . 0.0 116.905 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -106.28 -45.39 4.3 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 114.658 -1.156 . . . . 0.0 110.397 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.6 tt -40.78 -45.1 2.37 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.17 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -43.12 -49.69 6.29 Favored 'General case' 0 N--CA 1.507 2.408 0 CA-C-O 121.455 0.645 . . . . 0.0 111.172 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.8 m -57.15 -55.86 29.28 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.436 -1.256 . . . . 0.0 109.741 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -37.68 -61.37 0.63 Allowed 'General case' 0 N--CA 1.507 2.407 0 O-C-N 124.649 1.218 . . . . 0.0 109.454 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.0 mt -47.34 -69.13 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.2 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -40.42 -39.17 0.94 Allowed 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.2 p -92.21 -36.55 13.2 Favored 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 118.692 2.849 . . . . 0.0 118.692 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -95.07 -13.86 24.78 Favored 'General case' 0 N--CA 1.508 2.427 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.9 m-70 -122.02 -33.35 3.55 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.55 0.531 . . . . 0.0 109.829 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 79.1 p . . . . . 0 N--CA 1.5 2.045 0 O-C-N 124.871 1.357 . . . . 0.0 113.177 179.905 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 . . . . . 0 N--CA 1.496 1.859 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -137.8 165.65 25.93 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 44.6 t -82.18 161.13 22.88 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -119.76 28.7 7.97 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.151 0.907 . . . . 0.0 109.256 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -132.62 -55.12 0.95 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.005 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.7 p -111.72 -113.72 0.32 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.72 43.64 0.38 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.3 tt -90.62 148.91 22.35 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ptp85 -124.08 143.59 50.37 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 124.712 1.258 . . . . 0.0 111.099 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -140.52 168.43 19.81 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.423 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.16 2.75 11.43 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -125.51 -173.2 2.77 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.614 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.8 p -107.45 -49.69 3.21 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.5 p -42.21 -62.15 1.01 Allowed 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 121.922 0.868 . . . . 0.0 111.202 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -45.28 -48.94 12.95 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 113.728 -1.578 . . . . 0.0 111.223 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.25 -59.56 4.85 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.123 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -40.28 -53.69 2.5 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 124.234 0.959 . . . . 0.0 111.457 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.2 p -64.22 -51.02 65.71 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.445 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -37.78 -57.7 0.97 Allowed 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.4 mp -57.67 -62.65 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 124.764 1.29 . . . . 0.0 111.859 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 tttt -42.74 -37.57 1.8 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.5 m -83.19 -58.74 2.72 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 118.484 2.772 . . . . 0.0 118.484 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -87.48 -4.58 59.0 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 116.956 2.206 . . . . 0.0 116.956 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -125.76 -33.91 2.68 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.3 m . . . . . 0 N--CA 1.504 2.246 0 N-CA-C 118.67 2.841 . . . . 0.0 118.67 -179.64 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.439 ' CE2' ' HB2' ' A' ' 15' ' ' SER . 36.7 m-85 . . . . . 0 N--CA 1.493 1.711 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.521 HE22 ' H ' ' A' ' 6' ' ' GLN . 2.1 tm0? -114.07 154.88 26.97 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.469 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.8 t -72.43 -49.39 33.87 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 118.38 2.733 . . . . 0.0 118.38 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.521 ' H ' HE22 ' A' ' 4' ' ' GLN . 0.0 OUTLIER 72.93 17.12 4.31 Favored 'General case' 0 N--CA 1.509 2.488 0 C-N-CA 124.328 1.051 . . . . 0.0 112.456 -179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.469 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 24.4 m-85 -121.38 -50.36 2.12 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.418 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 24.3 p -111.56 -50.2 2.94 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.439 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 45.9 tp10 118.68 66.8 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 126.92 2.637 . . . . 0.0 110.108 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 14.5 tp -106.04 157.63 17.39 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.5 ttt85 -118.49 120.01 36.25 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.8 1.313 . . . . 0.0 108.535 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -122.53 149.58 43.73 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 122.845 1.307 . . . . 0.0 111.364 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -135.09 83.93 2.06 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 101.46 -3.533 . . . . 0.0 101.46 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.439 ' HB2' ' CD1' ' A' ' 3' ' ' TYR . 1.9 p30 -137.24 -153.61 0.5 Allowed 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 126.739 2.016 . . . . 0.0 106.973 0.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.439 ' HB2' ' CE2' ' A' ' 3' ' ' TYR . 43.7 t -26.02 -55.92 0.07 Allowed 'General case' 0 N--CA 1.503 2.211 0 O-C-N 124.23 0.957 . . . . 0.0 112.303 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.5 m -33.37 -38.81 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 CA-C-N 113.005 -1.907 . . . . 0.0 115.841 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -95.11 -50.78 4.92 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.817 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.8 tt -40.46 -46.38 2.42 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 123.853 0.721 . . . . 0.0 110.722 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -44.45 -56.17 4.48 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.118 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.0 p -66.3 -42.36 88.42 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 28.1 t60 -44.61 -61.39 1.58 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.77 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.3 mt -50.25 -61.8 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 O-C-N 124.604 1.19 . . . . 0.0 109.399 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -31.0 -52.23 0.18 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 125.468 1.73 . . . . 0.0 114.178 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.8 t -112.7 36.19 3.55 Favored 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -142.21 -35.38 0.43 Allowed 'General case' 0 N--CA 1.503 2.225 0 CA-C-O 121.411 0.625 . . . . 0.0 109.876 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -119.64 -64.39 1.27 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 113.857 -1.519 . . . . 0.0 107.144 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.495 1.822 0 O-C-N 125.673 1.858 . . . . 0.0 113.449 179.507 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -116.25 153.89 31.1 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 105.031 -2.211 . . . . 0.0 105.031 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 53.9 t -74.65 159.77 31.68 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.028 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -120.76 37.05 4.4 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.429 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 54.2 m-85 -137.5 -50.45 0.62 Allowed 'General case' 0 N--CA 1.496 1.872 0 CA-C-N 113.506 -1.679 . . . . 0.0 108.403 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -118.88 -124.35 0.28 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 103.942 -2.614 . . . . 0.0 103.942 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -157.06 48.95 0.44 Allowed 'General case' 0 N--CA 1.499 2.009 0 CA-C-O 121.483 0.659 . . . . 0.0 112.643 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.0 tt -109.23 160.33 16.2 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.711 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.2 mtp180 -117.4 145.51 44.05 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 123.844 0.715 . . . . 0.0 109.17 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.6 m -130.93 146.18 52.26 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 114.781 -1.099 . . . . 0.0 112.064 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -127.6 91.96 3.4 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 125.137 1.523 . . . . 0.0 107.934 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -122.42 -97.32 0.45 Allowed 'General case' 0 N--CA 1.501 2.113 0 CA-C-N 121.636 2.017 . . . . 0.0 110.067 0.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.512 ' N ' ' HB3' ' A' ' 16' ' ' SER . 79.7 p -144.37 63.99 1.31 Allowed 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.512 ' HB3' ' N ' ' A' ' 15' ' ' SER . 4.6 t 50.21 -155.31 0.12 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 117.224 -3.422 . . . . 0.0 112.848 0.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.41 ' N ' HD21 ' A' ' 17' ' ' ASN . 1.5 m120 -25.43 -30.15 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 118.592 2.812 . . . . 0.0 118.592 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -84.58 -59.91 2.22 Favored 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -46.37 -48.96 18.47 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.4 p -63.39 -51.85 64.1 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 113.093 -1.867 . . . . 0.0 109.959 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -41.05 -58.11 1.84 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 76.0 mt -52.02 -63.21 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 124.356 1.035 . . . . 0.0 108.822 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -31.7 -42.0 0.05 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 125.201 1.563 . . . . 0.0 113.853 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.595 ' HG1' ' HZ2' ' A' ' 25' ' ' LYS . 65.9 p -101.55 -42.82 6.1 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.595 ' HZ2' ' HG1' ' A' ' 24' ' ' THR . 13.6 mptt -80.24 -21.29 42.96 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -120.36 -37.17 3.08 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 123.704 0.627 . . . . 0.0 111.422 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.9 t . . . . . 0 N--CA 1.5 2.059 0 O-C-N 123.912 0.758 . . . . 0.0 111.464 -179.846 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.475 ' CZ ' ' HB2' ' A' ' 15' ' ' SER . 4.4 m-85 . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 103.975 -2.602 . . . . 0.0 103.975 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -132.15 160.43 36.07 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 119.401 -0.919 . . . . 0.0 113.283 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.431 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.5 t -102.44 149.96 23.85 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 114.029 -1.442 . . . . 0.0 108.676 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -120.93 41.78 3.21 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 124.209 0.943 . . . . 0.0 108.798 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.431 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 71.8 m-85 -131.66 -42.56 1.03 Allowed 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 113.55 -1.659 . . . . 0.0 109.944 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.7 p -116.07 -49.92 2.68 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 124.227 0.954 . . . . 0.0 111.7 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 144.39 -40.5 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.661 0 O-C-N 125.608 1.817 . . . . 0.0 109.612 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.5 tt -24.9 143.94 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 116.592 2.071 . . . . 0.0 116.592 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.7 ttt85 -124.35 145.89 49.16 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 113.469 -1.696 . . . . 0.0 106.987 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.6 p -124.87 164.43 20.07 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.81 0.94 20.63 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 123.836 0.71 . . . . 0.0 111.349 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -137.24 177.08 8.14 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 124.006 0.816 . . . . 0.0 110.355 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.475 ' HB2' ' CZ ' ' A' ' 3' ' ' TYR . 27.1 t -115.32 40.21 2.75 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.3 t -120.21 -49.87 2.27 Favored 'General case' 0 N--CA 1.496 1.825 0 CA-C-N 114.433 -1.258 . . . . 0.0 109.807 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -102.97 32.6 3.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.267 0.979 . . . . 0.0 110.905 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.418 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 2.7 tm? -109.21 -61.65 1.59 Allowed 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -46.29 -56.75 5.33 Favored 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 62.3 p -56.5 -45.14 81.16 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 112.767 -2.015 . . . . 0.0 110.407 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.418 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 82.4 t60 -43.77 -70.09 0.12 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 124.226 0.954 . . . . 0.0 110.796 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mp -47.5 -64.98 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.051 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -35.5 -52.37 0.65 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 68.0 p -114.99 26.94 9.76 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 116.694 2.109 . . . . 0.0 116.694 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.4 mmpt? -128.98 -32.77 2.04 Favored 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.7 m-70 -109.26 -27.76 9.37 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 124.168 0.917 . . . . 0.0 112.49 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.501 2.124 0 C-N-CA 118.685 -1.206 . . . . 0.0 108.958 179.777 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 24.4 m-85 . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -122.17 155.02 36.66 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.88 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.39 166.53 8.11 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.221 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -123.87 23.5 8.62 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.696 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.464 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 91.0 m-85 -139.57 -49.62 0.49 Allowed 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 115.721 1.749 . . . . 0.0 115.721 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.407 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 28.7 p -107.18 -64.36 1.2 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 118.218 -0.896 . . . . 0.0 112.889 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.407 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 14.3 pt-20 143.72 52.39 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.535 0 O-C-N 125.503 1.752 . . . . 0.0 110.927 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.7 tt -104.45 154.56 19.72 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.7 ptt85 -117.02 146.13 43.25 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 64.6 m -131.81 179.2 6.21 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 113.01 -1.904 . . . . 0.0 106.425 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -123.35 -38.17 2.59 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.953 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -125.33 165.34 18.53 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 124.25 0.969 . . . . 0.0 112.51 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 40.6 t -115.72 147.06 41.32 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 105.967 -1.864 . . . . 0.0 105.967 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 75.6 m -96.82 56.79 1.49 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 121.151 1.796 . . . . 0.0 112.15 0.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -98.39 12.97 33.24 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.0 -51.97 2.82 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 101.22 -3.622 . . . . 0.0 101.22 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -53.59 -46.23 70.27 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.9 m -43.33 -50.84 6.61 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 124.474 1.109 . . . . 0.0 110.598 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.565 ' HD1' ' HZ3' ' A' ' 25' ' ' LYS . 54.2 t60 -58.69 -63.2 1.37 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.529 1.143 . . . . 0.0 108.968 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.5 mt -41.62 -61.96 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 O-C-N 125.053 1.471 . . . . 0.0 111.119 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -37.54 -63.83 0.43 Allowed 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.709 -1.587 . . . . 0.0 112.881 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.8 m -66.08 -45.26 81.89 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 120.873 3.657 . . . . 0.0 120.873 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.565 ' HZ3' ' HD1' ' A' ' 21' ' ' HIS . 23.1 mttt -94.69 -7.53 40.44 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 -179.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.464 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 68.9 m-70 -126.75 -37.1 2.17 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 77.8 p . . . . . 0 N--CA 1.501 2.098 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 179.877 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 . . . . . 0 N--CA 1.499 1.993 0 CA-C-O 120.493 0.187 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -135.22 161.25 35.91 Favored 'General case' 0 N--CA 1.501 2.082 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.476 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 52.9 t -99.85 141.99 31.92 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.217 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -118.45 44.45 2.25 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 124.56 1.163 . . . . 0.0 109.027 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.483 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 79.1 m-85 -129.27 -46.8 1.21 Allowed 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 113.173 -1.83 . . . . 0.0 106.707 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -118.04 -52.24 2.42 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 124.577 1.173 . . . . 0.0 111.015 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 147.82 -39.47 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.772 0 O-C-N 125.025 1.453 . . . . 0.0 112.248 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.6 tt -29.92 153.43 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 116.625 2.084 . . . . 0.0 116.625 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 62.7 mtt-85 -119.22 152.17 37.09 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.622 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.5 m -124.05 -162.87 1.1 Allowed 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 113.91 -1.496 . . . . 0.0 107.574 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.24 -63.71 1.3 Allowed 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -124.42 171.57 9.84 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 124.221 0.95 . . . . 0.0 109.455 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.1 t -47.72 -52.34 18.79 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.52 ' HG ' ' H ' ' A' ' 17' ' ' ASN . 35.0 p -43.27 -50.89 6.46 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.901 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.52 ' H ' ' HG ' ' A' ' 16' ' ' SER . 1.4 t-20 -68.68 -48.72 63.22 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.441 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.8 -50.07 14.46 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -49.74 -56.15 11.3 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 179.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.5 m -40.46 -55.58 2.24 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 124.863 1.352 . . . . 0.0 108.769 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -53.37 -68.18 0.2 Allowed 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 113.069 -1.878 . . . . 0.0 109.277 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.3 mm -39.48 -67.03 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 124.536 1.148 . . . . 0.0 110.922 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -36.6 -52.51 0.88 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 124.812 1.32 . . . . 0.0 114.344 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.6 p -108.79 37.76 2.45 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 116.083 1.882 . . . . 0.0 116.083 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -144.81 -36.62 0.31 Allowed 'General case' 0 N--CA 1.501 2.09 0 CA-C-O 121.262 0.553 . . . . 0.0 109.543 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -127.75 -61.17 1.13 Allowed 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 87.4 p . . . . . 0 N--CA 1.508 2.429 0 O-C-N 126.758 2.536 . . . . 0.0 110.166 179.917 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 . . . . . 0 N--CA 1.495 1.806 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.7 tp60 -120.76 157.67 29.18 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.799 1.312 . . . . 0.0 108.257 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.9 t -99.89 149.31 23.53 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -119.15 43.64 2.54 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 122.19 0.995 . . . . 0.0 110.593 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -133.23 -52.06 0.89 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 112.994 -1.912 . . . . 0.0 105.868 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.9 p -119.51 -124.49 0.28 Allowed 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 102.149 -3.278 . . . . 0.0 102.149 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -147.61 56.21 1.09 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 123.993 0.808 . . . . 0.0 108.927 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.424 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 24.2 tp -105.29 139.19 40.31 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.033 -1.067 . . . . 0.0 111.61 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.424 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -134.92 146.44 49.16 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.583 -1.644 . . . . 0.0 111.569 179.392 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.582 ' HG ' HD22 ' A' ' 17' ' ' ASN . 37.2 t -142.03 171.96 13.35 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 112.875 -1.966 . . . . 0.0 108.449 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.17 -12.79 25.76 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -121.66 -173.69 2.7 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 124.26 0.975 . . . . 0.0 108.55 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.7 t -119.19 -38.46 3.04 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.8 p -31.66 -46.12 0.1 Allowed 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.582 HD22 ' HG ' ' A' ' 12' ' ' SER . 19.3 p30 -84.54 -36.82 21.89 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 119.017 -1.073 . . . . 0.0 109.969 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.6 tp -49.21 -41.61 37.63 Favored 'General case' 0 N--CA 1.503 2.22 0 CA-C-O 121.505 0.669 . . . . 0.0 109.837 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.7 tmtp? -51.97 -53.65 38.91 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -61.29 -52.94 62.6 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.118 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -35.41 -59.18 0.55 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.145 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 71.2 mt -53.06 -57.96 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-O 121.494 0.664 . . . . 0.0 109.361 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.41 ' HZ1' ' CB ' ' A' ' 23' ' ' LYS . 4.1 ttmp? -45.61 -41.86 10.61 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.689 -1.141 . . . . 0.0 113.094 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -87.68 -37.83 16.38 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 121.276 3.806 . . . . 0.0 121.276 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.3 mtpt -108.11 0.1 21.42 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 115.141 1.534 . . . . 0.0 115.141 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 47.3 m-70 -125.52 -40.25 2.1 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.3 p . . . . . 0 N--CA 1.504 2.249 0 C-N-CA 119.543 -0.863 . . . . 0.0 111.286 179.834 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 -112.88 114.95 27.69 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 124.011 0.819 . . . . 0.0 109.058 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 53.2 t -23.31 -70.48 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.46 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 7.9 tt0 109.62 -23.06 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.723 0 O-C-N 126.094 2.122 . . . . 0.0 110.305 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -99.5 -52.65 3.43 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.436 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 29.7 p -103.55 -49.45 3.69 Favored 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 34.4 tt0 119.12 64.02 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 126.695 2.497 . . . . 0.0 109.236 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.1 tt -106.51 137.64 44.14 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 103.461 -2.792 . . . . 0.0 103.461 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 24.9 ttp85 -115.0 134.49 55.14 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 122.27 1.033 . . . . 0.0 113.604 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 t -129.41 179.3 5.87 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 112.135 -2.302 . . . . 0.0 106.16 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -117.06 -21.41 8.88 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.086 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -141.33 -172.38 3.5 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 124.337 1.023 . . . . 0.0 108.774 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 16' ' ' SER . 30.7 t -105.75 171.71 7.19 Favored 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 15' ' ' SER . 25.1 t 101.02 -31.13 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.795 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -106.48 -16.15 14.61 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-N 113.071 -1.877 . . . . 0.0 109.61 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.41 -55.13 2.46 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 104.503 -2.406 . . . . 0.0 104.503 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 tppp? -50.7 -53.04 34.57 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 56.5 m -60.84 -50.35 73.8 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 114.31 -1.314 . . . . 0.0 108.44 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 39.2 t60 -40.6 -59.15 1.43 Allowed 'General case' 0 N--CA 1.503 2.206 0 O-C-N 124.091 0.87 . . . . 0.0 108.768 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.3 mt -54.15 -59.58 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 123.782 0.676 . . . . 0.0 109.786 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 22.1 mtmt -44.46 -28.97 0.63 Allowed 'General case' 0 N--CA 1.503 2.2 0 N-CA-C 114.779 1.399 . . . . 0.0 114.779 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.1 m -101.92 -40.91 6.68 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 118.138 2.644 . . . . 0.0 118.138 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -89.95 -14.93 33.06 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.9 m-70 -127.37 -46.55 1.47 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.0 t . . . . . 0 N--CA 1.495 1.801 0 O-C-N 124.423 1.077 . . . . 0.0 108.434 -179.739 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 . . . . . 0 N--CA 1.496 1.866 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -121.23 158.1 28.81 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 40.4 t -105.75 139.14 40.78 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 104.772 -2.307 . . . . 0.0 104.772 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -113.58 47.12 1.19 Allowed 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 122.701 1.238 . . . . 0.0 109.747 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 67.0 m-85 -136.08 -55.64 0.76 Allowed 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 112.263 -2.244 . . . . 0.0 108.548 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -121.3 -117.22 0.31 Allowed 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.337 1.023 . . . . 0.0 110.189 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.2 mp0 -122.16 -49.73 2.05 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 tt -23.49 129.93 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 117.04 2.237 . . . . 0.0 117.04 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -131.77 145.56 51.66 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.5 m -128.56 173.9 9.85 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 123.869 0.73 . . . . 0.0 110.212 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.17 35.14 3.73 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -132.4 -62.92 0.81 Allowed 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.353 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.4 t 125.61 -58.4 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 104.274 -2.491 . . . . 0.0 104.274 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.6 m -44.97 -58.07 3.4 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 124.149 0.906 . . . . 0.0 110.378 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -46.91 -60.56 2.36 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 114.182 -1.372 . . . . 0.0 110.255 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -50.99 -52.95 37.56 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.209 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -47.69 -55.95 8.36 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 121.093 0.473 . . . . 0.0 110.038 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.1 m -56.45 -47.37 79.28 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.059 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 37.4 t60 -50.4 -58.08 6.52 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 123.765 0.665 . . . . 0.0 109.654 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.6 mt -54.07 -60.34 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.48 -23.02 5.44 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 23.9 m -96.08 -45.16 7.0 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 117.725 2.491 . . . . 0.0 117.725 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -97.36 -7.25 32.33 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 56.6 m-70 -122.79 -48.09 2.04 Favored 'General case' 0 N--CA 1.501 2.11 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.077 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.95 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -123.6 164.06 19.78 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 51.0 t -93.79 155.24 17.32 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -114.37 32.08 6.17 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 124.003 0.814 . . . . 0.0 109.665 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -137.26 -53.91 0.69 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 114.746 -1.116 . . . . 0.0 111.141 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.7 p -114.62 -116.64 0.32 Allowed 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.44 52.37 0.53 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.558 0.694 . . . . 0.0 111.801 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.2 tt -105.65 140.42 38.74 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.6 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -122.97 152.18 41.13 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 124.412 1.07 . . . . 0.0 109.952 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.2 p -140.14 179.02 6.87 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.613 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -103.35 -43.92 5.3 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.021 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -109.68 -168.01 1.27 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 124.35 1.032 . . . . 0.0 110.339 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.476 ' HG ' ' H ' ' A' ' 16' ' ' SER . 68.8 p -97.51 -45.65 6.34 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.802 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.476 ' H ' ' HG ' ' A' ' 15' ' ' SER . 51.1 m -40.46 -52.07 2.81 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -80.23 1.92 26.51 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -107.29 -46.78 3.8 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.434 ' HG3' ' N ' ' A' ' 20' ' ' THR . 0.2 OUTLIER -55.84 -49.48 73.2 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.598 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.434 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 8.8 t -51.47 -40.98 60.55 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 123.645 0.591 . . . . 0.0 110.417 179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.3 t60 -59.88 -66.24 0.55 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.8 mt -46.29 -53.55 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-O 121.256 0.551 . . . . 0.0 109.944 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -38.55 -48.28 1.4 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.936 -1.484 . . . . 0.0 114.058 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.608 ' HG1' ' HZ3' ' A' ' 25' ' ' LYS . 44.9 p -110.07 -9.23 14.73 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -179.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.608 ' HZ3' ' HG1' ' A' ' 24' ' ' THR . 13.9 mptt -102.69 -22.54 13.93 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -127.82 -38.03 1.89 Allowed 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.503 2.211 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 -179.375 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.4 m-30 . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.516 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 64.7 tp60 -125.7 170.35 11.62 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 114.646 -1.161 . . . . 0.0 108.816 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.516 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 32.5 t -104.52 -54.51 2.51 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.442 ' H ' HE21 ' A' ' 4' ' ' GLN . 5.6 tt0 80.63 16.3 0.64 Allowed 'General case' 0 N--CA 1.505 2.294 0 O-C-N 125.252 1.595 . . . . 0.0 109.793 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -126.78 -45.71 1.59 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 118.974 -0.536 . . . . 0.0 112.404 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 p -116.16 -117.59 0.32 Allowed 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -140.27 28.09 2.08 Favored 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.7 tt -109.25 155.13 21.48 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.62 157.06 39.91 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 105.553 -2.017 . . . . 0.0 105.553 179.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -126.34 168.2 14.47 Favored 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 120.661 -0.416 . . . . 0.0 109.968 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.58 -52.49 2.76 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 124.01 0.819 . . . . 0.0 110.387 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -109.36 155.04 21.7 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 122.049 0.928 . . . . 0.0 110.347 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.1 m -49.57 -56.42 10.0 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 113.141 -1.845 . . . . 0.0 110.802 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.4 t -45.95 -62.67 1.22 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 124.545 1.153 . . . . 0.0 110.025 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -43.2 -58.19 2.62 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 124.417 1.073 . . . . 0.0 111.701 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -52.88 -57.04 11.58 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.3 mtmm -53.17 -49.3 66.93 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 119.819 -0.752 . . . . 0.0 109.829 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 67.1 m -53.39 -50.98 64.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 124.033 0.833 . . . . 0.0 109.029 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -51.02 -58.77 5.21 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.281 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.0 mt -57.39 -26.07 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.62 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.424 ' HZ2' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.05 -48.23 25.02 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.749 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.614 ' HG1' ' HZ1' ' A' ' 25' ' ' LYS . 80.9 p -85.33 -29.15 24.75 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.614 ' HZ1' ' HG1' ' A' ' 24' ' ' THR . 47.2 mmtm -101.55 -22.29 14.53 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 123.762 0.664 . . . . 0.0 110.569 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -131.68 33.69 3.98 Favored 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 119.018 -1.073 . . . . 0.0 113.099 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.0 p . . . . . 0 N--CA 1.513 2.682 0 O-C-N 124.413 1.07 . . . . 0.0 113.634 179.685 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 . . . . . 0 N--CA 1.496 1.852 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.402 ' NE2' HH21 ' A' ' 11' ' ' ARG . 2.2 tt0 -125.58 177.06 6.44 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.428 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 51.0 t -106.46 161.87 14.21 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.201 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -118.9 29.72 7.56 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 124.132 0.895 . . . . 0.0 108.895 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -137.19 -49.84 0.62 Allowed 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.063 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.0 p -114.75 -48.78 2.83 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 124.093 0.871 . . . . 0.0 110.991 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 129.56 -2.51 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.918 0 C-N-CA 127.054 2.142 . . . . 0.0 113.389 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -44.83 135.36 5.16 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 124.082 0.864 . . . . 0.0 109.314 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.402 HH21 ' NE2' ' A' ' 4' ' ' GLN . 4.6 ptp180 -124.03 144.55 49.77 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 124.396 1.06 . . . . 0.0 112.737 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.539 ' HG ' ' H ' ' A' ' 13' ' ' ALA . 23.3 t -126.98 -176.01 3.59 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-N 112.649 -2.069 . . . . 0.0 107.926 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.539 ' H ' ' HG ' ' A' ' 12' ' ' SER . . . -115.5 -9.2 12.1 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.303 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -135.74 -177.0 4.48 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 124.478 1.111 . . . . 0.0 111.782 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.5 m -113.61 38.87 2.8 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.031 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.7 t -117.71 -54.49 2.35 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 104.945 -2.243 . . . . 0.0 104.945 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -75.42 -43.03 52.1 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 113.514 -1.675 . . . . 0.0 109.385 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.54 -53.28 60.14 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.165 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.402 ' HD3' ' C ' ' A' ' 19' ' ' LYS . 13.1 tmtt? -50.31 -60.29 3.13 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 120.191 -0.603 . . . . 0.0 109.576 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.4 p -52.36 -42.27 63.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 123.804 0.69 . . . . 0.0 112.436 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -49.69 -62.65 1.44 Allowed 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.33 179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.41 HD12 ' H ' ' A' ' 22' ' ' ILE . 2.9 mp -50.07 -59.62 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 O-C-N 123.737 0.648 . . . . 0.0 110.473 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -36.58 -51.82 0.85 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 23.1 m -85.37 -42.6 14.4 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 119.358 3.095 . . . . 0.0 119.358 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.59 -8.34 56.38 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.16 0.913 . . . . 0.0 112.867 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -150.18 70.65 1.04 Allowed 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 102.506 -3.146 . . . . 0.0 102.506 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.7 p . . . . . 0 N--CA 1.501 2.075 0 O-C-N 118.702 -2.498 . . . . 0.0 109.757 0.401 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 N--CA 1.501 2.097 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.462 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 31.6 tt0 -121.75 173.97 7.13 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 124.995 1.434 . . . . 0.0 107.63 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 48.0 t -100.7 163.36 12.37 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.66 25.96 9.42 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 124.219 0.949 . . . . 0.0 109.676 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.483 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 63.2 m-85 -123.35 -53.83 1.8 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 107.243 -1.392 . . . . 0.0 107.243 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -118.04 -121.23 0.3 Allowed 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 104.116 -2.55 . . . . 0.0 104.116 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -159.42 51.28 0.35 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.541 0.686 . . . . 0.0 109.824 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.3 tt -106.48 158.51 16.86 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.938 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -118.95 161.75 19.67 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.193 0.997 . . . . 0.0 113.539 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.8 m -125.23 -158.81 0.85 Allowed 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 112.537 -2.119 . . . . 0.0 110.225 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.79 -55.0 2.54 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.8 p-10 -122.15 -43.95 2.3 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 116.121 1.896 . . . . 0.0 116.121 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.6 p 156.02 -49.49 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.8 p -47.09 -42.7 19.37 Favored 'General case' 0 N--CA 1.507 2.398 0 CA-C-O 121.51 0.672 . . . . 0.0 109.305 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -67.78 -47.52 68.95 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -46.13 -45.53 16.58 Favored 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 179.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -51.59 -59.65 4.03 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 124.314 1.009 . . . . 0.0 108.837 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.6 p -51.4 -46.27 62.8 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 124.111 0.882 . . . . 0.0 110.916 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -48.47 -66.69 0.36 Allowed 'General case' 0 N--CA 1.502 2.141 0 C-N-CA 119.811 -0.755 . . . . 0.0 109.02 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.1 mt -48.94 -55.74 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 124.264 0.978 . . . . 0.0 111.499 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -33.25 -57.72 0.4 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 125.193 1.558 . . . . 0.0 113.996 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 50.2 m -115.07 48.11 1.2 Allowed 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 122.233 1.016 . . . . 0.0 113.406 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -145.31 -39.1 0.25 Allowed 'General case' 0 N--CA 1.5 2.073 0 CA-C-N 114.664 -1.153 . . . . 0.0 109.539 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -121.36 -40.33 2.59 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 114.152 -1.385 . . . . 0.0 111.575 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 73.2 p . . . . . 0 N--CA 1.5 2.071 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -179.401 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.406 ' HG3' ' H ' ' A' ' 6' ' ' GLN . 4.1 tp-100 -124.28 156.22 37.29 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 124.425 1.078 . . . . 0.0 111.017 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 14.7 t -107.09 -17.87 14.05 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 114.435 -1.257 . . . . 0.0 113.819 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.406 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 9.7 pt20 40.89 30.39 0.09 Allowed 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 116.374 1.991 . . . . 0.0 116.374 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -135.43 -59.93 0.76 Allowed 'General case' 0 N--CA 1.504 2.259 0 N-CA-C 106.055 -1.831 . . . . 0.0 106.055 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.419 ' SG ' ' HB2' ' A' ' 10' ' ' LEU . 17.8 p -118.45 29.57 7.69 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 105.396 -2.076 . . . . 0.0 105.396 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 24.72 55.03 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 112.646 -2.07 . . . . 0.0 112.373 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.419 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 4.3 tp -90.96 146.42 23.89 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 104.132 -2.544 . . . . 0.0 104.132 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -114.35 149.32 36.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 124.325 1.016 . . . . 0.0 109.151 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.6 t -138.9 170.97 15.02 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.116 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.62 -4.59 10.28 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 125.137 1.523 . . . . 0.0 108.817 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -127.47 169.8 13.27 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.416 ' HG ' ' H ' ' A' ' 16' ' ' SER . 54.5 p -104.99 -45.79 4.45 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 124.206 0.942 . . . . 0.0 112.744 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.416 ' H ' ' HG ' ' A' ' 15' ' ' SER . 22.7 t -50.39 -53.35 29.9 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 122.071 0.939 . . . . 0.0 112.528 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.0 p-10 -60.33 -30.17 69.34 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.38 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -72.15 -53.41 12.78 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 118.862 -0.589 . . . . 0.0 110.19 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.411 ' NZ ' ' HA ' ' A' ' 16' ' ' SER . 17.6 pttm -52.15 -48.12 65.09 Favored 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.21 -1.396 . . . . 0.0 109.73 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.407 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 41.1 p -62.29 -51.06 69.2 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.743 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.462 ' CE1' ' HD2' ' A' ' 25' ' ' LYS . 68.1 t60 -38.11 -59.51 0.85 Allowed 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.031 0.443 . . . . 0.0 110.192 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 86.0 mt -54.64 -59.65 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.654 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -40.67 -42.78 1.8 Allowed 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.5 t -101.35 -19.86 15.44 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 120.107 3.373 . . . . 0.0 120.107 -179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.462 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 47.0 mttp -106.51 -14.62 15.01 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -122.75 -46.22 2.13 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 120.318 -0.553 . . . . 0.0 112.296 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.3 p . . . . . 0 N--CA 1.504 2.264 0 C-N-CA 118.146 -1.422 . . . . 0.0 108.178 179.952 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.406 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 4.9 m-85 . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.532 HE22 ' N ' ' A' ' 6' ' ' GLN . 8.6 tm0? -141.24 167.54 21.93 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 41.8 t -105.33 -68.61 0.85 Allowed 'General case' 0 N--CA 1.504 2.257 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.945 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.532 ' N ' HE22 ' A' ' 4' ' ' GLN . 3.1 tp-100 107.42 -27.09 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.572 0 O-C-N 125.816 1.947 . . . . 0.0 109.955 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -83.38 -46.02 13.03 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.768 0.668 . . . . 0.0 110.511 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -115.53 -40.85 3.33 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 109.42 49.03 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.176 0 O-C-N 126.887 2.617 . . . . 0.0 110.643 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.488 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 44.2 tp -98.39 158.97 15.25 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.488 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 55.7 mtt-85 -121.54 -176.91 3.41 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.297 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.592 ' HG ' ' H ' ' A' ' 15' ' ' SER . 24.0 t -141.24 -70.83 0.36 Allowed 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.738 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.442 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 108.49 -20.09 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.546 0 O-C-N 125.909 2.006 . . . . 0.0 109.047 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.459 ' O ' ' CB ' ' A' ' 15' ' ' SER . 3.6 p-10 -119.29 -45.42 2.54 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.592 ' H ' ' HG ' ' A' ' 12' ' ' SER . 37.5 t 121.85 -51.02 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.878 0 C-N-CA 126.016 1.727 . . . . 0.0 109.596 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.1 t -47.85 -52.46 19.04 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.846 0.831 . . . . 0.0 111.922 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.403 ' N ' HD21 ' A' ' 17' ' ' ASN . 1.9 m120 -64.71 2.71 0.63 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-N 112.714 -2.039 . . . . 0.0 114.379 -179.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -106.52 -52.03 2.85 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 103.533 -2.766 . . . . 0.0 103.533 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.591 ' HZ1' ' HG ' ' A' ' 15' ' ' SER . 21.4 mtmm -54.29 -54.45 40.09 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.294 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.5 t -62.99 -39.71 95.55 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 123.79 0.682 . . . . 0.0 109.259 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.406 ' CG ' HD21 ' A' ' 10' ' ' LEU . 13.8 t60 -51.01 -63.3 1.17 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 123.996 0.81 . . . . 0.0 109.219 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.6 mt -46.84 -59.83 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.452 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -49.48 -31.99 11.18 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -93.4 -41.1 10.01 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 118.067 2.617 . . . . 0.0 118.067 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -92.29 -15.24 27.68 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 -121.28 -43.48 2.42 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 123.444 0.465 . . . . 0.0 111.243 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.503 2.188 0 CA-C-O 122.112 0.958 . . . . 0.0 109.116 179.941 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 . . . . . 0 N--CA 1.492 1.668 1 N-CA-C 99.966 -4.087 . . . . 0.0 99.966 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.46 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 24.2 tt0 -107.73 161.67 14.67 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.606 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.46 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 36.0 t -87.0 162.61 17.54 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 113.163 -1.835 . . . . 0.0 108.632 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -122.73 36.79 4.56 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 124.297 0.998 . . . . 0.0 110.582 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -136.08 -49.48 0.68 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.708 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.407 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 27.3 p -111.82 -63.62 1.4 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.765 1.291 . . . . 0.0 110.605 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.407 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER 135.55 41.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.532 0 O-C-N 126.004 2.065 . . . . 0.0 108.932 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.402 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 49.7 tp -83.4 157.03 22.65 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.474 HH11 ' H ' ' A' ' 13' ' ' ALA . 10.9 ttp85 -119.55 119.53 34.07 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 125.279 1.612 . . . . 0.0 107.696 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -132.88 77.1 1.72 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.474 ' H ' HH11 ' A' ' 11' ' ' ARG . . . -75.75 68.55 2.33 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 122.717 1.246 . . . . 0.0 112.658 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -139.19 -61.35 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.567 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p 127.3 -62.1 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.476 0 O-C-N 126.803 2.564 . . . . 0.0 109.865 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 m -57.59 -54.92 41.46 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 121.49 0.662 . . . . 0.0 109.364 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -42.52 -51.73 4.97 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.605 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -56.62 -54.69 43.07 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.034 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -43.47 -59.04 2.31 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 124.105 0.878 . . . . 0.0 111.718 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.8 t -60.56 -48.42 81.85 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 117.373 -1.299 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -40.31 -64.55 0.5 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.427 1.012 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.4 mt -43.66 -64.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 124.606 1.191 . . . . 0.0 113.956 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -58.72 -32.6 69.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.7 p -104.14 23.98 12.17 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.8 mmmm -142.02 -28.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -119.29 -56.21 2.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 124.828 1.33 . . . . 0.0 108.651 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.501 2.079 0 O-C-N 126.092 2.12 . . . . 0.0 107.948 -179.985 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 . . . . . 0 N--CA 1.492 1.668 1 N-CA-C 99.966 -4.087 . . . . 0.0 99.966 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.46 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 24.2 tt0 -107.73 161.67 14.67 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.606 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.46 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 36.0 t -87.0 162.61 17.54 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 113.163 -1.835 . . . . 0.0 108.632 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -122.73 36.79 4.56 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 124.297 0.998 . . . . 0.0 110.582 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -136.08 -49.48 0.68 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.708 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.407 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 27.3 p -111.82 -63.62 1.4 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.765 1.291 . . . . 0.0 110.605 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.407 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER 135.55 41.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.532 0 O-C-N 126.004 2.065 . . . . 0.0 108.932 -179.808 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.402 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 49.7 tp -83.4 157.03 22.65 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.474 HH11 ' H ' ' A' ' 13' ' ' ALA . 10.9 ttp85 -119.55 119.53 34.07 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 125.279 1.612 . . . . 0.0 107.696 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -132.88 77.1 1.72 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.474 ' H ' HH11 ' A' ' 11' ' ' ARG . . . -75.75 68.55 2.33 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 122.717 1.246 . . . . 0.0 112.658 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -139.19 -61.35 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.567 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p 127.3 -62.1 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.476 0 O-C-N 126.803 2.564 . . . . 0.0 109.865 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 m -57.59 -54.92 41.46 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 121.49 0.662 . . . . 0.0 109.364 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -42.52 -51.73 4.97 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.605 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -56.62 -54.69 43.07 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.034 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -43.47 -59.04 2.31 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 124.105 0.878 . . . . 0.0 111.718 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.8 t -60.56 -48.42 81.85 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 117.373 -1.299 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -40.31 -64.55 0.5 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.427 1.012 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.4 mt -43.66 -64.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 124.606 1.191 . . . . 0.0 113.956 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -58.72 -32.6 69.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -179.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.7 p -104.14 23.98 12.17 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.8 mmmm -142.02 -28.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -119.29 -56.21 2.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 124.828 1.33 . . . . 0.0 108.651 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.501 2.079 0 O-C-N 126.092 2.12 . . . . 0.0 107.948 -179.985 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 104.207 -2.516 . . . . 0.0 104.207 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -124.96 144.56 50.3 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 125.591 1.807 . . . . 0.0 108.565 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.0 t -63.38 163.16 11.15 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 114.24 -1.346 . . . . 0.0 113.211 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -126.28 38.88 4.05 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.478 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 80.8 m-85 -139.47 -47.58 0.47 Allowed 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 114.331 -1.304 . . . . 0.0 112.325 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.8 p -109.69 -65.37 1.16 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 124.037 0.836 . . . . 0.0 112.465 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 140.14 41.73 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.596 0 C-N-CA 126.487 1.915 . . . . 0.0 110.264 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.8 tt -101.18 131.05 47.34 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.7 ptt85 -123.6 150.18 44.43 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 123.891 0.744 . . . . 0.0 110.032 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.519 ' CB ' HD22 ' A' ' 17' ' ' ASN . 53.7 p -128.25 -55.93 1.25 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 124.182 0.926 . . . . 0.0 112.076 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 118.03 -18.54 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.781 0 O-C-N 125.725 1.891 . . . . 0.0 109.542 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -129.3 -178.86 4.84 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.09 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.7 t -111.44 176.65 4.94 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.361 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.3 m 99.73 -52.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.549 0 C-N-CA 126.07 1.748 . . . . 0.0 106.691 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.519 HD22 ' CB ' ' A' ' 12' ' ' SER . 8.7 p-10 -79.86 -51.47 9.1 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.106 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.9 tp -60.87 -42.83 98.68 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.177 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.433 ' HZ3' ' HB3' ' A' ' 19' ' ' LYS . 3.1 mmmp? -52.55 -60.5 3.16 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 61.0 m -48.54 -57.46 6.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 124.984 1.427 . . . . 0.0 109.907 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -40.08 -71.23 0.08 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 124.828 1.33 . . . . 0.0 110.926 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -47.42 -63.04 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.399 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -39.03 -53.68 1.76 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.0 t -106.02 5.65 30.52 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 118.022 2.601 . . . . 0.0 118.022 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -113.6 -25.33 8.77 Favored 'General case' 0 N--CA 1.504 2.27 0 CA-C-N 118.241 0.473 . . . . 0.0 111.645 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.478 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 62.4 m-70 -115.72 -40.25 3.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 123.928 0.768 . . . . 0.0 112.793 -179.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.497 1.887 0 O-C-N 124.087 0.867 . . . . 0.0 111.563 -179.756 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.408 ' CD1' ' HA ' ' A' ' 14' ' ' ASP . 2.3 m-85 . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 121.856 0.836 . . . . 0.0 112.148 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -120.52 179.18 4.4 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 112.374 -2.194 . . . . 0.0 106.204 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 44.5 t -106.01 169.13 8.67 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -116.6 25.43 10.59 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 123.981 0.801 . . . . 0.0 109.789 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -141.39 -52.46 0.45 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.439 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.5 p -117.67 -125.91 0.28 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.74 25.56 3.38 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.834 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.558 HD21 ' H ' ' A' ' 11' ' ' ARG . 1.3 tm? -69.19 164.41 22.7 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.099 -1.04 . . . . 0.0 108.323 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.558 ' H ' HD21 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -132.68 147.9 52.34 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 112.507 -2.133 . . . . 0.0 108.256 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.43 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 68.9 m -126.34 -32.27 2.71 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -179.435 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.43 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 112.02 -53.29 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.487 0 O-C-N 126.307 2.254 . . . . 0.0 105.122 -179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' A' ' 15' ' ' SER . 35.1 t70 -137.02 -172.19 3.13 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 113.831 -1.531 . . . . 0.0 107.13 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.423 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 43.1 t -101.61 51.08 0.84 Allowed 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.6 t -122.98 -36.95 2.79 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 112.096 -2.32 . . . . 0.0 106.825 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.9 m-20 -106.36 -1.98 22.72 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.885 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 tp -85.39 -51.69 6.38 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -43.48 -47.74 7.2 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.164 0.915 . . . . 0.0 109.697 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.8 p -59.76 -59.43 5.44 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.233 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 51.7 t60 -41.98 -53.5 3.84 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 123.63 0.581 . . . . 0.0 109.555 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 67.2 mt -53.08 -58.95 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 123.995 0.809 . . . . 0.0 111.429 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -45.87 -39.38 8.53 Favored 'General case' 0 N--CA 1.504 2.267 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.9 m -92.35 -38.89 11.78 Favored 'General case' 0 N--CA 1.506 2.341 0 N-CA-C 119.08 2.992 . . . . 0.0 119.08 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -98.3 -6.72 30.39 Favored 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.9 m-70 -129.33 -47.93 1.19 Allowed 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.2 p . . . . . 0 N--CA 1.51 2.536 0 O-C-N 125.867 1.979 . . . . 0.0 113.408 -179.808 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.7 m-85 . . . . . 0 N--CA 1.502 2.162 0 N-CA-C 106.231 -1.766 . . . . 0.0 106.231 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -106.77 171.81 7.16 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 123.37 0.419 . . . . 0.0 110.294 -179.683 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 40.5 t -98.64 166.15 11.47 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 123.292 0.37 . . . . 0.0 111.638 -179.692 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -121.32 27.8 8.14 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 124.163 0.914 . . . . 0.0 110.996 -179.704 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -134.76 -51.89 0.79 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.132 -179.706 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 32.1 p -109.37 -46.24 3.59 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.243 0.965 . . . . 0.0 111.673 -179.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 135.9 -52.03 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.323 0 O-C-N 125.935 2.022 . . . . 0.0 108.386 -179.848 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.5 tt -22.06 130.7 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.461 0 O-C-N 125.377 1.673 . . . . 0.0 113.892 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -111.76 168.18 9.77 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.18 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.7 m -125.37 178.6 5.52 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-N 112.103 -2.317 . . . . 0.0 108.512 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.43 -31.39 10.94 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.281 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -117.36 -160.34 0.77 Allowed 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.682 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.9 p -99.87 -55.89 2.52 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 t -43.75 -50.03 7.82 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 124.085 0.866 . . . . 0.0 110.689 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -49.5 -61.2 2.23 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 114.295 -1.32 . . . . 0.0 110.615 179.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.08 -52.94 62.5 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.825 -179.911 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -40.61 -56.39 2.12 Favored 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 121.848 0.832 . . . . 0.0 109.341 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 87.4 m -55.61 -58.48 7.64 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 113.357 -1.747 . . . . 0.0 109.32 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -39.35 -60.78 0.87 Allowed 'General case' 0 N--CA 1.506 2.34 0 O-C-N 124.318 1.012 . . . . 0.0 109.915 179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.1 mm -48.27 -66.51 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.127 179.743 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -38.67 -46.2 1.2 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.6 t -93.32 -31.92 14.49 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 119.475 3.139 . . . . 0.0 119.475 -179.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -93.83 -17.1 23.44 Favored 'General case' 0 N--CA 1.503 2.179 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.772 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -122.55 -45.62 2.18 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 123.525 0.516 . . . . 0.0 111.525 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.1 p . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -179.851 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 . . . . . 0 N--CA 1.504 2.229 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.458 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 7.4 tt0 -126.68 169.71 12.86 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 179.69 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.506 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 51.5 t -100.84 154.54 18.56 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.758 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -127.04 42.99 3.21 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.506 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 63.9 m-85 -133.93 -51.17 0.84 Allowed 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 113.182 -1.827 . . . . 0.0 108.321 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 22.1 p -112.94 -52.98 2.75 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.547 1.154 . . . . 0.0 109.972 179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 148.79 -46.93 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.568 0 O-C-N 125.609 1.818 . . . . 0.0 107.813 -179.685 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -20.64 149.88 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.555 0 N-CA-C 116.693 2.108 . . . . 0.0 116.693 -179.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -106.1 155.54 19.32 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.226 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.2 t -134.63 159.37 41.43 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 114.165 -1.38 . . . . 0.0 107.839 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.14 -63.62 1.02 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 179.814 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -137.0 169.92 16.97 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 120.45 -0.5 . . . . 0.0 109.696 179.69 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.3 t -47.77 -51.73 21.3 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 87.0 p -35.09 -37.38 0.07 Allowed 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 111.62 -2.537 . . . . 0.0 113.983 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -97.83 -48.4 5.2 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 124.255 0.972 . . . . 0.0 109.529 -179.783 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.9 tp -39.2 -47.3 1.61 Allowed 'General case' 0 N--CA 1.503 2.217 0 CA-C-O 122.044 0.926 . . . . 0.0 111.147 179.548 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -42.64 -48.21 5.42 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.62 179.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.8 p -73.9 -41.94 61.38 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.851 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -43.98 -56.05 4.22 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 179.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.8 mt -49.6 -66.03 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-N 113.706 -1.588 . . . . 0.0 108.986 179.52 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -32.8 -43.46 0.09 Allowed 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 179.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 51.1 m -89.26 -45.56 9.43 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.148 2.647 . . . . 0.0 118.148 -179.539 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -83.89 -18.08 38.63 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 -179.332 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -124.28 -105.14 0.36 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 123.611 0.569 . . . . 0.0 111.067 -179.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 54.6 m . . . . . 0 N--CA 1.501 2.114 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -179.868 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 101.713 -3.44 . . . . 0.0 101.713 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -106.51 162.75 13.45 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -179.402 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 38.9 t -72.82 165.98 23.82 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 114.033 -1.44 . . . . 0.0 112.158 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -125.16 24.63 7.41 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.265 -179.918 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -127.5 -47.9 1.42 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.135 -179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.41 ' SG ' ' N ' ' A' ' 9' ' ' GLU . 30.5 p -116.02 -114.72 0.33 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.41 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 16.0 tp10 -136.81 -40.08 0.62 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 123.761 0.663 . . . . 0.0 112.442 -179.794 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -28.77 136.22 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -179.561 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.7 ptp180 -128.83 158.35 38.95 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.4 179.458 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -114.41 -163.13 0.85 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 105.308 -2.108 . . . . 0.0 105.308 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.47 -48.48 2.87 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -132.64 175.79 9.01 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 113.991 -1.459 . . . . 0.0 107.411 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.2 p -38.6 -36.97 0.28 Allowed 'General case' 0 N--CA 1.508 2.462 0 CA-C-O 122.789 1.28 . . . . 0.0 109.659 179.337 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.8 m -108.27 134.22 51.4 Favored 'General case' 0 C--N 1.308 -1.207 1 N-CA-C 98.925 -4.472 . . . . 0.0 98.925 179.798 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.5 65.25 0.77 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 118.877 -2.389 . . . . 0.0 113.32 0.49 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.8 tp -99.82 -50.93 3.87 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-N 113.485 -1.689 . . . . 0.0 107.34 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -36.64 -61.13 0.55 Allowed 'General case' 0 N--CA 1.507 2.392 0 O-C-N 124.082 0.863 . . . . 0.0 110.649 179.454 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.8 t -47.93 -49.72 29.21 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 113.833 -1.53 . . . . 0.0 111.539 179.767 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.404 ' ND1' ' HD2' ' A' ' 25' ' ' LYS . 74.6 t60 -48.88 -71.66 0.06 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 124.033 0.833 . . . . 0.0 110.788 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 51.3 mt -43.46 -48.47 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 124.362 1.039 . . . . 0.0 112.339 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -56.96 -55.98 27.66 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 92.8 m -79.59 -32.59 41.96 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 119.642 3.201 . . . . 0.0 119.642 -179.256 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.404 ' HD2' ' ND1' ' A' ' 21' ' ' HIS . 53.4 mttp -96.84 -11.71 24.49 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -179.312 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -129.44 -59.86 1.07 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.505 2.323 0 O-C-N 123.903 0.752 . . . . 0.0 111.21 -179.845 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 . . . . . 0 N--CA 1.495 1.804 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -129.41 166.92 18.61 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 39.8 t -83.85 161.18 20.99 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -122.95 32.98 5.53 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 123.771 0.669 . . . . 0.0 110.575 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -137.21 -42.24 0.57 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.997 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.8 p -110.77 -59.52 1.95 Allowed 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 160.74 -46.85 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.327 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -27.5 148.33 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 O-C-N 125.634 1.834 . . . . 0.0 115.123 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.6 ttm-85 -109.99 153.82 24.02 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.767 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.7 p -124.55 -174.91 3.13 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 179.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.05 -61.81 1.69 Allowed 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 120.557 -0.457 . . . . 0.0 109.906 -179.973 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.604 ' H ' HD22 ' A' ' 17' ' ' ASN . 39.4 m-20 -125.48 177.12 6.37 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 124.368 1.042 . . . . 0.0 112.159 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.6 t -94.99 46.62 1.13 Allowed 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 122.93 1.348 . . . . 0.0 110.629 -179.689 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.0 p -128.53 -28.38 2.52 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 112.672 -2.058 . . . . 0.0 105.979 179.572 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.604 HD22 ' H ' ' A' ' 14' ' ' ASP . 1.1 p30 -107.09 -49.43 3.28 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 113.042 -1.89 . . . . 0.0 110.894 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 62.1 tp -40.82 -45.11 2.4 Favored 'General case' 0 N--CA 1.509 2.485 0 CA-C-N 117.977 0.353 . . . . 0.0 111.25 179.778 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -49.71 -60.79 2.56 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.949 179.624 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.5 t -50.47 -43.14 55.28 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 124.219 0.949 . . . . 0.0 111.286 -179.723 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -55.45 -64.14 0.94 Allowed 'General case' 0 N--CA 1.5 2.073 0 O-C-N 124.25 0.969 . . . . 0.0 109.273 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -49.41 -63.43 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.002 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -38.91 -33.15 0.1 Allowed 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -179.932 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.1 m -97.1 -44.08 7.12 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 118.283 2.697 . . . . 0.0 118.283 -179.383 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -91.37 -12.97 33.33 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 115.286 1.588 . . . . 0.0 115.286 -179.366 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -127.2 -40.79 1.81 Allowed 'General case' 0 N--CA 1.496 1.87 0 O-C-N 123.733 0.645 . . . . 0.0 110.951 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 t . . . . . 0 N--CA 1.497 1.898 0 CA-C-N 114.15 -1.386 . . . . 0.0 108.002 -179.75 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 105.375 -2.083 . . . . 0.0 105.375 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -122.81 173.66 7.62 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-N 111.196 -2.729 . . . . 0.0 106.286 179.763 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.471 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 51.1 t -97.43 156.93 16.26 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.631 -179.868 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -121.46 37.08 4.43 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 124.268 0.98 . . . . 0.0 109.355 -179.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -133.12 -50.4 0.88 Allowed 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.093 -1.412 . . . . 0.0 109.043 179.867 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 27.5 p -113.25 -51.77 2.8 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 124.509 1.131 . . . . 0.0 108.431 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 33.7 tt0 112.97 61.08 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.599 0 O-C-N 126.305 2.253 . . . . 0.0 110.79 179.799 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.471 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 8.2 tt -107.37 135.66 48.48 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 104.642 -2.355 . . . . 0.0 104.642 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.1 ttt180 -115.16 147.72 39.91 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-O 121.838 0.828 . . . . 0.0 111.301 -179.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 62.2 m -118.64 -48.35 2.49 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-N 112.859 -1.973 . . . . 0.0 106.201 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.415 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 108.77 -38.22 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.431 0 O-C-N 126.633 2.458 . . . . 0.0 109.089 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -122.12 -176.67 3.4 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.978 -179.847 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.689 ' HG ' ' HG ' ' A' ' 16' ' ' SER . 0.4 OUTLIER -115.47 161.57 18.4 Favored 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 -179.985 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.689 ' HG ' ' HG ' ' A' ' 15' ' ' SER . 71.0 m -112.2 41.07 2.05 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 123.014 2.643 . . . . 0.0 107.88 0.019 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -72.04 -41.7 67.16 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 103.085 -2.931 . . . . 0.0 103.085 179.743 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.4 tp -57.08 -51.89 67.48 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.434 179.527 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -45.38 -58.52 3.27 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 179.708 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.6 m -48.35 -56.86 7.01 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.213 179.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -45.31 -67.5 0.28 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.828 0.705 . . . . 0.0 109.701 179.642 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.8 mm -37.92 -57.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 124.622 1.201 . . . . 0.0 112.775 179.835 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -58.16 -40.27 80.97 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 63.9 p -88.41 -32.13 18.49 Favored 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -179.592 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -92.77 -24.74 18.46 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 123.73 0.644 . . . . 0.0 110.895 -179.943 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -127.55 29.77 5.45 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 123.892 0.745 . . . . 0.0 111.881 179.979 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.8 t . . . . . 0 N--CA 1.504 2.27 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 179.372 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.431 ' CE2' ' HA ' ' A' ' 15' ' ' SER . 7.2 m-85 . . . . . 0 N--CA 1.492 1.632 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.454 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 1.6 tt0 -113.61 -170.68 1.74 Allowed 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 103.853 -2.647 . . . . 0.0 103.853 179.579 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.454 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 50.1 t -107.04 158.35 17.12 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -122.9 36.09 4.73 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 179.807 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.425 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 86.3 m-85 -137.94 -54.78 0.66 Allowed 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 113.961 -1.472 . . . . 0.0 108.779 179.966 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.3 p -117.6 -129.38 0.29 Allowed 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 102.302 -3.222 . . . . 0.0 102.302 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -147.64 52.2 1.05 Allowed 'General case' 0 N--CA 1.501 2.089 0 O-C-N 123.692 0.62 . . . . 0.0 111.967 -179.696 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.9 tt -107.62 148.87 28.76 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.23 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -107.04 145.27 32.56 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 124.585 1.178 . . . . 0.0 108.005 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.407 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 58.3 m -114.9 -43.51 3.11 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.754 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.407 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 110.15 -60.76 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.291 0 O-C-N 126.55 2.406 . . . . 0.0 105.621 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -135.9 162.47 32.75 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.859 1.35 . . . . 0.0 110.283 179.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.431 ' HA ' ' CE2' ' A' ' 3' ' ' TYR . 1.9 t -37.01 -52.7 0.97 Allowed 'General case' 0 N--CA 1.505 2.32 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.049 179.588 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.7 t -27.86 -41.42 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 CA-C-N 112.91 -1.95 . . . . 0.0 116.187 179.813 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -105.04 -37.66 6.86 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 123.693 0.62 . . . . 0.0 111.077 -179.564 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 tp -48.5 -27.29 2.61 Favored 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.427 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 10.2 mtpm? -106.46 124.73 50.04 Favored 'General case' 0 C--N 1.308 -1.207 1 N-CA-C 96.08 -5.526 . . . . 0.0 96.08 178.814 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.609 ' HG1' ' HG1' ' A' ' 24' ' ' THR . 19.2 p -97.38 26.83 4.58 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 119.256 -2.152 . . . . 0.0 114.605 0.678 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -44.07 -61.15 1.57 Allowed 'General case' 0 N--CA 1.507 2.377 0 CA-C-N 119.647 1.112 . . . . 0.0 109.963 179.769 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.4 mt -56.03 -69.75 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.258 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -31.99 -48.51 0.16 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 179.783 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.609 ' HG1' ' HG1' ' A' ' 20' ' ' THR . 33.4 m -95.13 -26.44 16.01 Favored 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 118.312 2.708 . . . . 0.0 118.312 -179.257 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -101.71 -10.69 19.76 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 -179.459 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.4 m-70 -129.05 -35.47 1.83 Allowed 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 115.549 1.685 . . . . 0.0 115.549 -179.952 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.1 t . . . . . 0 N--CA 1.501 2.083 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -179.453 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.7 tp60 -113.28 178.77 4.17 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.413 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 42.0 t -106.94 159.07 16.55 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 120.072 -0.651 . . . . 0.0 112.127 -179.912 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -123.21 33.52 5.36 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.02 -1.445 . . . . 0.0 110.292 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -134.74 -49.12 0.76 Allowed 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.682 -1.144 . . . . 0.0 108.278 179.894 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.6 p -115.66 -63.12 1.5 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 124.331 1.019 . . . . 0.0 109.568 179.794 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 132.79 49.25 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.575 0 C-N-CA 127.345 2.258 . . . . 0.0 109.592 -179.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.446 HD13 ' CE1' ' A' ' 21' ' ' HIS . 6.5 tt -98.22 153.27 18.61 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 179.856 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.9 ttm105 -107.73 137.25 46.09 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.973 -1.467 . . . . 0.0 109.432 -179.66 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.1 t -116.81 -51.54 2.57 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-N 113.854 -1.521 . . . . 0.0 107.669 179.874 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 92.09 -32.94 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.321 0 O-C-N 126.296 2.247 . . . . 0.0 110.385 179.982 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -136.58 136.23 39.08 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 124.253 0.971 . . . . 0.0 110.379 -179.872 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 53.4 p -39.75 -50.3 2.34 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 124.05 0.844 . . . . 0.0 109.555 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.9 t -29.82 -41.38 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 O-C-N 125.627 1.829 . . . . 0.0 115.39 179.593 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -102.29 -40.81 6.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 123.787 0.68 . . . . 0.0 109.696 -179.643 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -46.31 -42.92 15.37 Favored 'General case' 0 N--CA 1.505 2.31 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 179.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -45.85 -68.65 0.18 Allowed 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.905 179.347 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.5 p -53.94 -45.98 71.42 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 113.531 -1.668 . . . . 0.0 111.145 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.446 ' CE1' HD13 ' A' ' 10' ' ' LEU . 74.0 t60 -46.47 -65.38 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.671 1.232 . . . . 0.0 112.054 -179.954 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.7 mt -49.9 -56.65 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 124.292 0.995 . . . . 0.0 111.963 -179.645 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -51.12 -48.59 61.71 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -179.806 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 m -82.17 -37.09 26.64 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 118.609 2.818 . . . . 0.0 118.609 -179.218 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -96.31 -15.28 22.01 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -179.65 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -126.4 15.53 7.71 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.686 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.1 m . . . . . 0 N--CA 1.51 2.571 0 N-CA-C 115.789 1.774 . . . . 0.0 115.789 179.602 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.416 ' CE1' ' HA ' ' A' ' 14' ' ' ASP . 6.6 m-85 . . . . . 0 N--CA 1.494 1.751 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -131.91 164.15 26.74 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 179.704 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.41 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 42.3 t -106.34 159.34 16.21 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 105.903 -1.888 . . . . 0.0 105.903 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.449 ' NE2' ' N ' ' A' ' 6' ' ' GLN . 0.0 OUTLIER -122.82 35.03 4.98 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.887 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -132.36 -50.76 0.93 Allowed 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.81 -1.541 . . . . 0.0 108.676 179.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.5 p -112.69 -42.13 3.68 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.215 0.947 . . . . 0.0 109.282 179.849 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 97.19 54.07 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.138 0 O-C-N 126.265 2.228 . . . . 0.0 109.956 179.809 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.41 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 5.5 tt -104.23 148.32 26.47 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 103.434 -2.802 . . . . 0.0 103.434 179.652 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.402 ' HD2' ' C ' ' A' ' 10' ' ' LEU . 5.4 mpt_? -108.69 141.89 39.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 124.362 1.039 . . . . 0.0 110.69 -179.501 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.5 m -124.13 -166.47 1.5 Allowed 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 113.305 -1.77 . . . . 0.0 108.75 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -104.89 -42.82 5.24 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.753 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.577 ' H ' HD22 ' A' ' 17' ' ' ASN . 34.5 t70 -129.92 -165.54 1.55 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 123.94 0.775 . . . . 0.0 109.698 -179.803 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.504 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 45.5 t -93.01 -42.55 9.37 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 179.735 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.8 m -47.3 -43.69 22.77 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-O 121.944 0.878 . . . . 0.0 110.802 179.861 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.577 HD22 ' H ' ' A' ' 14' ' ' ASP . 16.8 p30 -83.53 -24.48 31.63 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.623 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 27.4 tp -67.79 -46.55 71.64 Favored 'General case' 0 N--CA 1.506 2.37 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 179.687 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -51.28 -52.45 44.95 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.0 m -57.36 -53.21 60.75 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.882 179.549 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -40.44 -59.59 1.29 Allowed 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.348 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -51.69 -60.47 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.96 179.633 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -34.89 -50.13 0.47 Allowed 'General case' 0 N--CA 1.503 2.206 0 O-C-N 124.539 1.15 . . . . 0.0 113.038 179.555 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.3 m -114.64 45.89 1.49 Allowed 'General case' 0 N--CA 1.501 2.12 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -179.751 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -156.09 -37.15 0.08 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 121.389 0.614 . . . . 0.0 110.406 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -119.65 -38.58 2.97 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-N 114.203 -1.362 . . . . 0.0 113.28 -179.252 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 p . . . . . 0 N--CA 1.496 1.843 0 O-C-N 124.275 0.985 . . . . 0.0 112.618 -179.596 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.467 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 1.0 OUTLIER . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 105.569 -2.011 . . . . 0.0 105.569 . . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -126.53 165.87 18.33 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 179.588 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.403 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 44.8 t -94.49 -66.19 0.93 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.96 -179.945 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 28.2 tt0 90.92 -10.5 0.28 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 125.13 1.519 . . . . 0.0 111.53 179.885 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -91.7 -47.51 7.33 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.733 -179.769 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.2 p -111.45 -24.26 10.27 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.925 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 94.16 53.61 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 126.775 2.03 . . . . 0.0 111.084 179.446 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.413 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 11.5 tp -107.64 162.34 14.06 Favored 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 114.122 -1.399 . . . . 0.0 107.482 179.79 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.413 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 15.3 ttt85 -125.27 157.94 35.35 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 179.452 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.9 m -122.54 176.02 6.15 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.411 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.25 -47.59 2.93 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 124.676 1.235 . . . . 0.0 110.018 -179.903 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -123.45 162.59 22.53 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 123.761 0.663 . . . . 0.0 110.192 -179.974 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.6 p -50.42 -47.64 56.55 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-O 121.837 0.827 . . . . 0.0 108.92 179.584 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.5 m -56.63 -55.16 37.45 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.4 -1.727 . . . . 0.0 108.192 -179.989 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -40.69 -54.23 2.64 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.873 179.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -64.04 -57.17 10.45 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.831 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp -39.92 -54.7 2.14 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 124.201 0.938 . . . . 0.0 110.932 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.2 p -60.44 -54.43 45.64 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.065 -179.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 44.6 t60 -42.98 -59.17 2.11 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 119.611 -0.835 . . . . 0.0 109.536 179.802 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.38 -69.71 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 124.277 0.985 . . . . 0.0 109.756 179.522 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mmtm -41.51 -34.17 0.53 Allowed 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 -179.762 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.0 m -91.46 -41.46 10.83 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 118.658 2.836 . . . . 0.0 118.658 -179.549 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -103.56 -4.9 23.3 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -132.76 -40.92 0.95 Allowed 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 81.7 p . . . . . 0 N--CA 1.504 2.245 0 O-C-N 125.187 1.554 . . . . 0.0 107.191 -179.198 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.513 ' CE1' ' HB2' ' A' ' 15' ' ' SER . 82.9 m-85 . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -111.94 163.77 13.87 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 104.284 -2.487 . . . . 0.0 104.284 -179.962 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.6 t -103.21 153.79 20.0 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.817 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -119.79 35.81 4.72 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 122.131 0.967 . . . . 0.0 109.278 -179.812 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -131.52 -52.25 1.01 Allowed 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 113.772 -1.558 . . . . 0.0 107.676 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.7 p -119.86 -116.82 0.32 Allowed 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 103.538 -2.764 . . . . 0.0 103.538 179.717 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -161.94 58.8 0.25 Allowed 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.395 0.617 . . . . 0.0 109.81 179.74 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.1 tt -107.28 115.25 29.84 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 179.816 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -116.31 137.04 52.48 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.587 -179.834 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.5 p -128.38 -174.84 3.33 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-N 112.486 -2.143 . . . . 0.0 109.0 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.07 -23.88 8.82 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.52 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -115.12 174.76 5.82 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.364 1.04 . . . . 0.0 110.687 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.513 ' HB2' ' CE1' ' A' ' 3' ' ' TYR . 22.2 t -115.23 52.45 0.87 Allowed 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.49 ' HG ' ' H ' ' A' ' 17' ' ' ASN . 32.3 p -110.72 -45.17 3.53 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 112.999 -1.91 . . . . 0.0 110.432 -179.698 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.49 ' H ' ' HG ' ' A' ' 16' ' ' SER . 5.4 m-80 -106.44 -14.65 15.02 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 125.383 1.677 . . . . 0.0 113.085 -179.879 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -74.13 -53.7 9.35 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.676 -179.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -47.85 -48.31 31.08 Favored 'General case' 0 N--CA 1.5 2.067 0 CA-C-O 121.196 0.522 . . . . 0.0 109.795 179.669 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.3 p -65.6 -52.4 52.37 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.263 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -36.3 -64.55 0.32 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 123.954 0.784 . . . . 0.0 110.354 179.58 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.6 mt -51.52 -61.01 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 123.751 0.657 . . . . 0.0 111.152 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -38.18 -43.31 0.75 Allowed 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.565 ' HG1' ' HZ1' ' A' ' 25' ' ' LYS . 70.9 p -98.63 -38.7 9.02 Favored 'General case' 0 N--CA 1.508 2.455 0 N-CA-C 120.008 3.336 . . . . 0.0 120.008 -179.407 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.565 ' HZ1' ' HG1' ' A' ' 24' ' ' THR . 47.8 mmtm -79.1 -26.27 42.96 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -179.235 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -116.04 -59.31 2.0 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.7 t . . . . . 0 N--CA 1.507 2.414 0 O-C-N 125.124 1.515 . . . . 0.0 111.7 179.797 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.9 pttp . . . . . 0 N--CA 1.492 1.652 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.9 t -130.68 -178.49 4.81 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 121.964 0.887 . . . . 0.0 108.754 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.46 ' CD1' ' HA ' ' A' ' 14' ' ' ASP . 2.4 m-85 -114.95 134.94 54.75 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 105.149 -2.167 . . . . 0.0 105.149 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -108.57 175.46 5.46 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 124.736 1.273 . . . . 0.0 109.255 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.2 t -89.92 172.73 8.66 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -118.66 13.97 13.43 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 123.862 0.726 . . . . 0.0 111.032 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -129.87 -47.92 1.13 Allowed 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.511 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.1 p -112.78 -116.47 0.32 Allowed 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -164.08 42.76 0.1 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -106.68 131.63 53.59 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.586 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.06 168.81 9.5 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.695 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.6 t -129.15 -83.84 0.56 Allowed 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -164.88 -66.99 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 103.07 -2.937 . . . . 0.0 103.07 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.46 ' HA ' ' CD1' ' A' ' 3' ' ' TYR . 2.4 m-20 -134.44 162.28 32.67 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 124.782 1.301 . . . . 0.0 110.961 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.3 p -36.67 -53.09 0.9 Allowed 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.813 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.6 p -15.39 -50.51 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 126.329 2.268 . . . . 0.0 116.905 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -106.28 -45.39 4.3 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 114.658 -1.156 . . . . 0.0 110.397 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.6 tt -40.78 -45.1 2.37 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.17 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -43.12 -49.69 6.29 Favored 'General case' 0 N--CA 1.507 2.408 0 CA-C-O 121.455 0.645 . . . . 0.0 111.172 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.8 m -57.15 -55.86 29.28 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.436 -1.256 . . . . 0.0 109.741 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -37.68 -61.37 0.63 Allowed 'General case' 0 N--CA 1.507 2.407 0 O-C-N 124.649 1.218 . . . . 0.0 109.454 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.0 mt -47.34 -69.13 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.2 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -40.42 -39.17 0.94 Allowed 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.2 p -92.21 -36.55 13.2 Favored 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 118.692 2.849 . . . . 0.0 118.692 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -95.07 -13.86 24.78 Favored 'General case' 0 N--CA 1.508 2.427 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.9 m-70 -122.02 -33.35 3.55 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.55 0.531 . . . . 0.0 109.829 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 79.1 p 40.25 75.29 0.08 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 124.871 1.357 . . . . 0.0 113.177 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp 8.12 -87.34 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.308 0 CA-C-N 112.361 -2.2 . . . . 0.0 115.52 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -134.46 47.12 2.42 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.27 1.033 . . . . 0.0 108.37 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.5 mttm . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 179.973 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.2 m -119.88 164.76 15.54 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-O 121.593 0.711 . . . . 0.0 109.656 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -131.98 145.65 51.6 Favored 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 113.926 -1.488 . . . . 0.0 108.152 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -137.8 165.65 25.93 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 44.6 t -82.18 161.13 22.88 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -119.76 28.7 7.97 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.151 0.907 . . . . 0.0 109.256 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -132.62 -55.12 0.95 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.005 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.7 p -111.72 -113.72 0.32 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.72 43.64 0.38 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.3 tt -90.62 148.91 22.35 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ptp85 -124.08 143.59 50.37 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 124.712 1.258 . . . . 0.0 111.099 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -140.52 168.43 19.81 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.423 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.16 2.75 11.43 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -125.51 -173.2 2.77 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.614 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.8 p -107.45 -49.69 3.21 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.5 p -42.21 -62.15 1.01 Allowed 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 121.922 0.868 . . . . 0.0 111.202 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -45.28 -48.94 12.95 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 113.728 -1.578 . . . . 0.0 111.223 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.25 -59.56 4.85 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.123 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -40.28 -53.69 2.5 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 124.234 0.959 . . . . 0.0 111.457 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.2 p -64.22 -51.02 65.71 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.445 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -37.78 -57.7 0.97 Allowed 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.4 mp -57.67 -62.65 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 124.764 1.29 . . . . 0.0 111.859 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 tttt -42.74 -37.57 1.8 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.5 m -83.19 -58.74 2.72 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 118.484 2.772 . . . . 0.0 118.484 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -87.48 -4.58 59.0 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 116.956 2.206 . . . . 0.0 116.956 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -125.76 -33.91 2.68 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.3 m -109.37 -17.63 13.75 Favored 'General case' 0 N--CA 1.504 2.246 0 N-CA-C 118.67 2.841 . . . . 0.0 118.67 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -114.07 -49.63 2.85 Favored 'General case' 0 N--CA 1.507 2.396 0 N-CA-C 116.01 1.856 . . . . 0.0 116.01 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -85.25 75.15 10.32 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 123.152 1.453 . . . . 0.0 108.822 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? . . . . . 0 N--CA 1.492 1.666 0 CA-C-N 111.407 -2.633 . . . . 0.0 109.187 179.9 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.4 t -117.38 -166.04 1.14 Allowed 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.439 ' CE2' ' HB2' ' A' ' 15' ' ' SER . 36.7 m-85 -120.41 118.21 29.72 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.219 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.521 HE22 ' H ' ' A' ' 6' ' ' GLN . 2.1 tm0? -114.07 154.88 26.97 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.469 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.8 t -72.43 -49.39 33.87 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 118.38 2.733 . . . . 0.0 118.38 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.521 ' H ' HE22 ' A' ' 4' ' ' GLN . 0.0 OUTLIER 72.93 17.12 4.31 Favored 'General case' 0 N--CA 1.509 2.488 0 C-N-CA 124.328 1.051 . . . . 0.0 112.456 -179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.469 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 24.4 m-85 -121.38 -50.36 2.12 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.418 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 24.3 p -111.56 -50.2 2.94 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.439 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 45.9 tp10 118.68 66.8 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 126.92 2.637 . . . . 0.0 110.108 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 14.5 tp -106.04 157.63 17.39 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.5 ttt85 -118.49 120.01 36.25 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.8 1.313 . . . . 0.0 108.535 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -122.53 149.58 43.73 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 122.845 1.307 . . . . 0.0 111.364 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -135.09 83.93 2.06 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 101.46 -3.533 . . . . 0.0 101.46 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.439 ' HB2' ' CD1' ' A' ' 3' ' ' TYR . 1.9 p30 -137.24 -153.61 0.5 Allowed 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 126.739 2.016 . . . . 0.0 106.973 0.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.439 ' HB2' ' CE2' ' A' ' 3' ' ' TYR . 43.7 t -26.02 -55.92 0.07 Allowed 'General case' 0 N--CA 1.503 2.211 0 O-C-N 124.23 0.957 . . . . 0.0 112.303 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.5 m -33.37 -38.81 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 CA-C-N 113.005 -1.907 . . . . 0.0 115.841 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -95.11 -50.78 4.92 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.817 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.8 tt -40.46 -46.38 2.42 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 123.853 0.721 . . . . 0.0 110.722 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -44.45 -56.17 4.48 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.118 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.0 p -66.3 -42.36 88.42 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 28.1 t60 -44.61 -61.39 1.58 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.77 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.3 mt -50.25 -61.8 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 O-C-N 124.604 1.19 . . . . 0.0 109.399 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -31.0 -52.23 0.18 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 125.468 1.73 . . . . 0.0 114.178 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.8 t -112.7 36.19 3.55 Favored 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -142.21 -35.38 0.43 Allowed 'General case' 0 N--CA 1.503 2.225 0 CA-C-O 121.411 0.625 . . . . 0.0 109.876 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -119.64 -64.39 1.27 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 113.857 -1.519 . . . . 0.0 107.144 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.5 m 78.47 -59.33 0.42 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 125.673 1.858 . . . . 0.0 113.449 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -130.79 -62.58 0.9 Allowed 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 113.183 -1.826 . . . . 0.0 114.25 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 28.32 69.69 0.07 Allowed 'General case' 0 N--CA 1.501 2.108 0 O-C-N 125.459 1.725 . . . . 0.0 115.494 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.9 mtmm . . . . . 0 N--CA 1.501 2.089 0 CA-C-N 113.855 -1.52 . . . . 0.0 109.978 179.893 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.405 ' H1 ' ' CD ' ' A' ' 1' ' ' LYS . 3.8 mptp? . . . . . 0 N--CA 1.495 1.807 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.517 ' H ' ' NH2' ' A' ' 11' ' ' ARG . 2.0 m -112.58 -163.65 0.87 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -100.86 146.21 27.61 Favored 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 119.763 -0.775 . . . . 0.0 111.961 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -116.25 153.89 31.1 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 105.031 -2.211 . . . . 0.0 105.031 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 53.9 t -74.65 159.77 31.68 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.028 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -120.76 37.05 4.4 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.429 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 54.2 m-85 -137.5 -50.45 0.62 Allowed 'General case' 0 N--CA 1.496 1.872 0 CA-C-N 113.506 -1.679 . . . . 0.0 108.403 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -118.88 -124.35 0.28 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 103.942 -2.614 . . . . 0.0 103.942 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -157.06 48.95 0.44 Allowed 'General case' 0 N--CA 1.499 2.009 0 CA-C-O 121.483 0.659 . . . . 0.0 112.643 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.0 tt -109.23 160.33 16.2 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.711 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.517 ' NH2' ' H ' ' A' ' 2' ' ' THR . 23.2 mtp180 -117.4 145.51 44.05 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 123.844 0.715 . . . . 0.0 109.17 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.6 m -130.93 146.18 52.26 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 114.781 -1.099 . . . . 0.0 112.064 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -127.6 91.96 3.4 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 125.137 1.523 . . . . 0.0 107.934 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -122.42 -97.32 0.45 Allowed 'General case' 0 N--CA 1.501 2.113 0 CA-C-N 121.636 2.017 . . . . 0.0 110.067 0.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.512 ' N ' ' HB3' ' A' ' 16' ' ' SER . 79.7 p -144.37 63.99 1.31 Allowed 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.512 ' HB3' ' N ' ' A' ' 15' ' ' SER . 4.6 t 50.21 -155.31 0.12 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 117.224 -3.422 . . . . 0.0 112.848 0.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.41 ' N ' HD21 ' A' ' 17' ' ' ASN . 1.5 m120 -25.43 -30.15 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 118.592 2.812 . . . . 0.0 118.592 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -84.58 -59.91 2.22 Favored 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -46.37 -48.96 18.47 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.4 p -63.39 -51.85 64.1 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 113.093 -1.867 . . . . 0.0 109.959 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -41.05 -58.11 1.84 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 76.0 mt -52.02 -63.21 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 124.356 1.035 . . . . 0.0 108.822 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -31.7 -42.0 0.05 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 125.201 1.563 . . . . 0.0 113.853 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.595 ' HG1' ' HZ2' ' A' ' 25' ' ' LYS . 65.9 p -101.55 -42.82 6.1 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.595 ' HZ2' ' HG1' ' A' ' 24' ' ' THR . 13.6 mptt -80.24 -21.29 42.96 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -120.36 -37.17 3.08 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 123.704 0.627 . . . . 0.0 111.422 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.9 t -109.24 54.81 0.65 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 123.912 0.758 . . . . 0.0 111.464 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.6 tptm 7.0 74.74 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.651 0 O-C-N 124.912 1.382 . . . . 0.0 114.465 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 10.31 60.38 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 CA-C-N 112.904 -1.953 . . . . 0.0 115.654 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 85.7 tttt . . . . . 0 N--CA 1.502 2.161 0 CA-C-O 124.328 2.013 . . . . 0.0 111.114 179.741 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 67.3 p -111.04 160.63 16.67 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.475 ' CZ ' ' HB2' ' A' ' 15' ' ' SER . 4.4 m-85 -128.74 151.86 49.08 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.975 -2.602 . . . . 0.0 103.975 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -132.15 160.43 36.07 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 119.401 -0.919 . . . . 0.0 113.283 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.431 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.5 t -102.44 149.96 23.85 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 114.029 -1.442 . . . . 0.0 108.676 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -120.93 41.78 3.21 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 124.209 0.943 . . . . 0.0 108.798 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.431 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 71.8 m-85 -131.66 -42.56 1.03 Allowed 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 113.55 -1.659 . . . . 0.0 109.944 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.7 p -116.07 -49.92 2.68 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 124.227 0.954 . . . . 0.0 111.7 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 144.39 -40.5 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.661 0 O-C-N 125.608 1.817 . . . . 0.0 109.612 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.5 tt -24.9 143.94 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 116.592 2.071 . . . . 0.0 116.592 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.7 ttt85 -124.35 145.89 49.16 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 113.469 -1.696 . . . . 0.0 106.987 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.6 p -124.87 164.43 20.07 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.81 0.94 20.63 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 123.836 0.71 . . . . 0.0 111.349 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -137.24 177.08 8.14 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 124.006 0.816 . . . . 0.0 110.355 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.475 ' HB2' ' CZ ' ' A' ' 3' ' ' TYR . 27.1 t -115.32 40.21 2.75 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.3 t -120.21 -49.87 2.27 Favored 'General case' 0 N--CA 1.496 1.825 0 CA-C-N 114.433 -1.258 . . . . 0.0 109.807 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -102.97 32.6 3.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.267 0.979 . . . . 0.0 110.905 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.418 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 2.7 tm? -109.21 -61.65 1.59 Allowed 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -46.29 -56.75 5.33 Favored 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 62.3 p -56.5 -45.14 81.16 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 112.767 -2.015 . . . . 0.0 110.407 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.418 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 82.4 t60 -43.77 -70.09 0.12 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 124.226 0.954 . . . . 0.0 110.796 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mp -47.5 -64.98 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.051 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -35.5 -52.37 0.65 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 68.0 p -114.99 26.94 9.76 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 116.694 2.109 . . . . 0.0 116.694 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.4 mmpt? -128.98 -32.77 2.04 Favored 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.7 m-70 -109.26 -27.76 9.37 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 124.168 0.917 . . . . 0.0 112.49 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 m -89.58 45.96 1.33 Allowed 'General case' 0 N--CA 1.501 2.124 0 C-N-CA 118.685 -1.206 . . . . 0.0 108.958 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -126.83 142.16 51.62 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.408 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -124.42 46.74 2.23 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm . . . . . 0 N--CA 1.497 1.894 0 CA-C-N 113.653 -1.612 . . . . 0.0 109.616 -179.964 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 120.992 0.425 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.402 HG22 ' H ' ' A' ' 3' ' ' TYR . 96.5 m -114.59 177.01 4.8 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 24.4 m-85 -105.32 84.3 2.08 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.195 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -122.17 155.02 36.66 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.88 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.39 166.53 8.11 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.221 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -123.87 23.5 8.62 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.696 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.464 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 91.0 m-85 -139.57 -49.62 0.49 Allowed 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 115.721 1.749 . . . . 0.0 115.721 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.407 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 28.7 p -107.18 -64.36 1.2 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 118.218 -0.896 . . . . 0.0 112.889 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.407 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 14.3 pt-20 143.72 52.39 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.535 0 O-C-N 125.503 1.752 . . . . 0.0 110.927 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.7 tt -104.45 154.56 19.72 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.7 ptt85 -117.02 146.13 43.25 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 64.6 m -131.81 179.2 6.21 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 113.01 -1.904 . . . . 0.0 106.425 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -123.35 -38.17 2.59 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.953 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -125.33 165.34 18.53 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 124.25 0.969 . . . . 0.0 112.51 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 40.6 t -115.72 147.06 41.32 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 105.967 -1.864 . . . . 0.0 105.967 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 75.6 m -96.82 56.79 1.49 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 121.151 1.796 . . . . 0.0 112.15 0.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -98.39 12.97 33.24 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.0 -51.97 2.82 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 101.22 -3.622 . . . . 0.0 101.22 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -53.59 -46.23 70.27 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.9 m -43.33 -50.84 6.61 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 124.474 1.109 . . . . 0.0 110.598 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.565 ' HD1' ' HZ3' ' A' ' 25' ' ' LYS . 54.2 t60 -58.69 -63.2 1.37 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.529 1.143 . . . . 0.0 108.968 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.5 mt -41.62 -61.96 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 O-C-N 125.053 1.471 . . . . 0.0 111.119 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -37.54 -63.83 0.43 Allowed 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.709 -1.587 . . . . 0.0 112.881 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.8 m -66.08 -45.26 81.89 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 120.873 3.657 . . . . 0.0 120.873 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.565 ' HZ3' ' HD1' ' A' ' 21' ' ' HIS . 23.1 mttt -94.69 -7.53 40.44 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 -179.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.464 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 68.9 m-70 -126.75 -37.1 2.17 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 77.8 p -122.64 43.48 2.9 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -141.12 -57.13 0.5 Allowed 'General case' 0 N--CA 1.504 2.259 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -110.24 -41.76 4.32 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 113.502 -1.681 . . . . 0.0 112.578 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.7 tptt . . . . . 0 N--CA 1.506 2.329 0 N-CA-C 116.223 1.934 . . . . 0.0 116.223 -179.934 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 121.542 0.687 . . . . 0.0 109.889 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 78.1 m -131.62 172.43 12.26 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.625 -1.17 . . . . 0.0 109.057 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -122.51 145.58 48.19 Favored 'General case' 0 N--CA 1.499 1.993 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.301 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -135.22 161.25 35.91 Favored 'General case' 0 N--CA 1.501 2.082 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.476 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 52.9 t -99.85 141.99 31.92 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.217 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -118.45 44.45 2.25 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 124.56 1.163 . . . . 0.0 109.027 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.483 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 79.1 m-85 -129.27 -46.8 1.21 Allowed 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 113.173 -1.83 . . . . 0.0 106.707 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -118.04 -52.24 2.42 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 124.577 1.173 . . . . 0.0 111.015 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 147.82 -39.47 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.772 0 O-C-N 125.025 1.453 . . . . 0.0 112.248 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.6 tt -29.92 153.43 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 116.625 2.084 . . . . 0.0 116.625 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 62.7 mtt-85 -119.22 152.17 37.09 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.622 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.5 m -124.05 -162.87 1.1 Allowed 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 113.91 -1.496 . . . . 0.0 107.574 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.24 -63.71 1.3 Allowed 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -124.42 171.57 9.84 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 124.221 0.95 . . . . 0.0 109.455 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.1 t -47.72 -52.34 18.79 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.52 ' HG ' ' H ' ' A' ' 17' ' ' ASN . 35.0 p -43.27 -50.89 6.46 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.901 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.52 ' H ' ' HG ' ' A' ' 16' ' ' SER . 1.4 t-20 -68.68 -48.72 63.22 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.441 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.8 -50.07 14.46 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -49.74 -56.15 11.3 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 179.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.5 m -40.46 -55.58 2.24 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 124.863 1.352 . . . . 0.0 108.769 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -53.37 -68.18 0.2 Allowed 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 113.069 -1.878 . . . . 0.0 109.277 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.3 mm -39.48 -67.03 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 124.536 1.148 . . . . 0.0 110.922 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -36.6 -52.51 0.88 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 124.812 1.32 . . . . 0.0 114.344 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.6 p -108.79 37.76 2.45 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 116.083 1.882 . . . . 0.0 116.083 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -144.81 -36.62 0.31 Allowed 'General case' 0 N--CA 1.501 2.09 0 CA-C-O 121.262 0.553 . . . . 0.0 109.543 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -127.75 -61.17 1.13 Allowed 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.428 ' O ' ' CB ' ' A' ' 28' ' ' LYS . 87.4 p 119.93 -35.14 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.429 0 O-C-N 126.758 2.536 . . . . 0.0 110.166 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.428 ' CB ' ' O ' ' A' ' 27' ' ' SER . 5.0 ttmp? 104.99 63.21 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 100.77 -3.789 . . . . 0.0 100.77 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 28.08 56.35 0.09 Allowed 'General case' 0 N--CA 1.501 2.121 0 CA-C-N 113.895 -1.502 . . . . 0.0 113.925 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 93.3 mttt . . . . . 0 N--CA 1.511 2.576 0 C-N-CA 126.902 2.081 . . . . 0.0 109.486 179.834 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 121.867 0.841 . . . . 0.0 109.094 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 51.2 p -130.67 -178.1 4.64 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.863 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -114.45 135.11 54.46 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.7 tp60 -120.76 157.67 29.18 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.799 1.312 . . . . 0.0 108.257 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.9 t -99.89 149.31 23.53 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -119.15 43.64 2.54 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 122.19 0.995 . . . . 0.0 110.593 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -133.23 -52.06 0.89 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 112.994 -1.912 . . . . 0.0 105.868 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.9 p -119.51 -124.49 0.28 Allowed 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 102.149 -3.278 . . . . 0.0 102.149 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -147.61 56.21 1.09 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 123.993 0.808 . . . . 0.0 108.927 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.424 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 24.2 tp -105.29 139.19 40.31 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.033 -1.067 . . . . 0.0 111.61 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.424 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -134.92 146.44 49.16 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.583 -1.644 . . . . 0.0 111.569 179.392 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.582 ' HG ' HD22 ' A' ' 17' ' ' ASN . 37.2 t -142.03 171.96 13.35 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 112.875 -1.966 . . . . 0.0 108.449 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.17 -12.79 25.76 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -121.66 -173.69 2.7 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 124.26 0.975 . . . . 0.0 108.55 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.7 t -119.19 -38.46 3.04 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.8 p -31.66 -46.12 0.1 Allowed 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.582 HD22 ' HG ' ' A' ' 12' ' ' SER . 19.3 p30 -84.54 -36.82 21.89 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 119.017 -1.073 . . . . 0.0 109.969 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.6 tp -49.21 -41.61 37.63 Favored 'General case' 0 N--CA 1.503 2.22 0 CA-C-O 121.505 0.669 . . . . 0.0 109.837 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.7 tmtp? -51.97 -53.65 38.91 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -61.29 -52.94 62.6 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.118 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -35.41 -59.18 0.55 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.145 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 71.2 mt -53.06 -57.96 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-O 121.494 0.664 . . . . 0.0 109.361 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.41 ' HZ1' ' CB ' ' A' ' 23' ' ' LYS . 4.1 ttmp? -45.61 -41.86 10.61 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.689 -1.141 . . . . 0.0 113.094 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -87.68 -37.83 16.38 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 121.276 3.806 . . . . 0.0 121.276 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.3 mtpt -108.11 0.1 21.42 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 115.141 1.534 . . . . 0.0 115.141 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 47.3 m-70 -125.52 -40.25 2.1 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.3 p -92.58 -67.56 0.85 Allowed 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.543 -0.863 . . . . 0.0 111.286 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.65 -174.28 2.77 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -111.63 45.11 1.26 Allowed 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 106.287 -1.745 . . . . 0.0 106.287 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.4 tttp . . . . . 0 N--CA 1.499 1.99 0 CA-C-N 112.812 -1.995 . . . . 0.0 115.273 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 122.061 0.934 . . . . 0.0 111.44 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.1 m -116.0 163.84 15.31 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -124.74 104.06 8.44 Favored 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 113.737 -1.574 . . . . 0.0 107.816 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 -112.88 114.95 27.69 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 124.011 0.819 . . . . 0.0 109.058 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 53.2 t -23.31 -70.48 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.46 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 7.9 tt0 109.62 -23.06 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.723 0 O-C-N 126.094 2.122 . . . . 0.0 110.305 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -99.5 -52.65 3.43 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.436 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 29.7 p -103.55 -49.45 3.69 Favored 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 34.4 tt0 119.12 64.02 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 126.695 2.497 . . . . 0.0 109.236 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.1 tt -106.51 137.64 44.14 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 103.461 -2.792 . . . . 0.0 103.461 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 24.9 ttp85 -115.0 134.49 55.14 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 122.27 1.033 . . . . 0.0 113.604 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 t -129.41 179.3 5.87 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 112.135 -2.302 . . . . 0.0 106.16 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -117.06 -21.41 8.88 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.086 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -141.33 -172.38 3.5 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 124.337 1.023 . . . . 0.0 108.774 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 16' ' ' SER . 30.7 t -105.75 171.71 7.19 Favored 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 15' ' ' SER . 25.1 t 101.02 -31.13 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.795 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -106.48 -16.15 14.61 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-N 113.071 -1.877 . . . . 0.0 109.61 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.41 -55.13 2.46 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 104.503 -2.406 . . . . 0.0 104.503 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 tppp? -50.7 -53.04 34.57 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 56.5 m -60.84 -50.35 73.8 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 114.31 -1.314 . . . . 0.0 108.44 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 39.2 t60 -40.6 -59.15 1.43 Allowed 'General case' 0 N--CA 1.503 2.206 0 O-C-N 124.091 0.87 . . . . 0.0 108.768 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.3 mt -54.15 -59.58 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 123.782 0.676 . . . . 0.0 109.786 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 22.1 mtmt -44.46 -28.97 0.63 Allowed 'General case' 0 N--CA 1.503 2.2 0 N-CA-C 114.779 1.399 . . . . 0.0 114.779 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.1 m -101.92 -40.91 6.68 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 118.138 2.644 . . . . 0.0 118.138 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -89.95 -14.93 33.06 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.9 m-70 -127.37 -46.55 1.47 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.0 t -107.06 54.9 0.66 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.423 1.077 . . . . 0.0 108.434 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -31.05 170.22 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 117.508 2.411 . . . . 0.0 117.508 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -92.31 -42.67 9.69 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.551 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? . . . . . 0 N--CA 1.497 1.88 0 CA-C-O 122.339 1.066 . . . . 0.0 109.888 179.805 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 27.8 tptp . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.018 0.437 . . . . 0.0 109.848 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 28.2 m -121.45 169.64 10.44 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.592 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -117.81 136.75 53.21 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -121.23 158.1 28.81 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 40.4 t -105.75 139.14 40.78 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 104.772 -2.307 . . . . 0.0 104.772 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -113.58 47.12 1.19 Allowed 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 122.701 1.238 . . . . 0.0 109.747 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 67.0 m-85 -136.08 -55.64 0.76 Allowed 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 112.263 -2.244 . . . . 0.0 108.548 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -121.3 -117.22 0.31 Allowed 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.337 1.023 . . . . 0.0 110.189 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.2 mp0 -122.16 -49.73 2.05 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 tt -23.49 129.93 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 117.04 2.237 . . . . 0.0 117.04 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -131.77 145.56 51.66 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.5 m -128.56 173.9 9.85 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 123.869 0.73 . . . . 0.0 110.212 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.17 35.14 3.73 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -132.4 -62.92 0.81 Allowed 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.353 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.4 t 125.61 -58.4 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 104.274 -2.491 . . . . 0.0 104.274 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.6 m -44.97 -58.07 3.4 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 124.149 0.906 . . . . 0.0 110.378 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -46.91 -60.56 2.36 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 114.182 -1.372 . . . . 0.0 110.255 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -50.99 -52.95 37.56 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.209 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -47.69 -55.95 8.36 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 121.093 0.473 . . . . 0.0 110.038 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.1 m -56.45 -47.37 79.28 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.059 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 37.4 t60 -50.4 -58.08 6.52 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 123.765 0.665 . . . . 0.0 109.654 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.6 mt -54.07 -60.34 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.48 -23.02 5.44 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 23.9 m -96.08 -45.16 7.0 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 117.725 2.491 . . . . 0.0 117.725 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -97.36 -7.25 32.33 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 56.6 m-70 -122.79 -48.09 2.04 Favored 'General case' 0 N--CA 1.501 2.11 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.077 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.2 t -111.54 48.18 0.97 Allowed 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -52.65 160.6 0.86 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 113.56 -1.654 . . . . 0.0 112.268 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -131.69 58.0 1.75 Allowed 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.7 ttmp? . . . . . 0 N--CA 1.498 1.965 0 CA-C-N 114.576 -1.193 . . . . 0.0 108.573 -179.904 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 83.3 tttt . . . . . 0 N--CA 1.489 1.478 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.5 p -102.06 167.97 9.69 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -123.32 148.67 45.74 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 113.867 -1.515 . . . . 0.0 107.115 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -123.6 164.06 19.78 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 51.0 t -93.79 155.24 17.32 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -114.37 32.08 6.17 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 124.003 0.814 . . . . 0.0 109.665 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -137.26 -53.91 0.69 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 114.746 -1.116 . . . . 0.0 111.141 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.7 p -114.62 -116.64 0.32 Allowed 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.44 52.37 0.53 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.558 0.694 . . . . 0.0 111.801 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.2 tt -105.65 140.42 38.74 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.6 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -122.97 152.18 41.13 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 124.412 1.07 . . . . 0.0 109.952 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.2 p -140.14 179.02 6.87 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.613 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -103.35 -43.92 5.3 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.021 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -109.68 -168.01 1.27 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 124.35 1.032 . . . . 0.0 110.339 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.476 ' HG ' ' H ' ' A' ' 16' ' ' SER . 68.8 p -97.51 -45.65 6.34 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.802 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.476 ' H ' ' HG ' ' A' ' 15' ' ' SER . 51.1 m -40.46 -52.07 2.81 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -80.23 1.92 26.51 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -107.29 -46.78 3.8 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.434 ' HG3' ' N ' ' A' ' 20' ' ' THR . 0.2 OUTLIER -55.84 -49.48 73.2 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.598 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.434 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 8.8 t -51.47 -40.98 60.55 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 123.645 0.591 . . . . 0.0 110.417 179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.3 t60 -59.88 -66.24 0.55 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.8 mt -46.29 -53.55 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-O 121.256 0.551 . . . . 0.0 109.944 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -38.55 -48.28 1.4 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.936 -1.484 . . . . 0.0 114.058 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.608 ' HG1' ' HZ3' ' A' ' 25' ' ' LYS . 44.9 p -110.07 -9.23 14.73 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -179.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.608 ' HZ3' ' HG1' ' A' ' 24' ' ' THR . 13.9 mptt -102.69 -22.54 13.93 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -127.82 -38.03 1.89 Allowed 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.439 ' HG ' ' H ' ' A' ' 28' ' ' LYS . 29.3 p -100.9 -70.37 0.74 Allowed 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 -179.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.439 ' H ' ' HG ' ' A' ' 27' ' ' SER . 62.2 tttp 128.37 173.66 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.665 0 C-N-CA 127.675 2.39 . . . . 0.0 105.456 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.401 ' H ' ' CG ' ' A' ' 28' ' ' LYS . 35.5 tt0 -70.3 -49.76 46.28 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt . . . . . 0 N--CA 1.499 2.014 0 CA-C-O 122.312 1.054 . . . . 0.0 109.606 -179.97 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 49.7 mttm . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.4 m -116.81 171.45 7.89 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.4 m-30 -113.17 169.2 9.11 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.516 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 64.7 tp60 -125.7 170.35 11.62 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 114.646 -1.161 . . . . 0.0 108.816 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.516 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 32.5 t -104.52 -54.51 2.51 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.442 ' H ' HE21 ' A' ' 4' ' ' GLN . 5.6 tt0 80.63 16.3 0.64 Allowed 'General case' 0 N--CA 1.505 2.294 0 O-C-N 125.252 1.595 . . . . 0.0 109.793 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -126.78 -45.71 1.59 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 118.974 -0.536 . . . . 0.0 112.404 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 p -116.16 -117.59 0.32 Allowed 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -140.27 28.09 2.08 Favored 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.7 tt -109.25 155.13 21.48 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.62 157.06 39.91 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 105.553 -2.017 . . . . 0.0 105.553 179.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -126.34 168.2 14.47 Favored 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 120.661 -0.416 . . . . 0.0 109.968 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.58 -52.49 2.76 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 124.01 0.819 . . . . 0.0 110.387 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -109.36 155.04 21.7 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 122.049 0.928 . . . . 0.0 110.347 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.1 m -49.57 -56.42 10.0 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 113.141 -1.845 . . . . 0.0 110.802 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.4 t -45.95 -62.67 1.22 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 124.545 1.153 . . . . 0.0 110.025 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -43.2 -58.19 2.62 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 124.417 1.073 . . . . 0.0 111.701 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -52.88 -57.04 11.58 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.3 mtmm -53.17 -49.3 66.93 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 119.819 -0.752 . . . . 0.0 109.829 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 67.1 m -53.39 -50.98 64.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 124.033 0.833 . . . . 0.0 109.029 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -51.02 -58.77 5.21 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.281 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.0 mt -57.39 -26.07 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.62 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.424 ' HZ2' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.05 -48.23 25.02 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.749 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.614 ' HG1' ' HZ1' ' A' ' 25' ' ' LYS . 80.9 p -85.33 -29.15 24.75 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.614 ' HZ1' ' HG1' ' A' ' 24' ' ' THR . 47.2 mmtm -101.55 -22.29 14.53 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 123.762 0.664 . . . . 0.0 110.569 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -131.68 33.69 3.98 Favored 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 119.018 -1.073 . . . . 0.0 113.099 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.0 p -21.5 -61.66 0.03 OUTLIER 'General case' 0 N--CA 1.513 2.682 0 O-C-N 124.413 1.07 . . . . 0.0 113.634 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -117.21 175.88 5.4 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 26.63 56.19 0.06 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 124.278 0.986 . . . . 0.0 113.074 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 95.2 mttt . . . . . 0 N--CA 1.504 2.253 0 CA-C-N 112.227 -2.26 . . . . 0.0 116.56 -179.89 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 62.4 mttp . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 32.1 m -125.09 167.4 14.84 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 114.892 -1.049 . . . . 0.0 108.732 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -123.25 139.99 53.48 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.402 ' NE2' HH21 ' A' ' 11' ' ' ARG . 2.2 tt0 -125.58 177.06 6.44 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.428 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 51.0 t -106.46 161.87 14.21 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.201 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -118.9 29.72 7.56 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 124.132 0.895 . . . . 0.0 108.895 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -137.19 -49.84 0.62 Allowed 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.063 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.0 p -114.75 -48.78 2.83 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 124.093 0.871 . . . . 0.0 110.991 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 129.56 -2.51 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.918 0 C-N-CA 127.054 2.142 . . . . 0.0 113.389 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -44.83 135.36 5.16 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 124.082 0.864 . . . . 0.0 109.314 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.402 HH21 ' NE2' ' A' ' 4' ' ' GLN . 4.6 ptp180 -124.03 144.55 49.77 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 124.396 1.06 . . . . 0.0 112.737 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.539 ' HG ' ' H ' ' A' ' 13' ' ' ALA . 23.3 t -126.98 -176.01 3.59 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-N 112.649 -2.069 . . . . 0.0 107.926 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.539 ' H ' ' HG ' ' A' ' 12' ' ' SER . . . -115.5 -9.2 12.1 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.303 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -135.74 -177.0 4.48 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 124.478 1.111 . . . . 0.0 111.782 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.5 m -113.61 38.87 2.8 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.031 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.7 t -117.71 -54.49 2.35 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 104.945 -2.243 . . . . 0.0 104.945 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -75.42 -43.03 52.1 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 113.514 -1.675 . . . . 0.0 109.385 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.54 -53.28 60.14 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.165 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.402 ' HD3' ' C ' ' A' ' 19' ' ' LYS . 13.1 tmtt? -50.31 -60.29 3.13 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 120.191 -0.603 . . . . 0.0 109.576 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.4 p -52.36 -42.27 63.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 123.804 0.69 . . . . 0.0 112.436 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -49.69 -62.65 1.44 Allowed 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.33 179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.41 HD12 ' H ' ' A' ' 22' ' ' ILE . 2.9 mp -50.07 -59.62 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 O-C-N 123.737 0.648 . . . . 0.0 110.473 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -36.58 -51.82 0.85 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 23.1 m -85.37 -42.6 14.4 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 119.358 3.095 . . . . 0.0 119.358 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.59 -8.34 56.38 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.16 0.913 . . . . 0.0 112.867 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -150.18 70.65 1.04 Allowed 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 102.506 -3.146 . . . . 0.0 102.506 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.7 p -163.66 43.71 0.11 Allowed 'General case' 0 N--CA 1.501 2.075 0 O-C-N 118.702 -2.498 . . . . 0.0 109.757 0.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm 94.78 158.96 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.515 0 C-N-CA 125.498 1.519 . . . . 0.0 108.681 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.9 mp0 -130.81 -56.9 1.05 Allowed 'General case' 0 N--CA 1.496 1.852 0 O-C-N 124.087 0.867 . . . . 0.0 110.5 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.3 pttp . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 122.216 1.008 . . . . 0.0 110.565 -179.884 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 26.8 m 89.82 170.4 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.603 0 O-C-N 125.385 1.678 . . . . 0.0 108.75 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -103.96 145.64 29.85 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.462 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 31.6 tt0 -121.75 173.97 7.13 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 124.995 1.434 . . . . 0.0 107.63 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 48.0 t -100.7 163.36 12.37 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.66 25.96 9.42 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 124.219 0.949 . . . . 0.0 109.676 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.483 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 63.2 m-85 -123.35 -53.83 1.8 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 107.243 -1.392 . . . . 0.0 107.243 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -118.04 -121.23 0.3 Allowed 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 104.116 -2.55 . . . . 0.0 104.116 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -159.42 51.28 0.35 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.541 0.686 . . . . 0.0 109.824 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.3 tt -106.48 158.51 16.86 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.938 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -118.95 161.75 19.67 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.193 0.997 . . . . 0.0 113.539 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.8 m -125.23 -158.81 0.85 Allowed 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 112.537 -2.119 . . . . 0.0 110.225 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.79 -55.0 2.54 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.8 p-10 -122.15 -43.95 2.3 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 116.121 1.896 . . . . 0.0 116.121 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.6 p 156.02 -49.49 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.8 p -47.09 -42.7 19.37 Favored 'General case' 0 N--CA 1.507 2.398 0 CA-C-O 121.51 0.672 . . . . 0.0 109.305 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -67.78 -47.52 68.95 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -46.13 -45.53 16.58 Favored 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 179.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -51.59 -59.65 4.03 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 124.314 1.009 . . . . 0.0 108.837 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.6 p -51.4 -46.27 62.8 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 124.111 0.882 . . . . 0.0 110.916 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -48.47 -66.69 0.36 Allowed 'General case' 0 N--CA 1.502 2.141 0 C-N-CA 119.811 -0.755 . . . . 0.0 109.02 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.1 mt -48.94 -55.74 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 124.264 0.978 . . . . 0.0 111.499 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.456 ' HZ2' ' HZ2' ' A' ' 28' ' ' LYS . 50.9 tttm -33.25 -57.72 0.4 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 125.193 1.558 . . . . 0.0 113.996 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 50.2 m -115.07 48.11 1.2 Allowed 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 122.233 1.016 . . . . 0.0 113.406 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -145.31 -39.1 0.25 Allowed 'General case' 0 N--CA 1.5 2.073 0 CA-C-N 114.664 -1.153 . . . . 0.0 109.539 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -121.36 -40.33 2.59 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 114.152 -1.385 . . . . 0.0 111.575 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 73.2 p -111.31 65.27 0.62 Allowed 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.456 ' HZ2' ' HZ2' ' A' ' 23' ' ' LYS . 46.9 mtmt 126.85 69.89 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.753 0 C-N-CA 127.766 2.427 . . . . 0.0 106.802 -179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -118.41 -39.6 3.01 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 112.41 -2.177 . . . . 0.0 107.537 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.507 2.392 0 O-C-N 125.893 1.996 . . . . 0.0 116.145 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 121.106 0.479 . . . . 0.0 109.933 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.6 p -107.87 159.14 16.75 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-O 121.426 0.632 . . . . 0.0 112.406 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -127.22 159.08 35.4 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 113.624 -1.625 . . . . 0.0 108.488 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.406 ' HG3' ' H ' ' A' ' 6' ' ' GLN . 4.1 tp-100 -124.28 156.22 37.29 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 124.425 1.078 . . . . 0.0 111.017 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 14.7 t -107.09 -17.87 14.05 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 114.435 -1.257 . . . . 0.0 113.819 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.406 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 9.7 pt20 40.89 30.39 0.09 Allowed 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 116.374 1.991 . . . . 0.0 116.374 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -135.43 -59.93 0.76 Allowed 'General case' 0 N--CA 1.504 2.259 0 N-CA-C 106.055 -1.831 . . . . 0.0 106.055 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.419 ' SG ' ' HB2' ' A' ' 10' ' ' LEU . 17.8 p -118.45 29.57 7.69 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 105.396 -2.076 . . . . 0.0 105.396 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 24.72 55.03 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 112.646 -2.07 . . . . 0.0 112.373 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.419 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 4.3 tp -90.96 146.42 23.89 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 104.132 -2.544 . . . . 0.0 104.132 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -114.35 149.32 36.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 124.325 1.016 . . . . 0.0 109.151 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.6 t -138.9 170.97 15.02 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.116 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.62 -4.59 10.28 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 125.137 1.523 . . . . 0.0 108.817 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -127.47 169.8 13.27 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.416 ' HG ' ' H ' ' A' ' 16' ' ' SER . 54.5 p -104.99 -45.79 4.45 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 124.206 0.942 . . . . 0.0 112.744 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.416 ' H ' ' HG ' ' A' ' 15' ' ' SER . 22.7 t -50.39 -53.35 29.9 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 122.071 0.939 . . . . 0.0 112.528 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.0 p-10 -60.33 -30.17 69.34 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.38 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -72.15 -53.41 12.78 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 118.862 -0.589 . . . . 0.0 110.19 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.411 ' NZ ' ' HA ' ' A' ' 16' ' ' SER . 17.6 pttm -52.15 -48.12 65.09 Favored 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.21 -1.396 . . . . 0.0 109.73 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.407 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 41.1 p -62.29 -51.06 69.2 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.743 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.462 ' CE1' ' HD2' ' A' ' 25' ' ' LYS . 68.1 t60 -38.11 -59.51 0.85 Allowed 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.031 0.443 . . . . 0.0 110.192 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 86.0 mt -54.64 -59.65 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.654 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -40.67 -42.78 1.8 Allowed 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.5 t -101.35 -19.86 15.44 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 120.107 3.373 . . . . 0.0 120.107 -179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.462 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 47.0 mttp -106.51 -14.62 15.01 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.413 ' C ' ' H ' ' A' ' 28' ' ' LYS . 70.8 m-70 -122.75 -46.22 2.13 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 120.318 -0.553 . . . . 0.0 112.296 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.3 p -93.93 30.53 1.83 Allowed 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 118.146 -1.422 . . . . 0.0 108.178 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 29' ' ' GLU . 53.3 tptt -155.5 60.69 0.62 Allowed 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 31.0 tt0 129.83 -64.19 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.575 0 C-N-CA 126.178 1.791 . . . . 0.0 109.498 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HZ3' ' HB3' ' A' ' 30' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.513 2.703 0 O-C-N 125.751 1.907 . . . . 0.0 106.403 -179.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? . . . . . 0 N--CA 1.495 1.786 0 N-CA-C 105.58 -2.008 . . . . 0.0 105.58 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.7 t -113.87 178.13 4.39 Favored 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 122.433 1.111 . . . . 0.0 113.005 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.406 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 4.9 m-85 -108.5 179.23 4.25 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-N 112.147 -2.297 . . . . 0.0 106.89 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.532 HE22 ' N ' ' A' ' 6' ' ' GLN . 8.6 tm0? -141.24 167.54 21.93 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 41.8 t -105.33 -68.61 0.85 Allowed 'General case' 0 N--CA 1.504 2.257 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.945 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.532 ' N ' HE22 ' A' ' 4' ' ' GLN . 3.1 tp-100 107.42 -27.09 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.572 0 O-C-N 125.816 1.947 . . . . 0.0 109.955 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -83.38 -46.02 13.03 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.768 0.668 . . . . 0.0 110.511 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -115.53 -40.85 3.33 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 109.42 49.03 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.176 0 O-C-N 126.887 2.617 . . . . 0.0 110.643 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.488 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 44.2 tp -98.39 158.97 15.25 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.488 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 55.7 mtt-85 -121.54 -176.91 3.41 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.297 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.592 ' HG ' ' H ' ' A' ' 15' ' ' SER . 24.0 t -141.24 -70.83 0.36 Allowed 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.738 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.442 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 108.49 -20.09 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.546 0 O-C-N 125.909 2.006 . . . . 0.0 109.047 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.459 ' O ' ' CB ' ' A' ' 15' ' ' SER . 3.6 p-10 -119.29 -45.42 2.54 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.592 ' H ' ' HG ' ' A' ' 12' ' ' SER . 37.5 t 121.85 -51.02 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.878 0 C-N-CA 126.016 1.727 . . . . 0.0 109.596 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.1 t -47.85 -52.46 19.04 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.846 0.831 . . . . 0.0 111.922 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.403 ' N ' HD21 ' A' ' 17' ' ' ASN . 1.9 m120 -64.71 2.71 0.63 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-N 112.714 -2.039 . . . . 0.0 114.379 -179.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -106.52 -52.03 2.85 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 103.533 -2.766 . . . . 0.0 103.533 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.591 ' HZ1' ' HG ' ' A' ' 15' ' ' SER . 21.4 mtmm -54.29 -54.45 40.09 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.294 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.5 t -62.99 -39.71 95.55 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 123.79 0.682 . . . . 0.0 109.259 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.406 ' CG ' HD21 ' A' ' 10' ' ' LEU . 13.8 t60 -51.01 -63.3 1.17 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 123.996 0.81 . . . . 0.0 109.219 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.6 mt -46.84 -59.83 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.452 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -49.48 -31.99 11.18 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -93.4 -41.1 10.01 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 118.067 2.617 . . . . 0.0 118.067 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -92.29 -15.24 27.68 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 -121.28 -43.48 2.42 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 123.444 0.465 . . . . 0.0 111.243 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.6 m -109.26 38.11 2.4 Favored 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 122.112 0.958 . . . . 0.0 109.116 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 23.1 ttpp -12.58 92.36 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 112.192 -2.276 . . . . 0.0 116.286 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.36 39.18 1.63 Allowed 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? . . . . . 0 N--CA 1.496 1.864 0 CA-C-N 114.43 -1.259 . . . . 0.0 109.647 -179.775 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 103.586 -2.746 . . . . 0.0 103.586 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.428 HG23 ' H ' ' A' ' 3' ' ' TYR . 1.4 m -128.28 -163.1 1.24 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 112.215 -2.266 . . . . 0.0 109.429 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.428 ' H ' HG23 ' A' ' 2' ' ' THR . 25.4 m-85 -109.81 82.12 1.54 Allowed 'General case' 0 N--CA 1.492 1.668 1 N-CA-C 99.966 -4.087 . . . . 0.0 99.966 179.577 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.46 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 24.2 tt0 -107.73 161.67 14.67 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.606 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.46 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 36.0 t -87.0 162.61 17.54 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 113.163 -1.835 . . . . 0.0 108.632 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -122.73 36.79 4.56 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 124.297 0.998 . . . . 0.0 110.582 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -136.08 -49.48 0.68 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.708 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.407 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 27.3 p -111.82 -63.62 1.4 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.765 1.291 . . . . 0.0 110.605 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.407 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER 135.55 41.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.532 0 O-C-N 126.004 2.065 . . . . 0.0 108.932 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.402 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 49.7 tp -83.4 157.03 22.65 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.474 HH11 ' H ' ' A' ' 13' ' ' ALA . 10.9 ttp85 -119.55 119.53 34.07 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 125.279 1.612 . . . . 0.0 107.696 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -132.88 77.1 1.72 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.474 ' H ' HH11 ' A' ' 11' ' ' ARG . . . -75.75 68.55 2.33 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 122.717 1.246 . . . . 0.0 112.658 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -139.19 -61.35 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.567 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p 127.3 -62.1 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.476 0 O-C-N 126.803 2.564 . . . . 0.0 109.865 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 m -57.59 -54.92 41.46 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 121.49 0.662 . . . . 0.0 109.364 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -42.52 -51.73 4.97 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.605 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -56.62 -54.69 43.07 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.034 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -43.47 -59.04 2.31 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 124.105 0.878 . . . . 0.0 111.718 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.8 t -60.56 -48.42 81.85 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 117.373 -1.299 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -40.31 -64.55 0.5 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.427 1.012 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.4 mt -43.66 -64.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 124.606 1.191 . . . . 0.0 113.956 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -58.72 -32.6 69.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.7 p -104.14 23.98 12.17 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.8 mmmm -142.02 -28.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -119.29 -56.21 2.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 124.828 1.33 . . . . 0.0 108.651 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.7 m 81.58 -60.42 0.21 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 126.092 2.12 . . . . 0.0 107.948 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 30' ' ' LYS . 22.3 tptm -142.06 -41.57 0.35 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 113.711 -1.586 . . . . 0.0 111.39 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 26.43 -68.98 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.434 0 O-C-N 127.385 2.928 . . . . 0.0 115.123 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 28' ' ' LYS . 20.1 mtpp . . . . . 0 N--CA 1.499 2.013 0 CA-C-O 122.486 1.136 . . . . 0.0 108.595 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 103.586 -2.746 . . . . 0.0 103.586 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.428 HG23 ' H ' ' A' ' 3' ' ' TYR . 1.4 m -128.28 -163.1 1.24 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 112.215 -2.266 . . . . 0.0 109.429 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.428 ' H ' HG23 ' A' ' 2' ' ' THR . 25.4 m-85 -109.81 82.12 1.54 Allowed 'General case' 0 N--CA 1.492 1.668 1 N-CA-C 99.966 -4.087 . . . . 0.0 99.966 179.577 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.46 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 24.2 tt0 -107.73 161.67 14.67 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.606 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.46 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 36.0 t -87.0 162.61 17.54 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 113.163 -1.835 . . . . 0.0 108.632 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -122.73 36.79 4.56 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 124.297 0.998 . . . . 0.0 110.582 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -136.08 -49.48 0.68 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.708 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.407 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 27.3 p -111.82 -63.62 1.4 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.765 1.291 . . . . 0.0 110.605 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.407 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER 135.55 41.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.532 0 O-C-N 126.004 2.065 . . . . 0.0 108.932 -179.808 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.402 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 49.7 tp -83.4 157.03 22.65 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.474 HH11 ' H ' ' A' ' 13' ' ' ALA . 10.9 ttp85 -119.55 119.53 34.07 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 125.279 1.612 . . . . 0.0 107.696 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -132.88 77.1 1.72 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.474 ' H ' HH11 ' A' ' 11' ' ' ARG . . . -75.75 68.55 2.33 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 122.717 1.246 . . . . 0.0 112.658 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -139.19 -61.35 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.567 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p 127.3 -62.1 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.476 0 O-C-N 126.803 2.564 . . . . 0.0 109.865 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 m -57.59 -54.92 41.46 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 121.49 0.662 . . . . 0.0 109.364 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -42.52 -51.73 4.97 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.605 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -56.62 -54.69 43.07 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.034 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -43.47 -59.04 2.31 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 124.105 0.878 . . . . 0.0 111.718 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.8 t -60.56 -48.42 81.85 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 117.373 -1.299 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -40.31 -64.55 0.5 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.427 1.012 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.4 mt -43.66 -64.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 124.606 1.191 . . . . 0.0 113.956 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -58.72 -32.6 69.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -179.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.7 p -104.14 23.98 12.17 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.8 mmmm -142.02 -28.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -119.29 -56.21 2.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 124.828 1.33 . . . . 0.0 108.651 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.7 m 81.58 -60.42 0.21 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 126.092 2.12 . . . . 0.0 107.948 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 30' ' ' LYS . 22.3 tptm -142.06 -41.57 0.35 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 113.711 -1.586 . . . . 0.0 111.39 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 26.43 -68.98 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.434 0 O-C-N 127.385 2.928 . . . . 0.0 115.123 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 28' ' ' LYS . 20.1 mtpp . . . . . 0 N--CA 1.499 2.013 0 CA-C-O 122.486 1.136 . . . . 0.0 108.595 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.5 pttt . . . . . 0 N--CA 1.496 1.87 0 N-CA-C 104.802 -2.295 . . . . 0.0 104.802 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.5 m -121.07 166.84 13.32 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 112.92 -1.945 . . . . 0.0 112.549 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -119.04 76.91 1.14 Allowed 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 104.207 -2.516 . . . . 0.0 104.207 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -124.96 144.56 50.3 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 125.591 1.807 . . . . 0.0 108.565 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.0 t -63.38 163.16 11.15 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 114.24 -1.346 . . . . 0.0 113.211 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -126.28 38.88 4.05 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.478 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 80.8 m-85 -139.47 -47.58 0.47 Allowed 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 114.331 -1.304 . . . . 0.0 112.325 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.8 p -109.69 -65.37 1.16 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 124.037 0.836 . . . . 0.0 112.465 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 140.14 41.73 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.596 0 C-N-CA 126.487 1.915 . . . . 0.0 110.264 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.8 tt -101.18 131.05 47.34 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.7 ptt85 -123.6 150.18 44.43 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 123.891 0.744 . . . . 0.0 110.032 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.519 ' CB ' HD22 ' A' ' 17' ' ' ASN . 53.7 p -128.25 -55.93 1.25 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 124.182 0.926 . . . . 0.0 112.076 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 118.03 -18.54 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.781 0 O-C-N 125.725 1.891 . . . . 0.0 109.542 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -129.3 -178.86 4.84 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.09 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.7 t -111.44 176.65 4.94 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.361 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.3 m 99.73 -52.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.549 0 C-N-CA 126.07 1.748 . . . . 0.0 106.691 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.519 HD22 ' CB ' ' A' ' 12' ' ' SER . 8.7 p-10 -79.86 -51.47 9.1 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.106 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.9 tp -60.87 -42.83 98.68 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.177 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.433 ' HZ3' ' HB3' ' A' ' 19' ' ' LYS . 3.1 mmmp? -52.55 -60.5 3.16 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 61.0 m -48.54 -57.46 6.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 124.984 1.427 . . . . 0.0 109.907 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -40.08 -71.23 0.08 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 124.828 1.33 . . . . 0.0 110.926 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -47.42 -63.04 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.399 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -39.03 -53.68 1.76 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.0 t -106.02 5.65 30.52 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 118.022 2.601 . . . . 0.0 118.022 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -113.6 -25.33 8.77 Favored 'General case' 0 N--CA 1.504 2.27 0 CA-C-N 118.241 0.473 . . . . 0.0 111.645 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.478 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 62.4 m-70 -115.72 -40.25 3.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 123.928 0.768 . . . . 0.0 112.793 -179.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.2 t -91.74 -57.37 2.77 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 124.087 0.867 . . . . 0.0 111.563 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.47 ' HB3' ' HZ1' ' A' ' 28' ' ' LYS . 5.6 ttpm? -110.38 71.56 0.76 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 123.8 0.687 . . . . 0.0 109.188 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -52.45 89.4 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.078 0 O-C-N 124.065 0.853 . . . . 0.0 110.988 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.3 mttp . . . . . 0 N--CA 1.506 2.33 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 -179.916 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.672 0.748 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.0 m -118.78 165.8 13.57 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 103.463 -2.791 . . . . 0.0 103.463 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.408 ' CD1' ' HA ' ' A' ' 14' ' ' ASP . 2.3 m-85 -121.87 162.09 21.6 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.856 0.836 . . . . 0.0 112.148 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -120.52 179.18 4.4 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 112.374 -2.194 . . . . 0.0 106.204 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 44.5 t -106.01 169.13 8.67 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -116.6 25.43 10.59 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 123.981 0.801 . . . . 0.0 109.789 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -141.39 -52.46 0.45 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.439 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.5 p -117.67 -125.91 0.28 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.74 25.56 3.38 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.834 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.558 HD21 ' H ' ' A' ' 11' ' ' ARG . 1.3 tm? -69.19 164.41 22.7 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.099 -1.04 . . . . 0.0 108.323 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.558 ' H ' HD21 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -132.68 147.9 52.34 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 112.507 -2.133 . . . . 0.0 108.256 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.43 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 68.9 m -126.34 -32.27 2.71 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -179.435 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.43 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 112.02 -53.29 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.487 0 O-C-N 126.307 2.254 . . . . 0.0 105.122 -179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' A' ' 15' ' ' SER . 35.1 t70 -137.02 -172.19 3.13 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 113.831 -1.531 . . . . 0.0 107.13 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.423 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 43.1 t -101.61 51.08 0.84 Allowed 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.6 t -122.98 -36.95 2.79 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 112.096 -2.32 . . . . 0.0 106.825 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.9 m-20 -106.36 -1.98 22.72 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.885 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 tp -85.39 -51.69 6.38 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -43.48 -47.74 7.2 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.164 0.915 . . . . 0.0 109.697 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.8 p -59.76 -59.43 5.44 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.233 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 51.7 t60 -41.98 -53.5 3.84 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 123.63 0.581 . . . . 0.0 109.555 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 67.2 mt -53.08 -58.95 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 123.995 0.809 . . . . 0.0 111.429 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -45.87 -39.38 8.53 Favored 'General case' 0 N--CA 1.504 2.267 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.9 m -92.35 -38.89 11.78 Favored 'General case' 0 N--CA 1.506 2.341 0 N-CA-C 119.08 2.992 . . . . 0.0 119.08 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -98.3 -6.72 30.39 Favored 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.9 m-70 -129.33 -47.93 1.19 Allowed 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.535 ' HG ' ' H ' ' A' ' 28' ' ' LYS . 19.2 p -10.13 -65.33 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.536 0 O-C-N 125.867 1.979 . . . . 0.0 113.408 -179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.535 ' H ' ' HG ' ' A' ' 27' ' ' SER . 13.3 tptt -134.23 163.29 29.94 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-N 113.156 -1.838 . . . . 0.0 106.853 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -127.41 58.53 1.46 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 106.26 -1.755 . . . . 0.0 106.26 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp . . . . . 0 N--CA 1.494 1.769 0 CA-C-N 113.259 -1.791 . . . . 0.0 109.611 -179.747 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 53.7 pttt . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 122.415 1.102 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.6 t -143.11 -156.32 0.67 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 113.428 -1.714 . . . . 0.0 107.534 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.7 m-85 -82.47 115.07 21.32 Favored 'General case' 0 N--CA 1.502 2.162 0 N-CA-C 106.231 -1.766 . . . . 0.0 106.231 179.894 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -106.77 171.81 7.16 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 123.37 0.419 . . . . 0.0 110.294 -179.683 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 40.5 t -98.64 166.15 11.47 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 123.292 0.37 . . . . 0.0 111.638 -179.692 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -121.32 27.8 8.14 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 124.163 0.914 . . . . 0.0 110.996 -179.704 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -134.76 -51.89 0.79 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.132 -179.706 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 32.1 p -109.37 -46.24 3.59 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.243 0.965 . . . . 0.0 111.673 -179.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 135.9 -52.03 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.323 0 O-C-N 125.935 2.022 . . . . 0.0 108.386 -179.848 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.5 tt -22.06 130.7 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.461 0 O-C-N 125.377 1.673 . . . . 0.0 113.892 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -111.76 168.18 9.77 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.18 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.7 m -125.37 178.6 5.52 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-N 112.103 -2.317 . . . . 0.0 108.512 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.43 -31.39 10.94 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.281 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -117.36 -160.34 0.77 Allowed 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.682 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.9 p -99.87 -55.89 2.52 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 t -43.75 -50.03 7.82 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 124.085 0.866 . . . . 0.0 110.689 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -49.5 -61.2 2.23 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 114.295 -1.32 . . . . 0.0 110.615 179.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.08 -52.94 62.5 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.825 -179.911 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -40.61 -56.39 2.12 Favored 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 121.848 0.832 . . . . 0.0 109.341 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 87.4 m -55.61 -58.48 7.64 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 113.357 -1.747 . . . . 0.0 109.32 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -39.35 -60.78 0.87 Allowed 'General case' 0 N--CA 1.506 2.34 0 O-C-N 124.318 1.012 . . . . 0.0 109.915 179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.1 mm -48.27 -66.51 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.127 179.743 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -38.67 -46.2 1.2 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.6 t -93.32 -31.92 14.49 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 119.475 3.139 . . . . 0.0 119.475 -179.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -93.83 -17.1 23.44 Favored 'General case' 0 N--CA 1.503 2.179 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.772 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -122.55 -45.62 2.18 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 123.525 0.516 . . . . 0.0 111.525 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.1 p 45.08 16.06 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -179.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -118.54 -179.09 3.69 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-O 121.586 0.708 . . . . 0.0 110.455 -179.863 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -91.85 -49.51 6.21 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.068 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? . . . . . 0 N--CA 1.496 1.831 0 O-C-N 124.488 1.118 . . . . 0.0 109.968 179.8 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? . . . . . 0 N--CA 1.484 1.258 0 N-CA-C 105.486 -2.042 . . . . 0.0 105.486 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.1 m -111.29 167.25 10.43 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.163 -1.586 . . . . 0.0 111.037 0.148 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -129.89 152.06 49.78 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.778 179.769 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.458 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 7.4 tt0 -126.68 169.71 12.86 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 179.69 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.506 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 51.5 t -100.84 154.54 18.56 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.758 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -127.04 42.99 3.21 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.506 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 63.9 m-85 -133.93 -51.17 0.84 Allowed 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 113.182 -1.827 . . . . 0.0 108.321 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 22.1 p -112.94 -52.98 2.75 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.547 1.154 . . . . 0.0 109.972 179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 148.79 -46.93 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.568 0 O-C-N 125.609 1.818 . . . . 0.0 107.813 -179.685 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -20.64 149.88 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.555 0 N-CA-C 116.693 2.108 . . . . 0.0 116.693 -179.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -106.1 155.54 19.32 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.226 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.2 t -134.63 159.37 41.43 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 114.165 -1.38 . . . . 0.0 107.839 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.14 -63.62 1.02 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 179.814 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -137.0 169.92 16.97 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 120.45 -0.5 . . . . 0.0 109.696 179.69 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.3 t -47.77 -51.73 21.3 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 87.0 p -35.09 -37.38 0.07 Allowed 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 111.62 -2.537 . . . . 0.0 113.983 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -97.83 -48.4 5.2 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 124.255 0.972 . . . . 0.0 109.529 -179.783 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.9 tp -39.2 -47.3 1.61 Allowed 'General case' 0 N--CA 1.503 2.217 0 CA-C-O 122.044 0.926 . . . . 0.0 111.147 179.548 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -42.64 -48.21 5.42 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.62 179.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.8 p -73.9 -41.94 61.38 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.851 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -43.98 -56.05 4.22 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 179.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.8 mt -49.6 -66.03 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-N 113.706 -1.588 . . . . 0.0 108.986 179.52 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -32.8 -43.46 0.09 Allowed 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 179.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 51.1 m -89.26 -45.56 9.43 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.148 2.647 . . . . 0.0 118.148 -179.539 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -83.89 -18.08 38.63 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 -179.332 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -124.28 -105.14 0.36 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 123.611 0.569 . . . . 0.0 111.067 -179.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 54.6 m 19.93 71.93 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -179.868 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -106.58 56.76 0.65 Allowed 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 112.559 -2.109 . . . . 0.0 109.583 -179.936 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -125.28 -42.6 1.98 Allowed 'General case' 0 N--CA 1.499 2.009 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.426 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp . . . . . 0 N--CA 1.504 2.259 0 O-C-N 125.964 2.04 . . . . 0.0 116.275 -179.936 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.426 HG23 ' H ' ' A' ' 3' ' ' TYR . 2.4 m -121.47 -165.71 1.28 Allowed 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.426 ' H ' HG23 ' A' ' 2' ' ' THR . 6.4 m-85 -83.92 85.28 7.34 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 101.713 -3.44 . . . . 0.0 101.713 179.509 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -106.51 162.75 13.45 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -179.402 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 38.9 t -72.82 165.98 23.82 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 114.033 -1.44 . . . . 0.0 112.158 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -125.16 24.63 7.41 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.265 -179.918 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -127.5 -47.9 1.42 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.135 -179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.41 ' SG ' ' N ' ' A' ' 9' ' ' GLU . 30.5 p -116.02 -114.72 0.33 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.41 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 16.0 tp10 -136.81 -40.08 0.62 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 123.761 0.663 . . . . 0.0 112.442 -179.794 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -28.77 136.22 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -179.561 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.7 ptp180 -128.83 158.35 38.95 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.4 179.458 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -114.41 -163.13 0.85 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 105.308 -2.108 . . . . 0.0 105.308 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.47 -48.48 2.87 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -132.64 175.79 9.01 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 113.991 -1.459 . . . . 0.0 107.411 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.2 p -38.6 -36.97 0.28 Allowed 'General case' 0 N--CA 1.508 2.462 0 CA-C-O 122.789 1.28 . . . . 0.0 109.659 179.337 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.8 m -108.27 134.22 51.4 Favored 'General case' 0 C--N 1.308 -1.207 1 N-CA-C 98.925 -4.472 . . . . 0.0 98.925 179.798 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.5 65.25 0.77 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 118.877 -2.389 . . . . 0.0 113.32 0.49 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.8 tp -99.82 -50.93 3.87 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-N 113.485 -1.689 . . . . 0.0 107.34 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -36.64 -61.13 0.55 Allowed 'General case' 0 N--CA 1.507 2.392 0 O-C-N 124.082 0.863 . . . . 0.0 110.649 179.454 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.8 t -47.93 -49.72 29.21 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 113.833 -1.53 . . . . 0.0 111.539 179.767 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.404 ' ND1' ' HD2' ' A' ' 25' ' ' LYS . 74.6 t60 -48.88 -71.66 0.06 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 124.033 0.833 . . . . 0.0 110.788 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 51.3 mt -43.46 -48.47 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 124.362 1.039 . . . . 0.0 112.339 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -56.96 -55.98 27.66 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 92.8 m -79.59 -32.59 41.96 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 119.642 3.201 . . . . 0.0 119.642 -179.256 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.404 ' HD2' ' ND1' ' A' ' 21' ' ' HIS . 53.4 mttp -96.84 -11.71 24.49 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -179.312 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -129.44 -59.86 1.07 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.2 m -45.93 -65.64 0.52 Allowed 'General case' 0 N--CA 1.505 2.323 0 O-C-N 123.903 0.752 . . . . 0.0 111.21 -179.845 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 37.8 pttt -120.31 109.73 15.72 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 179.601 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -113.08 50.62 0.87 Allowed 'General case' 0 N--CA 1.497 1.896 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.678 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.7 pttp . . . . . 0 N--CA 1.506 2.366 0 N-CA-C 117.12 2.267 . . . . 0.0 117.12 179.662 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 98.2 mttt . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 119.235 -0.412 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.7 m -118.53 164.68 14.94 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.059 -1.65 . . . . 0.0 108.399 -0.06 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -123.49 154.08 39.63 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 124.324 1.015 . . . . 0.0 109.432 179.954 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -129.41 166.92 18.61 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 39.8 t -83.85 161.18 20.99 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -122.95 32.98 5.53 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 123.771 0.669 . . . . 0.0 110.575 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -137.21 -42.24 0.57 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.997 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.8 p -110.77 -59.52 1.95 Allowed 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 160.74 -46.85 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.327 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -27.5 148.33 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 O-C-N 125.634 1.834 . . . . 0.0 115.123 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.6 ttm-85 -109.99 153.82 24.02 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.767 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.7 p -124.55 -174.91 3.13 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 179.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.05 -61.81 1.69 Allowed 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 120.557 -0.457 . . . . 0.0 109.906 -179.973 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.604 ' H ' HD22 ' A' ' 17' ' ' ASN . 39.4 m-20 -125.48 177.12 6.37 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 124.368 1.042 . . . . 0.0 112.159 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.6 t -94.99 46.62 1.13 Allowed 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 122.93 1.348 . . . . 0.0 110.629 -179.689 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.0 p -128.53 -28.38 2.52 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 112.672 -2.058 . . . . 0.0 105.979 179.572 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.604 HD22 ' H ' ' A' ' 14' ' ' ASP . 1.1 p30 -107.09 -49.43 3.28 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 113.042 -1.89 . . . . 0.0 110.894 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 62.1 tp -40.82 -45.11 2.4 Favored 'General case' 0 N--CA 1.509 2.485 0 CA-C-N 117.977 0.353 . . . . 0.0 111.25 179.778 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -49.71 -60.79 2.56 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.949 179.624 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.5 t -50.47 -43.14 55.28 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 124.219 0.949 . . . . 0.0 111.286 -179.723 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -55.45 -64.14 0.94 Allowed 'General case' 0 N--CA 1.5 2.073 0 O-C-N 124.25 0.969 . . . . 0.0 109.273 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -49.41 -63.43 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.002 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -38.91 -33.15 0.1 Allowed 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -179.932 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.1 m -97.1 -44.08 7.12 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 118.283 2.697 . . . . 0.0 118.283 -179.383 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -91.37 -12.97 33.33 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 115.286 1.588 . . . . 0.0 115.286 -179.366 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -127.2 -40.79 1.81 Allowed 'General case' 0 N--CA 1.496 1.87 0 O-C-N 123.733 0.645 . . . . 0.0 110.951 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 t 62.47 41.55 9.71 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-N 114.15 -1.386 . . . . 0.0 108.002 -179.75 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? 0.28 66.98 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.393 0 N-CA-C 117.093 2.257 . . . . 0.0 117.093 -179.928 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 26.92 53.02 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 CA-C-O 122.855 1.312 . . . . 0.0 112.63 -179.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 85.2 tttt . . . . . 0 N--CA 1.495 1.793 0 CA-C-N 112.017 -2.356 . . . . 0.0 108.651 -179.937 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp . . . . . 0 N--CA 1.494 1.775 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 35.5 m 87.92 168.63 0.05 Allowed 'General case' 0 N--CA 1.508 2.428 0 O-C-N 125.52 1.763 . . . . 0.0 109.117 179.808 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.69 75.31 1.0 Allowed 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 105.375 -2.083 . . . . 0.0 105.375 179.533 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -122.81 173.66 7.62 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-N 111.196 -2.729 . . . . 0.0 106.286 179.763 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.471 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 51.1 t -97.43 156.93 16.26 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.631 -179.868 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -121.46 37.08 4.43 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 124.268 0.98 . . . . 0.0 109.355 -179.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -133.12 -50.4 0.88 Allowed 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.093 -1.412 . . . . 0.0 109.043 179.867 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 27.5 p -113.25 -51.77 2.8 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 124.509 1.131 . . . . 0.0 108.431 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 33.7 tt0 112.97 61.08 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.599 0 O-C-N 126.305 2.253 . . . . 0.0 110.79 179.799 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.471 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 8.2 tt -107.37 135.66 48.48 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 104.642 -2.355 . . . . 0.0 104.642 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.1 ttt180 -115.16 147.72 39.91 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-O 121.838 0.828 . . . . 0.0 111.301 -179.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 62.2 m -118.64 -48.35 2.49 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-N 112.859 -1.973 . . . . 0.0 106.201 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.415 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 108.77 -38.22 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.431 0 O-C-N 126.633 2.458 . . . . 0.0 109.089 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -122.12 -176.67 3.4 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.978 -179.847 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.689 ' HG ' ' HG ' ' A' ' 16' ' ' SER . 0.4 OUTLIER -115.47 161.57 18.4 Favored 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 -179.985 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.689 ' HG ' ' HG ' ' A' ' 15' ' ' SER . 71.0 m -112.2 41.07 2.05 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 123.014 2.643 . . . . 0.0 107.88 0.019 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -72.04 -41.7 67.16 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 103.085 -2.931 . . . . 0.0 103.085 179.743 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.4 tp -57.08 -51.89 67.48 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.434 179.527 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -45.38 -58.52 3.27 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 179.708 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.6 m -48.35 -56.86 7.01 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.213 179.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -45.31 -67.5 0.28 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.828 0.705 . . . . 0.0 109.701 179.642 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.8 mm -37.92 -57.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 124.622 1.201 . . . . 0.0 112.775 179.835 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -58.16 -40.27 80.97 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 63.9 p -88.41 -32.13 18.49 Favored 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -179.592 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -92.77 -24.74 18.46 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 123.73 0.644 . . . . 0.0 110.895 -179.943 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -127.55 29.77 5.45 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 123.892 0.745 . . . . 0.0 111.881 179.979 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.8 t -32.73 -36.49 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 179.372 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -95.09 163.04 13.47 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 123.899 0.749 . . . . 0.0 110.91 -179.43 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -116.7 141.17 48.55 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.909 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 87.3 tttt . . . . . 0 N--CA 1.504 2.232 0 CA-C-N 121.643 2.02 . . . . 0.0 108.24 -0.117 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 49.4 tttm . . . . . 0 N--CA 1.492 1.632 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.9 m -127.54 177.71 6.58 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.811 -1.54 . . . . 0.0 107.568 -179.87 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.431 ' CE2' ' HA ' ' A' ' 15' ' ' SER . 7.2 m-85 -89.24 101.7 14.37 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.454 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 1.6 tt0 -113.61 -170.68 1.74 Allowed 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 103.853 -2.647 . . . . 0.0 103.853 179.579 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.454 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 50.1 t -107.04 158.35 17.12 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -122.9 36.09 4.73 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 179.807 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.425 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 86.3 m-85 -137.94 -54.78 0.66 Allowed 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 113.961 -1.472 . . . . 0.0 108.779 179.966 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.3 p -117.6 -129.38 0.29 Allowed 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 102.302 -3.222 . . . . 0.0 102.302 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -147.64 52.2 1.05 Allowed 'General case' 0 N--CA 1.501 2.089 0 O-C-N 123.692 0.62 . . . . 0.0 111.967 -179.696 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.9 tt -107.62 148.87 28.76 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.23 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -107.04 145.27 32.56 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 124.585 1.178 . . . . 0.0 108.005 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.407 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 58.3 m -114.9 -43.51 3.11 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.754 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.407 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 110.15 -60.76 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.291 0 O-C-N 126.55 2.406 . . . . 0.0 105.621 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -135.9 162.47 32.75 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.859 1.35 . . . . 0.0 110.283 179.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.431 ' HA ' ' CE2' ' A' ' 3' ' ' TYR . 1.9 t -37.01 -52.7 0.97 Allowed 'General case' 0 N--CA 1.505 2.32 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.049 179.588 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.7 t -27.86 -41.42 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 CA-C-N 112.91 -1.95 . . . . 0.0 116.187 179.813 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -105.04 -37.66 6.86 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 123.693 0.62 . . . . 0.0 111.077 -179.564 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 tp -48.5 -27.29 2.61 Favored 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.427 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 10.2 mtpm? -106.46 124.73 50.04 Favored 'General case' 0 C--N 1.308 -1.207 1 N-CA-C 96.08 -5.526 . . . . 0.0 96.08 178.814 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.609 ' HG1' ' HG1' ' A' ' 24' ' ' THR . 19.2 p -97.38 26.83 4.58 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 119.256 -2.152 . . . . 0.0 114.605 0.678 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -44.07 -61.15 1.57 Allowed 'General case' 0 N--CA 1.507 2.377 0 CA-C-N 119.647 1.112 . . . . 0.0 109.963 179.769 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.4 mt -56.03 -69.75 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.258 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -31.99 -48.51 0.16 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 179.783 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.609 ' HG1' ' HG1' ' A' ' 20' ' ' THR . 33.4 m -95.13 -26.44 16.01 Favored 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 118.312 2.708 . . . . 0.0 118.312 -179.257 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -101.71 -10.69 19.76 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 -179.459 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.4 m-70 -129.05 -35.47 1.83 Allowed 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 115.549 1.685 . . . . 0.0 115.549 -179.952 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.1 t -93.04 -55.19 3.43 Favored 'General case' 0 N--CA 1.501 2.083 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -179.453 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -89.32 -61.85 1.61 Allowed 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.662 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 85.36 -45.01 0.06 Allowed 'General case' 0 N--CA 1.506 2.341 0 O-C-N 125.431 1.707 . . . . 0.0 109.636 179.828 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp . . . . . 0 N--CA 1.495 1.82 0 CA-C-N 114.218 -1.356 . . . . 0.0 109.373 -179.968 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 11.2 pttp . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.762 0.791 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.7 m -107.43 169.2 8.73 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.882 -179.864 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -114.21 108.06 16.45 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 114.443 -1.253 . . . . 0.0 108.27 -179.879 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.7 tp60 -113.28 178.77 4.17 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.413 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 42.0 t -106.94 159.07 16.55 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 120.072 -0.651 . . . . 0.0 112.127 -179.912 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -123.21 33.52 5.36 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.02 -1.445 . . . . 0.0 110.292 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -134.74 -49.12 0.76 Allowed 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.682 -1.144 . . . . 0.0 108.278 179.894 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.6 p -115.66 -63.12 1.5 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 124.331 1.019 . . . . 0.0 109.568 179.794 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 132.79 49.25 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.575 0 C-N-CA 127.345 2.258 . . . . 0.0 109.592 -179.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.446 HD13 ' CE1' ' A' ' 21' ' ' HIS . 6.5 tt -98.22 153.27 18.61 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 179.856 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.9 ttm105 -107.73 137.25 46.09 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.973 -1.467 . . . . 0.0 109.432 -179.66 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.1 t -116.81 -51.54 2.57 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-N 113.854 -1.521 . . . . 0.0 107.669 179.874 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 92.09 -32.94 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.321 0 O-C-N 126.296 2.247 . . . . 0.0 110.385 179.982 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -136.58 136.23 39.08 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 124.253 0.971 . . . . 0.0 110.379 -179.872 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 53.4 p -39.75 -50.3 2.34 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 124.05 0.844 . . . . 0.0 109.555 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.9 t -29.82 -41.38 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 O-C-N 125.627 1.829 . . . . 0.0 115.39 179.593 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -102.29 -40.81 6.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 123.787 0.68 . . . . 0.0 109.696 -179.643 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -46.31 -42.92 15.37 Favored 'General case' 0 N--CA 1.505 2.31 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 179.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -45.85 -68.65 0.18 Allowed 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.905 179.347 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.5 p -53.94 -45.98 71.42 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 113.531 -1.668 . . . . 0.0 111.145 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.446 ' CE1' HD13 ' A' ' 10' ' ' LEU . 74.0 t60 -46.47 -65.38 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.671 1.232 . . . . 0.0 112.054 -179.954 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.7 mt -49.9 -56.65 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 124.292 0.995 . . . . 0.0 111.963 -179.645 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -51.12 -48.59 61.71 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -179.806 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 m -82.17 -37.09 26.64 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 118.609 2.818 . . . . 0.0 118.609 -179.218 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -96.31 -15.28 22.01 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -179.65 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -126.4 15.53 7.71 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.686 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.1 m -9.63 -58.33 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.571 0 N-CA-C 115.789 1.774 . . . . 0.0 115.789 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -114.53 62.04 0.67 Allowed 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 114.042 -1.436 . . . . 0.0 108.652 -179.945 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -9.14 -67.46 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 CA-C-N 112.982 -1.917 . . . . 0.0 115.504 -179.783 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.444 ' HB3' ' NZ ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 122.391 1.091 . . . . 0.0 111.661 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.9 pttm . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 120.366 0.127 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.7 p -114.85 171.79 7.44 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 122.397 1.094 . . . . 0.0 112.573 -179.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.416 ' CE1' ' HA ' ' A' ' 14' ' ' ASP . 6.6 m-85 -114.02 165.06 13.01 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.136 -2.302 . . . . 0.0 106.197 179.852 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -131.91 164.15 26.74 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 179.704 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.41 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 42.3 t -106.34 159.34 16.21 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 105.903 -1.888 . . . . 0.0 105.903 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.449 ' NE2' ' N ' ' A' ' 6' ' ' GLN . 0.0 OUTLIER -122.82 35.03 4.98 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.887 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -132.36 -50.76 0.93 Allowed 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.81 -1.541 . . . . 0.0 108.676 179.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.5 p -112.69 -42.13 3.68 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.215 0.947 . . . . 0.0 109.282 179.849 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 97.19 54.07 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.138 0 O-C-N 126.265 2.228 . . . . 0.0 109.956 179.809 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.41 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 5.5 tt -104.23 148.32 26.47 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 103.434 -2.802 . . . . 0.0 103.434 179.652 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.402 ' HD2' ' C ' ' A' ' 10' ' ' LEU . 5.4 mpt_? -108.69 141.89 39.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 124.362 1.039 . . . . 0.0 110.69 -179.501 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.5 m -124.13 -166.47 1.5 Allowed 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 113.305 -1.77 . . . . 0.0 108.75 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -104.89 -42.82 5.24 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.753 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.577 ' H ' HD22 ' A' ' 17' ' ' ASN . 34.5 t70 -129.92 -165.54 1.55 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 123.94 0.775 . . . . 0.0 109.698 -179.803 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.504 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 45.5 t -93.01 -42.55 9.37 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 179.735 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.8 m -47.3 -43.69 22.77 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-O 121.944 0.878 . . . . 0.0 110.802 179.861 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.577 HD22 ' H ' ' A' ' 14' ' ' ASP . 16.8 p30 -83.53 -24.48 31.63 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.623 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 27.4 tp -67.79 -46.55 71.64 Favored 'General case' 0 N--CA 1.506 2.37 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 179.687 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -51.28 -52.45 44.95 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.0 m -57.36 -53.21 60.75 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.882 179.549 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -40.44 -59.59 1.29 Allowed 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.348 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -51.69 -60.47 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.96 179.633 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -34.89 -50.13 0.47 Allowed 'General case' 0 N--CA 1.503 2.206 0 O-C-N 124.539 1.15 . . . . 0.0 113.038 179.555 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.404 ' HA ' ' HB2' ' A' ' 28' ' ' LYS . 24.3 m -114.64 45.89 1.49 Allowed 'General case' 0 N--CA 1.501 2.12 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -179.751 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -156.09 -37.15 0.08 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 121.389 0.614 . . . . 0.0 110.406 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -119.65 -38.58 2.97 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-N 114.203 -1.362 . . . . 0.0 113.28 -179.252 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 p -113.48 51.43 0.85 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.275 0.985 . . . . 0.0 112.618 -179.596 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.404 ' HB2' ' HA ' ' A' ' 24' ' ' THR . 1.1 tmmm? -127.26 -67.79 0.82 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 103.547 -2.761 . . . . 0.0 103.547 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.499 ' H ' ' CD ' ' A' ' 29' ' ' GLU . 12.3 mp0 -6.56 79.78 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.099 0 O-C-N 126.676 2.485 . . . . 0.0 113.854 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.4 ttmt . . . . . 0 N--CA 1.496 1.863 0 CA-C-O 122.513 1.149 . . . . 0.0 108.838 -179.879 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.8 pttp . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 69.0 p -107.55 165.95 11.03 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.835 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.467 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 1.0 OUTLIER -131.27 167.28 19.48 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 105.569 -2.011 . . . . 0.0 105.569 179.895 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -126.53 165.87 18.33 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 179.588 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.403 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 44.8 t -94.49 -66.19 0.93 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.96 -179.945 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 28.2 tt0 90.92 -10.5 0.28 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 125.13 1.519 . . . . 0.0 111.53 179.885 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -91.7 -47.51 7.33 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.733 -179.769 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.2 p -111.45 -24.26 10.27 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.925 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 94.16 53.61 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 126.775 2.03 . . . . 0.0 111.084 179.446 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.413 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 11.5 tp -107.64 162.34 14.06 Favored 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 114.122 -1.399 . . . . 0.0 107.482 179.79 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.413 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 15.3 ttt85 -125.27 157.94 35.35 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 179.452 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.9 m -122.54 176.02 6.15 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.411 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.25 -47.59 2.93 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 124.676 1.235 . . . . 0.0 110.018 -179.903 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -123.45 162.59 22.53 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 123.761 0.663 . . . . 0.0 110.192 -179.974 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.6 p -50.42 -47.64 56.55 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-O 121.837 0.827 . . . . 0.0 108.92 179.584 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.5 m -56.63 -55.16 37.45 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.4 -1.727 . . . . 0.0 108.192 -179.989 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -40.69 -54.23 2.64 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.873 179.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -64.04 -57.17 10.45 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.831 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp -39.92 -54.7 2.14 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 124.201 0.938 . . . . 0.0 110.932 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.2 p -60.44 -54.43 45.64 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.065 -179.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 44.6 t60 -42.98 -59.17 2.11 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 119.611 -0.835 . . . . 0.0 109.536 179.802 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.38 -69.71 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 124.277 0.985 . . . . 0.0 109.756 179.522 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mmtm -41.51 -34.17 0.53 Allowed 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 -179.762 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.0 m -91.46 -41.46 10.83 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 118.658 2.836 . . . . 0.0 118.658 -179.549 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -103.56 -4.9 23.3 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -132.76 -40.92 0.95 Allowed 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 81.7 p 40.52 54.55 2.97 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 125.187 1.554 . . . . 0.0 107.191 -179.198 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 30' ' ' LYS . 22.5 ttmm 58.19 65.69 1.24 Allowed 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 112.067 -2.333 . . . . 0.0 104.847 -179.559 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 37.84 -77.58 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.049 0 CA-C-N 112.163 -2.29 . . . . 0.0 113.544 -179.487 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.016 0 CA-C-O 122.25 1.024 . . . . 0.0 108.722 179.758 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 99.0 mttt . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.67 0.748 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 95.5 m -129.28 174.77 9.3 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 179.594 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.513 ' CE1' ' HB2' ' A' ' 15' ' ' SER . 82.9 m-85 -123.05 76.27 1.36 Allowed 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 179.876 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -111.94 163.77 13.87 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 104.284 -2.487 . . . . 0.0 104.284 -179.962 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.6 t -103.21 153.79 20.0 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.817 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -119.79 35.81 4.72 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 122.131 0.967 . . . . 0.0 109.278 -179.812 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -131.52 -52.25 1.01 Allowed 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 113.772 -1.558 . . . . 0.0 107.676 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.7 p -119.86 -116.82 0.32 Allowed 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 103.538 -2.764 . . . . 0.0 103.538 179.717 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -161.94 58.8 0.25 Allowed 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.395 0.617 . . . . 0.0 109.81 179.74 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.1 tt -107.28 115.25 29.84 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 179.816 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -116.31 137.04 52.48 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.587 -179.834 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.5 p -128.38 -174.84 3.33 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-N 112.486 -2.143 . . . . 0.0 109.0 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.07 -23.88 8.82 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.52 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -115.12 174.76 5.82 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.364 1.04 . . . . 0.0 110.687 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.513 ' HB2' ' CE1' ' A' ' 3' ' ' TYR . 22.2 t -115.23 52.45 0.87 Allowed 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.49 ' HG ' ' H ' ' A' ' 17' ' ' ASN . 32.3 p -110.72 -45.17 3.53 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 112.999 -1.91 . . . . 0.0 110.432 -179.698 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.49 ' H ' ' HG ' ' A' ' 16' ' ' SER . 5.4 m-80 -106.44 -14.65 15.02 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 125.383 1.677 . . . . 0.0 113.085 -179.879 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -74.13 -53.7 9.35 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.676 -179.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -47.85 -48.31 31.08 Favored 'General case' 0 N--CA 1.5 2.067 0 CA-C-O 121.196 0.522 . . . . 0.0 109.795 179.669 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.3 p -65.6 -52.4 52.37 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.263 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -36.3 -64.55 0.32 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 123.954 0.784 . . . . 0.0 110.354 179.58 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.6 mt -51.52 -61.01 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 123.751 0.657 . . . . 0.0 111.152 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -38.18 -43.31 0.75 Allowed 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.565 ' HG1' ' HZ1' ' A' ' 25' ' ' LYS . 70.9 p -98.63 -38.7 9.02 Favored 'General case' 0 N--CA 1.508 2.455 0 N-CA-C 120.008 3.336 . . . . 0.0 120.008 -179.407 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.565 ' HZ1' ' HG1' ' A' ' 24' ' ' THR . 47.8 mmtm -79.1 -26.27 42.96 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -179.235 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -116.04 -59.31 2.0 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.7 t 76.85 -56.54 0.55 Allowed 'General case' 0 N--CA 1.507 2.414 0 O-C-N 125.124 1.515 . . . . 0.0 111.7 179.797 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -123.72 -174.97 3.1 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 113.67 -1.604 . . . . 0.0 109.449 -179.949 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -122.0 82.84 2.01 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 179.893 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.453 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.886 0 O-C-N 119.721 -1.862 . . . . 0.0 111.105 -0.14 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.474 ' CD1' ' HA ' ' A' ' 14' ' ' ASP . 2.4 m-85 . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 105.149 -2.167 . . . . 0.0 105.149 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -108.57 175.46 5.46 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 124.736 1.273 . . . . 0.0 109.255 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.2 t -89.92 172.73 8.66 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -118.66 13.97 13.43 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 123.862 0.726 . . . . 0.0 111.032 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -129.87 -47.92 1.13 Allowed 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.511 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.1 p -112.78 -116.47 0.32 Allowed 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -164.08 42.76 0.1 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -106.68 131.63 53.59 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.586 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.427 ' C ' ' HD3' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -114.06 168.81 9.5 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.695 179.954 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.6 t -129.15 -83.84 0.56 Allowed 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -164.88 -66.99 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 103.07 -2.937 . . . . 0.0 103.07 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.474 ' HA ' ' CD1' ' A' ' 3' ' ' TYR . 2.4 m-20 -134.44 162.28 32.67 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 124.782 1.301 . . . . 0.0 110.961 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.3 p -36.67 -53.09 0.9 Allowed 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.813 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.6 p -15.39 -50.51 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 126.329 2.268 . . . . 0.0 116.905 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -106.28 -45.39 4.3 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 114.658 -1.156 . . . . 0.0 110.397 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.6 tt -40.78 -45.1 2.37 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.17 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -43.12 -49.69 6.29 Favored 'General case' 0 N--CA 1.507 2.408 0 CA-C-O 121.455 0.645 . . . . 0.0 111.172 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.8 m -57.15 -55.86 29.28 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.436 -1.256 . . . . 0.0 109.741 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -37.68 -61.37 0.63 Allowed 'General case' 0 N--CA 1.507 2.407 0 O-C-N 124.649 1.218 . . . . 0.0 109.454 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.0 mt -47.34 -69.13 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.2 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -40.42 -39.17 0.94 Allowed 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.2 p -92.21 -36.55 13.2 Favored 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 118.692 2.849 . . . . 0.0 118.692 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.44 ' N ' ' HD2' ' A' ' 25' ' ' LYS . 13.8 mptt -95.07 -13.86 24.78 Favored 'General case' 0 N--CA 1.508 2.427 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.9 m-70 -122.02 -33.35 3.55 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.55 0.531 . . . . 0.0 109.829 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 79.1 p . . . . . 0 N--CA 1.5 2.045 0 O-C-N 124.871 1.357 . . . . 0.0 113.177 179.905 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 . . . . . 0 N--CA 1.496 1.859 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -137.8 165.65 25.93 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 44.6 t -82.18 161.13 22.88 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -119.76 28.7 7.97 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.151 0.907 . . . . 0.0 109.256 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -132.62 -55.12 0.95 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.005 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.7 p -111.72 -113.72 0.32 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.72 43.64 0.38 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.3 tt -90.62 148.91 22.35 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 11' ' ' ARG . 1.1 ptp85 -124.08 143.59 50.37 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 124.712 1.258 . . . . 0.0 111.099 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -140.52 168.43 19.81 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.423 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.16 2.75 11.43 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -125.51 -173.2 2.77 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.614 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.8 p -107.45 -49.69 3.21 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.5 p -42.21 -62.15 1.01 Allowed 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 121.922 0.868 . . . . 0.0 111.202 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -45.28 -48.94 12.95 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 113.728 -1.578 . . . . 0.0 111.223 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.432 HD13 HD13 ' A' ' 22' ' ' ILE . 3.4 tm? -62.25 -59.56 4.85 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.123 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -40.28 -53.69 2.5 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 124.234 0.959 . . . . 0.0 111.457 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.2 p -64.22 -51.02 65.71 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.445 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -37.78 -57.7 0.97 Allowed 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.433 ' N ' HD12 ' A' ' 22' ' ' ILE . 2.4 mp -57.67 -62.65 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 124.764 1.29 . . . . 0.0 111.859 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 tttt -42.74 -37.57 1.8 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.5 m -83.19 -58.74 2.72 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 118.484 2.772 . . . . 0.0 118.484 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -87.48 -4.58 59.0 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 116.956 2.206 . . . . 0.0 116.956 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -125.76 -33.91 2.68 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.3 m . . . . . 0 N--CA 1.504 2.246 0 N-CA-C 118.67 2.841 . . . . 0.0 118.67 -179.64 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.461 ' CE2' ' HB2' ' A' ' 15' ' ' SER . 36.7 m-85 . . . . . 0 N--CA 1.493 1.711 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -114.07 154.88 26.97 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.8 t -72.43 -49.39 33.87 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 118.38 2.733 . . . . 0.0 118.38 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 72.93 17.12 4.31 Favored 'General case' 0 N--CA 1.509 2.488 0 C-N-CA 124.328 1.051 . . . . 0.0 112.456 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.479 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 24.4 m-85 -121.38 -50.36 2.12 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.418 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 24.3 p -111.56 -50.2 2.94 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.418 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 45.9 tp10 118.68 66.8 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 126.92 2.637 . . . . 0.0 110.108 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 14.5 tp -106.04 157.63 17.39 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.5 ttt85 -118.49 120.01 36.25 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.8 1.313 . . . . 0.0 108.535 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -122.53 149.58 43.73 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 122.845 1.307 . . . . 0.0 111.364 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -135.09 83.93 2.06 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 101.46 -3.533 . . . . 0.0 101.46 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.457 ' HB2' ' CD1' ' A' ' 3' ' ' TYR . 1.9 p30 -137.24 -153.61 0.5 Allowed 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 126.739 2.016 . . . . 0.0 106.973 0.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.461 ' HB2' ' CE2' ' A' ' 3' ' ' TYR . 43.7 t -26.02 -55.92 0.07 Allowed 'General case' 0 N--CA 1.503 2.211 0 O-C-N 124.23 0.957 . . . . 0.0 112.303 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.5 m -33.37 -38.81 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 CA-C-N 113.005 -1.907 . . . . 0.0 115.841 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 68.7 m-20 -95.11 -50.78 4.92 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.817 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.412 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 2.8 tt -40.46 -46.38 2.42 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 123.853 0.721 . . . . 0.0 110.722 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -44.45 -56.17 4.48 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.118 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.0 p -66.3 -42.36 88.42 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 28.1 t60 -44.61 -61.39 1.58 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.77 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.3 mt -50.25 -61.8 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 O-C-N 124.604 1.19 . . . . 0.0 109.399 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -31.0 -52.23 0.18 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 125.468 1.73 . . . . 0.0 114.178 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.8 t -112.7 36.19 3.55 Favored 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -142.21 -35.38 0.43 Allowed 'General case' 0 N--CA 1.503 2.225 0 CA-C-O 121.411 0.625 . . . . 0.0 109.876 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -119.64 -64.39 1.27 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 113.857 -1.519 . . . . 0.0 107.144 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.495 1.822 0 O-C-N 125.673 1.858 . . . . 0.0 113.449 179.507 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.405 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 32.2 tt0 -116.25 153.89 31.1 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 105.031 -2.211 . . . . 0.0 105.031 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.432 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 53.9 t -74.65 159.77 31.68 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.028 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -120.76 37.05 4.4 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.432 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 54.2 m-85 -137.5 -50.45 0.62 Allowed 'General case' 0 N--CA 1.496 1.872 0 CA-C-N 113.506 -1.679 . . . . 0.0 108.403 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -118.88 -124.35 0.28 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 103.942 -2.614 . . . . 0.0 103.942 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -157.06 48.95 0.44 Allowed 'General case' 0 N--CA 1.499 2.009 0 CA-C-O 121.483 0.659 . . . . 0.0 112.643 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.0 tt -109.23 160.33 16.2 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.711 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.2 mtp180 -117.4 145.51 44.05 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 123.844 0.715 . . . . 0.0 109.17 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.6 m -130.93 146.18 52.26 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 114.781 -1.099 . . . . 0.0 112.064 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -127.6 91.96 3.4 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 125.137 1.523 . . . . 0.0 107.934 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -122.42 -97.32 0.45 Allowed 'General case' 0 N--CA 1.501 2.113 0 CA-C-N 121.636 2.017 . . . . 0.0 110.067 0.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.575 ' N ' ' HB3' ' A' ' 16' ' ' SER . 79.7 p -144.37 63.99 1.31 Allowed 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.575 ' HB3' ' N ' ' A' ' 15' ' ' SER . 4.6 t 50.21 -155.31 0.12 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 117.224 -3.422 . . . . 0.0 112.848 0.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.1 m-20 -25.43 -30.15 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 118.592 2.812 . . . . 0.0 118.592 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -84.58 -59.91 2.22 Favored 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.434 ' C ' ' HD3' ' A' ' 19' ' ' LYS . 8.0 tmtm? -46.37 -48.96 18.47 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.4 p -63.39 -51.85 64.1 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 113.093 -1.867 . . . . 0.0 109.959 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -41.05 -58.11 1.84 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 76.0 mt -52.02 -63.21 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 124.356 1.035 . . . . 0.0 108.822 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -31.7 -42.0 0.05 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 125.201 1.563 . . . . 0.0 113.853 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 65.9 p -101.55 -42.82 6.1 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.24 -21.29 42.96 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -120.36 -37.17 3.08 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 123.704 0.627 . . . . 0.0 111.422 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.9 t . . . . . 0 N--CA 1.5 2.059 0 O-C-N 123.912 0.758 . . . . 0.0 111.464 -179.846 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 15' ' ' SER . 4.4 m-85 . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 103.975 -2.602 . . . . 0.0 103.975 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -132.15 160.43 36.07 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 119.401 -0.919 . . . . 0.0 113.283 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.433 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.5 t -102.44 149.96 23.85 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 114.029 -1.442 . . . . 0.0 108.676 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -120.93 41.78 3.21 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 124.209 0.943 . . . . 0.0 108.798 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.433 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 71.8 m-85 -131.66 -42.56 1.03 Allowed 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 113.55 -1.659 . . . . 0.0 109.944 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.7 p -116.07 -49.92 2.68 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 124.227 0.954 . . . . 0.0 111.7 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 144.39 -40.5 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.661 0 O-C-N 125.608 1.817 . . . . 0.0 109.612 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.5 tt -24.9 143.94 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 116.592 2.071 . . . . 0.0 116.592 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.7 ttt85 -124.35 145.89 49.16 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 113.469 -1.696 . . . . 0.0 106.987 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.6 p -124.87 164.43 20.07 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.81 0.94 20.63 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 123.836 0.71 . . . . 0.0 111.349 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -137.24 177.08 8.14 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 124.006 0.816 . . . . 0.0 110.355 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.487 ' HB2' ' CZ ' ' A' ' 3' ' ' TYR . 27.1 t -115.32 40.21 2.75 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.3 t -120.21 -49.87 2.27 Favored 'General case' 0 N--CA 1.496 1.825 0 CA-C-N 114.433 -1.258 . . . . 0.0 109.807 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -102.97 32.6 3.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.267 0.979 . . . . 0.0 110.905 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.469 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 2.7 tm? -109.21 -61.65 1.59 Allowed 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -46.29 -56.75 5.33 Favored 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 62.3 p -56.5 -45.14 81.16 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 112.767 -2.015 . . . . 0.0 110.407 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.469 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 82.4 t60 -43.77 -70.09 0.12 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 124.226 0.954 . . . . 0.0 110.796 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mp -47.5 -64.98 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.051 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -35.5 -52.37 0.65 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 68.0 p -114.99 26.94 9.76 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 116.694 2.109 . . . . 0.0 116.694 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.461 ' HA ' ' HE2' ' A' ' 25' ' ' LYS . 10.4 mmpt? -128.98 -32.77 2.04 Favored 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.7 m-70 -109.26 -27.76 9.37 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 124.168 0.917 . . . . 0.0 112.49 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.501 2.124 0 C-N-CA 118.685 -1.206 . . . . 0.0 108.958 179.777 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 24.4 m-85 . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -122.17 155.02 36.66 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.88 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.39 166.53 8.11 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.221 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -123.87 23.5 8.62 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.696 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.507 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 91.0 m-85 -139.57 -49.62 0.49 Allowed 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 115.721 1.749 . . . . 0.0 115.721 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.407 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 28.7 p -107.18 -64.36 1.2 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 118.218 -0.896 . . . . 0.0 112.889 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.407 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 14.3 pt-20 143.72 52.39 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.535 0 O-C-N 125.503 1.752 . . . . 0.0 110.927 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.7 tt -104.45 154.56 19.72 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.7 ptt85 -117.02 146.13 43.25 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 64.6 m -131.81 179.2 6.21 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 113.01 -1.904 . . . . 0.0 106.425 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -123.35 -38.17 2.59 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.953 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -125.33 165.34 18.53 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 124.25 0.969 . . . . 0.0 112.51 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 40.6 t -115.72 147.06 41.32 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 105.967 -1.864 . . . . 0.0 105.967 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 75.6 m -96.82 56.79 1.49 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 121.151 1.796 . . . . 0.0 112.15 0.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -98.39 12.97 33.24 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.0 -51.97 2.82 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 101.22 -3.622 . . . . 0.0 101.22 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -53.59 -46.23 70.27 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.9 m -43.33 -50.84 6.61 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 124.474 1.109 . . . . 0.0 110.598 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 54.2 t60 -58.69 -63.2 1.37 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.529 1.143 . . . . 0.0 108.968 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.5 mt -41.62 -61.96 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 O-C-N 125.053 1.471 . . . . 0.0 111.119 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -37.54 -63.83 0.43 Allowed 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.709 -1.587 . . . . 0.0 112.881 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.8 m -66.08 -45.26 81.89 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 120.873 3.657 . . . . 0.0 120.873 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -94.69 -7.53 40.44 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.507 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 68.9 m-70 -126.75 -37.1 2.17 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 77.8 p . . . . . 0 N--CA 1.501 2.098 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 179.877 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 . . . . . 0 N--CA 1.499 1.993 0 CA-C-O 120.493 0.187 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -135.22 161.25 35.91 Favored 'General case' 0 N--CA 1.501 2.082 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.476 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 52.9 t -99.85 141.99 31.92 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.217 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -118.45 44.45 2.25 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 124.56 1.163 . . . . 0.0 109.027 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.493 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 79.1 m-85 -129.27 -46.8 1.21 Allowed 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 113.173 -1.83 . . . . 0.0 106.707 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -118.04 -52.24 2.42 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 124.577 1.173 . . . . 0.0 111.015 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 147.82 -39.47 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.772 0 O-C-N 125.025 1.453 . . . . 0.0 112.248 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.6 tt -29.92 153.43 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 116.625 2.084 . . . . 0.0 116.625 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 62.7 mtt-85 -119.22 152.17 37.09 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.622 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.5 m -124.05 -162.87 1.1 Allowed 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 113.91 -1.496 . . . . 0.0 107.574 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.24 -63.71 1.3 Allowed 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -124.42 171.57 9.84 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 124.221 0.95 . . . . 0.0 109.455 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.1 t -47.72 -52.34 18.79 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.0 p -43.27 -50.89 6.46 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.901 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -68.68 -48.72 63.22 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.441 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.8 -50.07 14.46 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -49.74 -56.15 11.3 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 179.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.5 m -40.46 -55.58 2.24 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 124.863 1.352 . . . . 0.0 108.769 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -53.37 -68.18 0.2 Allowed 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 113.069 -1.878 . . . . 0.0 109.277 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.3 mm -39.48 -67.03 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 124.536 1.148 . . . . 0.0 110.922 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -36.6 -52.51 0.88 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 124.812 1.32 . . . . 0.0 114.344 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.6 p -108.79 37.76 2.45 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 116.083 1.882 . . . . 0.0 116.083 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -144.81 -36.62 0.31 Allowed 'General case' 0 N--CA 1.501 2.09 0 CA-C-O 121.262 0.553 . . . . 0.0 109.543 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -127.75 -61.17 1.13 Allowed 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 87.4 p . . . . . 0 N--CA 1.508 2.429 0 O-C-N 126.758 2.536 . . . . 0.0 110.166 179.917 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 . . . . . 0 N--CA 1.495 1.806 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.7 tp60 -120.76 157.67 29.18 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.799 1.312 . . . . 0.0 108.257 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.9 t -99.89 149.31 23.53 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -119.15 43.64 2.54 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 122.19 0.995 . . . . 0.0 110.593 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -133.23 -52.06 0.89 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 112.994 -1.912 . . . . 0.0 105.868 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.9 p -119.51 -124.49 0.28 Allowed 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 102.149 -3.278 . . . . 0.0 102.149 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -147.61 56.21 1.09 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 123.993 0.808 . . . . 0.0 108.927 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.472 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 24.2 tp -105.29 139.19 40.31 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.033 -1.067 . . . . 0.0 111.61 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.472 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -134.92 146.44 49.16 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.583 -1.644 . . . . 0.0 111.569 179.392 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.2 t -142.03 171.96 13.35 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 112.875 -1.966 . . . . 0.0 108.449 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.17 -12.79 25.76 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -121.66 -173.69 2.7 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 124.26 0.975 . . . . 0.0 108.55 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.7 t -119.19 -38.46 3.04 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.8 p -31.66 -46.12 0.1 Allowed 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.3 p30 -84.54 -36.82 21.89 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 119.017 -1.073 . . . . 0.0 109.969 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 23.6 tp -49.21 -41.61 37.63 Favored 'General case' 0 N--CA 1.503 2.22 0 CA-C-O 121.505 0.669 . . . . 0.0 109.837 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.7 tmtp? -51.97 -53.65 38.91 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -61.29 -52.94 62.6 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.118 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.411 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 70.1 t60 -35.41 -59.18 0.55 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.145 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 71.2 mt -53.06 -57.96 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-O 121.494 0.664 . . . . 0.0 109.361 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.436 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 4.1 ttmp? -45.61 -41.86 10.61 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.689 -1.141 . . . . 0.0 113.094 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -87.68 -37.83 16.38 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 121.276 3.806 . . . . 0.0 121.276 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.3 mtpt -108.11 0.1 21.42 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 115.141 1.534 . . . . 0.0 115.141 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 47.3 m-70 -125.52 -40.25 2.1 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.3 p . . . . . 0 N--CA 1.504 2.249 0 C-N-CA 119.543 -0.863 . . . . 0.0 111.286 179.834 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -112.88 114.95 27.69 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 124.011 0.819 . . . . 0.0 109.058 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 53.2 t -23.31 -70.48 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.46 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 64.1 tt0 109.62 -23.06 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.723 0 O-C-N 126.094 2.122 . . . . 0.0 110.305 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -99.5 -52.65 3.43 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.436 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 29.7 p -103.55 -49.45 3.69 Favored 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 34.4 tt0 119.12 64.02 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 126.695 2.497 . . . . 0.0 109.236 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.406 HD13 ' ND1' ' A' ' 21' ' ' HIS . 9.1 tt -106.51 137.64 44.14 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 103.461 -2.792 . . . . 0.0 103.461 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 24.9 ttp85 -115.0 134.49 55.14 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 122.27 1.033 . . . . 0.0 113.604 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 t -129.41 179.3 5.87 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 112.135 -2.302 . . . . 0.0 106.16 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -117.06 -21.41 8.88 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.086 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -141.33 -172.38 3.5 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 124.337 1.023 . . . . 0.0 108.774 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 16' ' ' SER . 30.7 t -105.75 171.71 7.19 Favored 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 15' ' ' SER . 25.1 t 101.02 -31.13 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.795 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -106.48 -16.15 14.61 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-N 113.071 -1.877 . . . . 0.0 109.61 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.41 -55.13 2.46 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 104.503 -2.406 . . . . 0.0 104.503 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HG3' ' HE2' ' A' ' 23' ' ' LYS . 1.1 tppp? -50.7 -53.04 34.57 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 56.5 m -60.84 -50.35 73.8 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 114.31 -1.314 . . . . 0.0 108.44 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.406 ' ND1' HD13 ' A' ' 10' ' ' LEU . 39.2 t60 -40.6 -59.15 1.43 Allowed 'General case' 0 N--CA 1.503 2.206 0 O-C-N 124.091 0.87 . . . . 0.0 108.768 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.3 mt -54.15 -59.58 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 123.782 0.676 . . . . 0.0 109.786 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.406 ' HE2' ' HG3' ' A' ' 19' ' ' LYS . 22.1 mtmt -44.46 -28.97 0.63 Allowed 'General case' 0 N--CA 1.503 2.2 0 N-CA-C 114.779 1.399 . . . . 0.0 114.779 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.1 m -101.92 -40.91 6.68 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 118.138 2.644 . . . . 0.0 118.138 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -89.95 -14.93 33.06 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.9 m-70 -127.37 -46.55 1.47 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.0 t . . . . . 0 N--CA 1.495 1.801 0 O-C-N 124.423 1.077 . . . . 0.0 108.434 -179.739 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 . . . . . 0 N--CA 1.496 1.866 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.418 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 69.4 tp60 -121.23 158.1 28.81 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.418 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 40.4 t -105.75 139.14 40.78 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 104.772 -2.307 . . . . 0.0 104.772 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -113.58 47.12 1.19 Allowed 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 122.701 1.238 . . . . 0.0 109.747 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 67.0 m-85 -136.08 -55.64 0.76 Allowed 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 112.263 -2.244 . . . . 0.0 108.548 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -121.3 -117.22 0.31 Allowed 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.337 1.023 . . . . 0.0 110.189 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.2 mp0 -122.16 -49.73 2.05 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 tt -23.49 129.93 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 117.04 2.237 . . . . 0.0 117.04 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -131.77 145.56 51.66 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.5 m -128.56 173.9 9.85 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 123.869 0.73 . . . . 0.0 110.212 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.17 35.14 3.73 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -132.4 -62.92 0.81 Allowed 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.353 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.4 t 125.61 -58.4 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 104.274 -2.491 . . . . 0.0 104.274 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.6 m -44.97 -58.07 3.4 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 124.149 0.906 . . . . 0.0 110.378 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -46.91 -60.56 2.36 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 114.182 -1.372 . . . . 0.0 110.255 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.419 HD13 ' C ' ' A' ' 18' ' ' LEU . 3.0 tm? -50.99 -52.95 37.56 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.209 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -47.69 -55.95 8.36 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 121.093 0.473 . . . . 0.0 110.038 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.1 m -56.45 -47.37 79.28 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.059 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 37.4 t60 -50.4 -58.08 6.52 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 123.765 0.665 . . . . 0.0 109.654 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.6 mt -54.07 -60.34 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.48 -23.02 5.44 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 23.9 m -96.08 -45.16 7.0 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 117.725 2.491 . . . . 0.0 117.725 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -97.36 -7.25 32.33 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 56.6 m-70 -122.79 -48.09 2.04 Favored 'General case' 0 N--CA 1.501 2.11 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.077 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.95 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -123.6 164.06 19.78 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 51.0 t -93.79 155.24 17.32 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -114.37 32.08 6.17 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 124.003 0.814 . . . . 0.0 109.665 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -137.26 -53.91 0.69 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 114.746 -1.116 . . . . 0.0 111.141 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.7 p -114.62 -116.64 0.32 Allowed 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.44 52.37 0.53 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.558 0.694 . . . . 0.0 111.801 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.2 tt -105.65 140.42 38.74 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.6 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -122.97 152.18 41.13 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 124.412 1.07 . . . . 0.0 109.952 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.2 p -140.14 179.02 6.87 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.613 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -103.35 -43.92 5.3 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.021 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -109.68 -168.01 1.27 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 124.35 1.032 . . . . 0.0 110.339 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 p -97.51 -45.65 6.34 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.802 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.1 m -40.46 -52.07 2.81 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -80.23 1.92 26.51 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -107.29 -46.78 3.8 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.484 ' HG3' ' N ' ' A' ' 20' ' ' THR . 0.2 OUTLIER -55.84 -49.48 73.2 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.598 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.484 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 8.8 t -51.47 -40.98 60.55 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 123.645 0.591 . . . . 0.0 110.417 179.81 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.3 t60 -59.88 -66.24 0.55 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.8 mt -46.29 -53.55 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-O 121.256 0.551 . . . . 0.0 109.944 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -38.55 -48.28 1.4 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.936 -1.484 . . . . 0.0 114.058 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 44.9 p -110.07 -9.23 14.73 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -102.69 -22.54 13.93 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -127.82 -38.03 1.89 Allowed 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.503 2.211 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 -179.375 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.4 m-30 . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.573 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 64.7 tp60 -125.7 170.35 11.62 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 114.646 -1.161 . . . . 0.0 108.816 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.573 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 32.5 t -104.52 -54.51 2.51 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.502 ' H ' HE21 ' A' ' 4' ' ' GLN . 40.4 tt0 80.63 16.3 0.64 Allowed 'General case' 0 N--CA 1.505 2.294 0 O-C-N 125.252 1.595 . . . . 0.0 109.793 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -126.78 -45.71 1.59 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 118.974 -0.536 . . . . 0.0 112.404 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 p -116.16 -117.59 0.32 Allowed 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -140.27 28.09 2.08 Favored 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.7 tt -109.25 155.13 21.48 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.62 157.06 39.91 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 105.553 -2.017 . . . . 0.0 105.553 179.546 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -126.34 168.2 14.47 Favored 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 120.661 -0.416 . . . . 0.0 109.968 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.58 -52.49 2.76 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 124.01 0.819 . . . . 0.0 110.387 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -109.36 155.04 21.7 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 122.049 0.928 . . . . 0.0 110.347 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.417 ' C ' ' HZ3' ' A' ' 19' ' ' LYS . 50.1 m -49.57 -56.42 10.0 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 113.141 -1.845 . . . . 0.0 110.802 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.4 t -45.95 -62.67 1.22 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 124.545 1.153 . . . . 0.0 110.025 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -43.2 -58.19 2.62 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 124.417 1.073 . . . . 0.0 111.701 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.403 ' C ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -52.88 -57.04 11.58 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.417 ' HZ3' ' C ' ' A' ' 15' ' ' SER . 38.3 mtmm -53.17 -49.3 66.93 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 119.819 -0.752 . . . . 0.0 109.829 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 67.1 m -53.39 -50.98 64.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 124.033 0.833 . . . . 0.0 109.029 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -51.02 -58.77 5.21 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.281 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.0 mt -57.39 -26.07 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.62 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.463 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.05 -48.23 25.02 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.749 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.9 p -85.33 -29.15 24.75 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -101.55 -22.29 14.53 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 123.762 0.664 . . . . 0.0 110.569 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -131.68 33.69 3.98 Favored 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 119.018 -1.073 . . . . 0.0 113.099 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.0 p . . . . . 0 N--CA 1.513 2.682 0 O-C-N 124.413 1.07 . . . . 0.0 113.634 179.685 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 . . . . . 0 N--CA 1.496 1.852 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.429 ' HG3' ' H ' ' A' ' 5' ' ' CYS . 2.1 tt0 -125.58 177.06 6.44 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.428 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.429 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 51.0 t -106.46 161.87 14.21 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.201 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -118.9 29.72 7.56 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 124.132 0.895 . . . . 0.0 108.895 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -137.19 -49.84 0.62 Allowed 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.063 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 9' ' ' GLU . 30.0 p -114.75 -48.78 2.83 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 124.093 0.871 . . . . 0.0 110.991 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 31.2 mm-40 129.56 -2.51 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.918 0 C-N-CA 127.054 2.142 . . . . 0.0 113.389 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -44.83 135.36 5.16 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 124.082 0.864 . . . . 0.0 109.314 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -124.03 144.55 49.77 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 124.396 1.06 . . . . 0.0 112.737 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.3 t -126.98 -176.01 3.59 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-N 112.649 -2.069 . . . . 0.0 107.926 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.5 -9.2 12.1 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.303 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -135.74 -177.0 4.48 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 124.478 1.111 . . . . 0.0 111.782 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.5 m -113.61 38.87 2.8 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.031 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.7 t -117.71 -54.49 2.35 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 104.945 -2.243 . . . . 0.0 104.945 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -75.42 -43.03 52.1 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 113.514 -1.675 . . . . 0.0 109.385 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.54 -53.28 60.14 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.165 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.461 ' C ' ' HD3' ' A' ' 19' ' ' LYS . 13.1 tmtt? -50.31 -60.29 3.13 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 120.191 -0.603 . . . . 0.0 109.576 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.4 p -52.36 -42.27 63.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 123.804 0.69 . . . . 0.0 112.436 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -49.69 -62.65 1.44 Allowed 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.33 179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.54 HD12 ' H ' ' A' ' 22' ' ' ILE . 2.9 mp -50.07 -59.62 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 O-C-N 123.737 0.648 . . . . 0.0 110.473 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -36.58 -51.82 0.85 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 23.1 m -85.37 -42.6 14.4 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 119.358 3.095 . . . . 0.0 119.358 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.59 -8.34 56.38 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.16 0.913 . . . . 0.0 112.867 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -150.18 70.65 1.04 Allowed 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 102.506 -3.146 . . . . 0.0 102.506 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.7 p . . . . . 0 N--CA 1.501 2.075 0 O-C-N 118.702 -2.498 . . . . 0.0 109.757 0.401 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 N--CA 1.501 2.097 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.528 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 31.6 tt0 -121.75 173.97 7.13 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 124.995 1.434 . . . . 0.0 107.63 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.528 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 48.0 t -100.7 163.36 12.37 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.66 25.96 9.42 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 124.219 0.949 . . . . 0.0 109.676 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.482 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 63.2 m-85 -123.35 -53.83 1.8 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 107.243 -1.392 . . . . 0.0 107.243 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -118.04 -121.23 0.3 Allowed 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 104.116 -2.55 . . . . 0.0 104.116 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -159.42 51.28 0.35 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.541 0.686 . . . . 0.0 109.824 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.3 tt -106.48 158.51 16.86 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.938 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -118.95 161.75 19.67 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.193 0.997 . . . . 0.0 113.539 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.8 m -125.23 -158.81 0.85 Allowed 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 112.537 -2.119 . . . . 0.0 110.225 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.79 -55.0 2.54 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.8 p-10 -122.15 -43.95 2.3 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 116.121 1.896 . . . . 0.0 116.121 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.6 p 156.02 -49.49 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.8 p -47.09 -42.7 19.37 Favored 'General case' 0 N--CA 1.507 2.398 0 CA-C-O 121.51 0.672 . . . . 0.0 109.305 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -67.78 -47.52 68.95 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -46.13 -45.53 16.58 Favored 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 179.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -51.59 -59.65 4.03 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 124.314 1.009 . . . . 0.0 108.837 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.6 p -51.4 -46.27 62.8 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 124.111 0.882 . . . . 0.0 110.916 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -48.47 -66.69 0.36 Allowed 'General case' 0 N--CA 1.502 2.141 0 C-N-CA 119.811 -0.755 . . . . 0.0 109.02 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.1 mt -48.94 -55.74 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 124.264 0.978 . . . . 0.0 111.499 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -33.25 -57.72 0.4 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 125.193 1.558 . . . . 0.0 113.996 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 50.2 m -115.07 48.11 1.2 Allowed 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 122.233 1.016 . . . . 0.0 113.406 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -145.31 -39.1 0.25 Allowed 'General case' 0 N--CA 1.5 2.073 0 CA-C-N 114.664 -1.153 . . . . 0.0 109.539 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -121.36 -40.33 2.59 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 114.152 -1.385 . . . . 0.0 111.575 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 73.2 p . . . . . 0 N--CA 1.5 2.071 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -179.401 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.438 ' HG3' ' H ' ' A' ' 6' ' ' GLN . 4.1 tp-100 -124.28 156.22 37.29 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 124.425 1.078 . . . . 0.0 111.017 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 14.7 t -107.09 -17.87 14.05 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 114.435 -1.257 . . . . 0.0 113.819 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.438 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 9.7 pt20 40.89 30.39 0.09 Allowed 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 116.374 1.991 . . . . 0.0 116.374 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -135.43 -59.93 0.76 Allowed 'General case' 0 N--CA 1.504 2.259 0 N-CA-C 106.055 -1.831 . . . . 0.0 106.055 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.448 ' SG ' ' HB2' ' A' ' 10' ' ' LEU . 17.8 p -118.45 29.57 7.69 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 105.396 -2.076 . . . . 0.0 105.396 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 24.72 55.03 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 112.646 -2.07 . . . . 0.0 112.373 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.448 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 4.3 tp -90.96 146.42 23.89 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 104.132 -2.544 . . . . 0.0 104.132 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -114.35 149.32 36.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 124.325 1.016 . . . . 0.0 109.151 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.6 t -138.9 170.97 15.02 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.116 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.62 -4.59 10.28 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 125.137 1.523 . . . . 0.0 108.817 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -127.47 169.8 13.27 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.5 p -104.99 -45.79 4.45 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 124.206 0.942 . . . . 0.0 112.744 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.425 ' HA ' ' NZ ' ' A' ' 19' ' ' LYS . 22.7 t -50.39 -53.35 29.9 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 122.071 0.939 . . . . 0.0 112.528 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.0 p-10 -60.33 -30.17 69.34 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.38 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -72.15 -53.41 12.78 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 118.862 -0.589 . . . . 0.0 110.19 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.443 ' HG3' ' N ' ' A' ' 20' ' ' THR . 17.6 pttm -52.15 -48.12 65.09 Favored 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.21 -1.396 . . . . 0.0 109.73 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.443 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 41.1 p -62.29 -51.06 69.2 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.743 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.477 ' CE1' ' HD2' ' A' ' 25' ' ' LYS . 68.1 t60 -38.11 -59.51 0.85 Allowed 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.031 0.443 . . . . 0.0 110.192 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 86.0 mt -54.64 -59.65 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.654 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -40.67 -42.78 1.8 Allowed 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.5 t -101.35 -19.86 15.44 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 120.107 3.373 . . . . 0.0 120.107 -179.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.477 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 47.0 mttp -106.51 -14.62 15.01 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -122.75 -46.22 2.13 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 120.318 -0.553 . . . . 0.0 112.296 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.3 p . . . . . 0 N--CA 1.504 2.264 0 C-N-CA 118.146 -1.422 . . . . 0.0 108.178 179.952 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.406 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 4.9 m-85 . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -141.24 167.54 21.93 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 41.8 t -105.33 -68.61 0.85 Allowed 'General case' 0 N--CA 1.504 2.257 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.945 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.45 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 31.5 tp60 107.42 -27.09 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.572 0 O-C-N 125.816 1.947 . . . . 0.0 109.955 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -83.38 -46.02 13.03 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.768 0.668 . . . . 0.0 110.511 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -115.53 -40.85 3.33 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 109.42 49.03 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.176 0 O-C-N 126.887 2.617 . . . . 0.0 110.643 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.556 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 44.2 tp -98.39 158.97 15.25 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.556 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 55.7 mtt-85 -121.54 -176.91 3.41 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.297 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.442 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 24.0 t -141.24 -70.83 0.36 Allowed 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.738 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.442 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 108.49 -20.09 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.546 0 O-C-N 125.909 2.006 . . . . 0.0 109.047 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.459 ' O ' ' CB ' ' A' ' 15' ' ' SER . 3.6 p-10 -119.29 -45.42 2.54 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.459 ' CB ' ' O ' ' A' ' 14' ' ' ASP . 37.5 t 121.85 -51.02 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.878 0 C-N-CA 126.016 1.727 . . . . 0.0 109.596 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.1 t -47.85 -52.46 19.04 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.846 0.831 . . . . 0.0 111.922 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -64.71 2.71 0.63 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-N 112.714 -2.039 . . . . 0.0 114.379 -179.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -106.52 -52.03 2.85 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 103.533 -2.766 . . . . 0.0 103.533 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.4 mtmm -54.29 -54.45 40.09 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.294 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.5 t -62.99 -39.71 95.55 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 123.79 0.682 . . . . 0.0 109.259 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.429 ' CG ' HD23 ' A' ' 10' ' ' LEU . 13.8 t60 -51.01 -63.3 1.17 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 123.996 0.81 . . . . 0.0 109.219 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.6 mt -46.84 -59.83 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.452 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -49.48 -31.99 11.18 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -93.4 -41.1 10.01 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 118.067 2.617 . . . . 0.0 118.067 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -92.29 -15.24 27.68 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 -121.28 -43.48 2.42 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 123.444 0.465 . . . . 0.0 111.243 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.503 2.188 0 CA-C-O 122.112 0.958 . . . . 0.0 109.116 179.941 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 . . . . . 0 N--CA 1.492 1.668 1 N-CA-C 99.966 -4.087 . . . . 0.0 99.966 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 24.2 tt0 -107.73 161.67 14.67 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.606 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.513 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 36.0 t -87.0 162.61 17.54 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 113.163 -1.835 . . . . 0.0 108.632 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -122.73 36.79 4.56 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 124.297 0.998 . . . . 0.0 110.582 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 52.1 m-85 -136.08 -49.48 0.68 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.708 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 9' ' ' GLU . 27.3 p -111.82 -63.62 1.4 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.765 1.291 . . . . 0.0 110.605 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.484 ' HB3' ' O ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER 135.55 41.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.532 0 O-C-N 126.004 2.065 . . . . 0.0 108.932 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.469 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 49.7 tp -83.4 157.03 22.65 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.523 HH11 ' H ' ' A' ' 13' ' ' ALA . 10.9 ttp85 -119.55 119.53 34.07 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 125.279 1.612 . . . . 0.0 107.696 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -132.88 77.1 1.72 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.523 ' H ' HH11 ' A' ' 11' ' ' ARG . . . -75.75 68.55 2.33 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 122.717 1.246 . . . . 0.0 112.658 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -139.19 -61.35 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.567 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p 127.3 -62.1 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.476 0 O-C-N 126.803 2.564 . . . . 0.0 109.865 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 m -57.59 -54.92 41.46 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 121.49 0.662 . . . . 0.0 109.364 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -42.52 -51.73 4.97 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.605 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -56.62 -54.69 43.07 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.034 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -43.47 -59.04 2.31 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 124.105 0.878 . . . . 0.0 111.718 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.8 t -60.56 -48.42 81.85 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 117.373 -1.299 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -40.31 -64.55 0.5 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.427 1.012 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.4 mt -43.66 -64.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 124.606 1.191 . . . . 0.0 113.956 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -58.72 -32.6 69.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.7 p -104.14 23.98 12.17 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.8 mmmm -142.02 -28.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.416 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 85.9 m-70 -119.29 -56.21 2.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 124.828 1.33 . . . . 0.0 108.651 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.501 2.079 0 O-C-N 126.092 2.12 . . . . 0.0 107.948 -179.985 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 . . . . . 0 N--CA 1.492 1.668 1 N-CA-C 99.966 -4.087 . . . . 0.0 99.966 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 24.2 tt0 -107.73 161.67 14.67 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.606 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.513 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 36.0 t -87.0 162.61 17.54 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 113.163 -1.835 . . . . 0.0 108.632 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -122.73 36.79 4.56 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 124.297 0.998 . . . . 0.0 110.582 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 52.1 m-85 -136.08 -49.48 0.68 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.708 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 9' ' ' GLU . 27.3 p -111.82 -63.62 1.4 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.765 1.291 . . . . 0.0 110.605 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.484 ' HB3' ' O ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER 135.55 41.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.532 0 O-C-N 126.004 2.065 . . . . 0.0 108.932 -179.808 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.469 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 49.7 tp -83.4 157.03 22.65 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.523 HH11 ' H ' ' A' ' 13' ' ' ALA . 10.9 ttp85 -119.55 119.53 34.07 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 125.279 1.612 . . . . 0.0 107.696 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -132.88 77.1 1.72 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.523 ' H ' HH11 ' A' ' 11' ' ' ARG . . . -75.75 68.55 2.33 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 122.717 1.246 . . . . 0.0 112.658 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -139.19 -61.35 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.567 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p 127.3 -62.1 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.476 0 O-C-N 126.803 2.564 . . . . 0.0 109.865 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 m -57.59 -54.92 41.46 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 121.49 0.662 . . . . 0.0 109.364 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -42.52 -51.73 4.97 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.605 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -56.62 -54.69 43.07 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.034 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -43.47 -59.04 2.31 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 124.105 0.878 . . . . 0.0 111.718 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.8 t -60.56 -48.42 81.85 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 117.373 -1.299 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -40.31 -64.55 0.5 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.427 1.012 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.4 mt -43.66 -64.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 124.606 1.191 . . . . 0.0 113.956 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -58.72 -32.6 69.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -179.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.7 p -104.14 23.98 12.17 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.8 mmmm -142.02 -28.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.416 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 85.9 m-70 -119.29 -56.21 2.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 124.828 1.33 . . . . 0.0 108.651 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.501 2.079 0 O-C-N 126.092 2.12 . . . . 0.0 107.948 -179.985 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 104.207 -2.516 . . . . 0.0 104.207 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -124.96 144.56 50.3 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 125.591 1.807 . . . . 0.0 108.565 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.0 t -63.38 163.16 11.15 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 114.24 -1.346 . . . . 0.0 113.211 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -126.28 38.88 4.05 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.519 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 80.8 m-85 -139.47 -47.58 0.47 Allowed 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 114.331 -1.304 . . . . 0.0 112.325 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.8 p -109.69 -65.37 1.16 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 124.037 0.836 . . . . 0.0 112.465 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 140.14 41.73 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.596 0 C-N-CA 126.487 1.915 . . . . 0.0 110.264 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.442 HD23 ' C ' ' A' ' 10' ' ' LEU . 6.8 tt -101.18 131.05 47.34 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.7 ptt85 -123.6 150.18 44.43 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 123.891 0.744 . . . . 0.0 110.032 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.435 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 53.7 p -128.25 -55.93 1.25 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 124.182 0.926 . . . . 0.0 112.076 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 118.03 -18.54 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.781 0 O-C-N 125.725 1.891 . . . . 0.0 109.542 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -129.3 -178.86 4.84 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.09 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.7 t -111.44 176.65 4.94 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.361 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.3 m 99.73 -52.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.549 0 C-N-CA 126.07 1.748 . . . . 0.0 106.691 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.45 ' ND2' ' H ' ' A' ' 17' ' ' ASN . 2.9 p30 -79.86 -51.47 9.1 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.106 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.9 tp -60.87 -42.83 98.68 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.177 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -52.55 -60.5 3.16 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 61.0 m -48.54 -57.46 6.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 124.984 1.427 . . . . 0.0 109.907 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -40.08 -71.23 0.08 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 124.828 1.33 . . . . 0.0 110.926 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -47.42 -63.04 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.399 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -39.03 -53.68 1.76 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.0 t -106.02 5.65 30.52 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 118.022 2.601 . . . . 0.0 118.022 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -113.6 -25.33 8.77 Favored 'General case' 0 N--CA 1.504 2.27 0 CA-C-N 118.241 0.473 . . . . 0.0 111.645 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.519 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 62.4 m-70 -115.72 -40.25 3.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 123.928 0.768 . . . . 0.0 112.793 -179.66 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.497 1.887 0 O-C-N 124.087 0.867 . . . . 0.0 111.563 -179.756 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 121.856 0.836 . . . . 0.0 112.148 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.417 ' HG3' ' H ' ' A' ' 5' ' ' CYS . 10.6 tp-100 -120.52 179.18 4.4 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 112.374 -2.194 . . . . 0.0 106.204 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.417 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 44.5 t -106.01 169.13 8.67 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -116.6 25.43 10.59 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 123.981 0.801 . . . . 0.0 109.789 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -141.39 -52.46 0.45 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.439 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.5 p -117.67 -125.91 0.28 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.74 25.56 3.38 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.834 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.673 HD22 ' H ' ' A' ' 11' ' ' ARG . 1.3 tm? -69.19 164.41 22.7 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.099 -1.04 . . . . 0.0 108.323 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.673 ' H ' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -132.68 147.9 52.34 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 112.507 -2.133 . . . . 0.0 108.256 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.43 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 68.9 m -126.34 -32.27 2.71 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -179.435 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.43 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 112.02 -53.29 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.487 0 O-C-N 126.307 2.254 . . . . 0.0 105.122 -179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.405 ' CG ' ' H ' ' A' ' 15' ' ' SER . 35.1 t70 -137.02 -172.19 3.13 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 113.831 -1.531 . . . . 0.0 107.13 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.405 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 43.1 t -101.61 51.08 0.84 Allowed 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.6 t -122.98 -36.95 2.79 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 112.096 -2.32 . . . . 0.0 106.825 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.9 m-20 -106.36 -1.98 22.72 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.885 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 tp -85.39 -51.69 6.38 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -43.48 -47.74 7.2 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.164 0.915 . . . . 0.0 109.697 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.8 p -59.76 -59.43 5.44 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.233 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.405 ' CE1' ' HG ' ' A' ' 10' ' ' LEU . 51.7 t60 -41.98 -53.5 3.84 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 123.63 0.581 . . . . 0.0 109.555 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 67.2 mt -53.08 -58.95 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 123.995 0.809 . . . . 0.0 111.429 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -45.87 -39.38 8.53 Favored 'General case' 0 N--CA 1.504 2.267 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.9 m -92.35 -38.89 11.78 Favored 'General case' 0 N--CA 1.506 2.341 0 N-CA-C 119.08 2.992 . . . . 0.0 119.08 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -98.3 -6.72 30.39 Favored 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.9 m-70 -129.33 -47.93 1.19 Allowed 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.2 p . . . . . 0 N--CA 1.51 2.536 0 O-C-N 125.867 1.979 . . . . 0.0 113.408 -179.808 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.7 m-85 . . . . . 0 N--CA 1.502 2.162 0 N-CA-C 106.231 -1.766 . . . . 0.0 106.231 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -106.77 171.81 7.16 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 123.37 0.419 . . . . 0.0 110.294 -179.683 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 40.5 t -98.64 166.15 11.47 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 123.292 0.37 . . . . 0.0 111.638 -179.692 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -121.32 27.8 8.14 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 124.163 0.914 . . . . 0.0 110.996 -179.704 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -134.76 -51.89 0.79 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.132 -179.706 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 32.1 p -109.37 -46.24 3.59 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.243 0.965 . . . . 0.0 111.673 -179.599 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 135.9 -52.03 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.323 0 O-C-N 125.935 2.022 . . . . 0.0 108.386 -179.848 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.5 tt -22.06 130.7 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.461 0 O-C-N 125.377 1.673 . . . . 0.0 113.892 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -111.76 168.18 9.77 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.18 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.7 m -125.37 178.6 5.52 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-N 112.103 -2.317 . . . . 0.0 108.512 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.43 -31.39 10.94 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.281 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -117.36 -160.34 0.77 Allowed 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.682 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.9 p -99.87 -55.89 2.52 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 t -43.75 -50.03 7.82 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 124.085 0.866 . . . . 0.0 110.689 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -49.5 -61.2 2.23 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 114.295 -1.32 . . . . 0.0 110.615 179.766 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.08 -52.94 62.5 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.825 -179.911 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -40.61 -56.39 2.12 Favored 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 121.848 0.832 . . . . 0.0 109.341 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 87.4 m -55.61 -58.48 7.64 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 113.357 -1.747 . . . . 0.0 109.32 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -39.35 -60.78 0.87 Allowed 'General case' 0 N--CA 1.506 2.34 0 O-C-N 124.318 1.012 . . . . 0.0 109.915 179.688 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.1 mm -48.27 -66.51 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.127 179.743 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -38.67 -46.2 1.2 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.6 t -93.32 -31.92 14.49 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 119.475 3.139 . . . . 0.0 119.475 -179.414 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -93.83 -17.1 23.44 Favored 'General case' 0 N--CA 1.503 2.179 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.772 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -122.55 -45.62 2.18 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 123.525 0.516 . . . . 0.0 111.525 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.1 p . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -179.851 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.407 ' CE2' ' HB2' ' A' ' 15' ' ' SER . 19.3 m-85 . . . . . 0 N--CA 1.504 2.229 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.5 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 7.4 tt0 -126.68 169.71 12.86 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 179.69 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.511 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 51.5 t -100.84 154.54 18.56 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.758 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -127.04 42.99 3.21 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.511 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 63.9 m-85 -133.93 -51.17 0.84 Allowed 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 113.182 -1.827 . . . . 0.0 108.321 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 9' ' ' GLU . 22.1 p -112.94 -52.98 2.75 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.547 1.154 . . . . 0.0 109.972 179.898 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 4.1 tm-20 148.79 -46.93 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.568 0 O-C-N 125.609 1.818 . . . . 0.0 107.813 -179.685 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.429 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 0.9 OUTLIER -20.64 149.88 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.555 0 N-CA-C 116.693 2.108 . . . . 0.0 116.693 -179.845 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.429 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 2.3 ptm180 -106.1 155.54 19.32 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.226 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.2 t -134.63 159.37 41.43 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 114.165 -1.38 . . . . 0.0 107.839 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.14 -63.62 1.02 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 179.814 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -137.0 169.92 16.97 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 120.45 -0.5 . . . . 0.0 109.696 179.69 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.407 ' HB2' ' CE2' ' A' ' 3' ' ' TYR . 39.3 t -47.77 -51.73 21.3 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 179.567 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 87.0 p -35.09 -37.38 0.07 Allowed 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 111.62 -2.537 . . . . 0.0 113.983 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -97.83 -48.4 5.2 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 124.255 0.972 . . . . 0.0 109.529 -179.783 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.9 tp -39.2 -47.3 1.61 Allowed 'General case' 0 N--CA 1.503 2.217 0 CA-C-O 122.044 0.926 . . . . 0.0 111.147 179.548 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -42.64 -48.21 5.42 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.62 179.733 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.8 p -73.9 -41.94 61.38 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.851 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -43.98 -56.05 4.22 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 179.393 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.8 mt -49.6 -66.03 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-N 113.706 -1.588 . . . . 0.0 108.986 179.52 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -32.8 -43.46 0.09 Allowed 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 179.742 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 51.1 m -89.26 -45.56 9.43 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.148 2.647 . . . . 0.0 118.148 -179.539 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.41 ' HB3' ' NZ ' ' A' ' 25' ' ' LYS . 3.5 mmmp? -83.89 -18.08 38.63 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 -179.332 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -124.28 -105.14 0.36 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 123.611 0.569 . . . . 0.0 111.067 -179.714 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 54.6 m . . . . . 0 N--CA 1.501 2.114 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -179.868 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 101.713 -3.44 . . . . 0.0 101.713 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -106.51 162.75 13.45 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -179.402 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 38.9 t -72.82 165.98 23.82 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 114.033 -1.44 . . . . 0.0 112.158 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -125.16 24.63 7.41 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.265 -179.918 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -127.5 -47.9 1.42 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.135 -179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.441 ' SG ' ' N ' ' A' ' 9' ' ' GLU . 30.5 p -116.02 -114.72 0.33 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.441 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 16.0 tp10 -136.81 -40.08 0.62 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 123.761 0.663 . . . . 0.0 112.442 -179.794 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -28.77 136.22 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -179.561 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.7 ptp180 -128.83 158.35 38.95 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.4 179.458 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -114.41 -163.13 0.85 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 105.308 -2.108 . . . . 0.0 105.308 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.47 -48.48 2.87 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -132.64 175.79 9.01 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 113.991 -1.459 . . . . 0.0 107.411 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.2 p -38.6 -36.97 0.28 Allowed 'General case' 0 N--CA 1.508 2.462 0 CA-C-O 122.789 1.28 . . . . 0.0 109.659 179.337 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 17' ' ' ASN . 27.8 m -108.27 134.22 51.4 Favored 'General case' 0 C--N 1.308 -1.207 1 N-CA-C 98.925 -4.472 . . . . 0.0 98.925 179.798 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.4 ' HA ' ' HA ' ' A' ' 16' ' ' SER . 49.1 p-10 -104.5 65.25 0.77 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 118.877 -2.389 . . . . 0.0 113.32 0.49 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.8 tp -99.82 -50.93 3.87 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-N 113.485 -1.689 . . . . 0.0 107.34 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -36.64 -61.13 0.55 Allowed 'General case' 0 N--CA 1.507 2.392 0 O-C-N 124.082 0.863 . . . . 0.0 110.649 179.454 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.8 t -47.93 -49.72 29.21 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 113.833 -1.53 . . . . 0.0 111.539 179.767 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.454 ' ND1' ' HD2' ' A' ' 25' ' ' LYS . 74.6 t60 -48.88 -71.66 0.06 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 124.033 0.833 . . . . 0.0 110.788 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 51.3 mt -43.46 -48.47 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 124.362 1.039 . . . . 0.0 112.339 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -56.96 -55.98 27.66 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 92.8 m -79.59 -32.59 41.96 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 119.642 3.201 . . . . 0.0 119.642 -179.256 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.454 ' HD2' ' ND1' ' A' ' 21' ' ' HIS . 53.4 mttp -96.84 -11.71 24.49 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -179.312 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -129.44 -59.86 1.07 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.505 2.323 0 O-C-N 123.903 0.752 . . . . 0.0 111.21 -179.845 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 . . . . . 0 N--CA 1.495 1.804 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -129.41 166.92 18.61 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.96 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 39.8 t -83.85 161.18 20.99 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -122.95 32.98 5.53 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 123.771 0.669 . . . . 0.0 110.575 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -137.21 -42.24 0.57 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.997 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.8 p -110.77 -59.52 1.95 Allowed 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 160.74 -46.85 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.327 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -27.5 148.33 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 O-C-N 125.634 1.834 . . . . 0.0 115.123 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.6 ttm-85 -109.99 153.82 24.02 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.767 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.7 p -124.55 -174.91 3.13 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 179.949 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.684 ' H ' HD22 ' A' ' 17' ' ' ASN . . . -115.05 -61.81 1.69 Allowed 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 120.557 -0.457 . . . . 0.0 109.906 -179.973 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -125.48 177.12 6.37 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 124.368 1.042 . . . . 0.0 112.159 -179.838 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.6 t -94.99 46.62 1.13 Allowed 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 122.93 1.348 . . . . 0.0 110.629 -179.689 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.407 ' H ' ' H ' ' A' ' 17' ' ' ASN . 92.0 p -128.53 -28.38 2.52 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 112.672 -2.058 . . . . 0.0 105.979 179.572 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.684 HD22 ' H ' ' A' ' 13' ' ' ALA . 5.9 p-10 -107.09 -49.43 3.28 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 113.042 -1.89 . . . . 0.0 110.894 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 62.1 tp -40.82 -45.11 2.4 Favored 'General case' 0 N--CA 1.509 2.485 0 CA-C-N 117.977 0.353 . . . . 0.0 111.25 179.778 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -49.71 -60.79 2.56 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.949 179.624 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.5 t -50.47 -43.14 55.28 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 124.219 0.949 . . . . 0.0 111.286 -179.723 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -55.45 -64.14 0.94 Allowed 'General case' 0 N--CA 1.5 2.073 0 O-C-N 124.25 0.969 . . . . 0.0 109.273 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -49.41 -63.43 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.002 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -38.91 -33.15 0.1 Allowed 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -179.932 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.1 m -97.1 -44.08 7.12 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 118.283 2.697 . . . . 0.0 118.283 -179.383 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -91.37 -12.97 33.33 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 115.286 1.588 . . . . 0.0 115.286 -179.366 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -127.2 -40.79 1.81 Allowed 'General case' 0 N--CA 1.496 1.87 0 O-C-N 123.733 0.645 . . . . 0.0 110.951 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 t . . . . . 0 N--CA 1.497 1.898 0 CA-C-N 114.15 -1.386 . . . . 0.0 108.002 -179.75 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 105.375 -2.083 . . . . 0.0 105.375 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.403 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 51.3 tt0 -122.81 173.66 7.62 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-N 111.196 -2.729 . . . . 0.0 106.286 179.763 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.548 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 51.1 t -97.43 156.93 16.26 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.631 -179.868 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -121.46 37.08 4.43 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 124.268 0.98 . . . . 0.0 109.355 -179.87 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -133.12 -50.4 0.88 Allowed 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.093 -1.412 . . . . 0.0 109.043 179.867 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 27.5 p -113.25 -51.77 2.8 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 124.509 1.131 . . . . 0.0 108.431 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 33.7 tt0 112.97 61.08 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.599 0 O-C-N 126.305 2.253 . . . . 0.0 110.79 179.799 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.548 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 8.2 tt -107.37 135.66 48.48 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 104.642 -2.355 . . . . 0.0 104.642 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.401 ' HA ' ' HA ' ' A' ' 4' ' ' GLN . 19.1 ttt180 -115.16 147.72 39.91 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-O 121.838 0.828 . . . . 0.0 111.301 -179.906 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 62.2 m -118.64 -48.35 2.49 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-N 112.859 -1.973 . . . . 0.0 106.201 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.415 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 108.77 -38.22 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.431 0 O-C-N 126.633 2.458 . . . . 0.0 109.089 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -122.12 -176.67 3.4 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.978 -179.847 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.47 161.57 18.4 Favored 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 -179.985 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 71.0 m -112.2 41.07 2.05 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 123.014 2.643 . . . . 0.0 107.88 0.019 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -72.04 -41.7 67.16 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 103.085 -2.931 . . . . 0.0 103.085 179.743 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.4 tp -57.08 -51.89 67.48 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.434 179.527 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -45.38 -58.52 3.27 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 179.708 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.6 m -48.35 -56.86 7.01 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.213 179.57 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -45.31 -67.5 0.28 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.828 0.705 . . . . 0.0 109.701 179.642 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.8 mm -37.92 -57.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 124.622 1.201 . . . . 0.0 112.775 179.835 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -58.16 -40.27 80.97 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 63.9 p -88.41 -32.13 18.49 Favored 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -179.592 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -92.77 -24.74 18.46 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 123.73 0.644 . . . . 0.0 110.895 -179.943 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -127.55 29.77 5.45 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 123.892 0.745 . . . . 0.0 111.881 179.979 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.8 t . . . . . 0 N--CA 1.504 2.27 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 179.372 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.426 ' CE2' ' HA ' ' A' ' 15' ' ' SER . 7.2 m-85 . . . . . 0 N--CA 1.492 1.632 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.497 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 11.7 tt0 -113.61 -170.68 1.74 Allowed 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 103.853 -2.647 . . . . 0.0 103.853 179.579 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.497 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 50.1 t -107.04 158.35 17.12 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -122.9 36.09 4.73 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 179.807 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.422 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 86.3 m-85 -137.94 -54.78 0.66 Allowed 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 113.961 -1.472 . . . . 0.0 108.779 179.966 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.3 p -117.6 -129.38 0.29 Allowed 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 102.302 -3.222 . . . . 0.0 102.302 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -147.64 52.2 1.05 Allowed 'General case' 0 N--CA 1.501 2.089 0 O-C-N 123.692 0.62 . . . . 0.0 111.967 -179.696 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.9 tt -107.62 148.87 28.76 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.23 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -107.04 145.27 32.56 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 124.585 1.178 . . . . 0.0 108.005 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.407 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 58.3 m -114.9 -43.51 3.11 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.754 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.407 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 110.15 -60.76 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.291 0 O-C-N 126.55 2.406 . . . . 0.0 105.621 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -135.9 162.47 32.75 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.859 1.35 . . . . 0.0 110.283 179.623 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.426 ' HA ' ' CE2' ' A' ' 3' ' ' TYR . 1.9 t -37.01 -52.7 0.97 Allowed 'General case' 0 N--CA 1.505 2.32 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.049 179.588 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.7 t -27.86 -41.42 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 CA-C-N 112.91 -1.95 . . . . 0.0 116.187 179.813 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -105.04 -37.66 6.86 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 123.693 0.62 . . . . 0.0 111.077 -179.564 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 tp -48.5 -27.29 2.61 Favored 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.478 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 10.2 mtpm? -106.46 124.73 50.04 Favored 'General case' 0 C--N 1.308 -1.207 1 N-CA-C 96.08 -5.526 . . . . 0.0 96.08 178.814 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 19.2 p -97.38 26.83 4.58 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 119.256 -2.152 . . . . 0.0 114.605 0.678 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.412 ' ND1' ' HD2' ' A' ' 25' ' ' LYS . 80.0 t60 -44.07 -61.15 1.57 Allowed 'General case' 0 N--CA 1.507 2.377 0 CA-C-N 119.647 1.112 . . . . 0.0 109.963 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.4 mt -56.03 -69.75 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.258 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.458 ' HB3' ' HB ' ' A' ' 20' ' ' THR . 40.5 ttmt -31.99 -48.51 0.16 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 179.783 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.4 m -95.13 -26.44 16.01 Favored 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 118.312 2.708 . . . . 0.0 118.312 -179.257 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.412 ' HD2' ' ND1' ' A' ' 21' ' ' HIS . 55.5 mttp -101.71 -10.69 19.76 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 -179.459 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.4 m-70 -129.05 -35.47 1.83 Allowed 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 115.549 1.685 . . . . 0.0 115.549 -179.952 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.1 t . . . . . 0 N--CA 1.501 2.083 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -179.453 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -113.28 178.77 4.17 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.475 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 42.0 t -106.94 159.07 16.55 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 120.072 -0.651 . . . . 0.0 112.127 -179.912 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -123.21 33.52 5.36 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.02 -1.445 . . . . 0.0 110.292 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -134.74 -49.12 0.76 Allowed 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.682 -1.144 . . . . 0.0 108.278 179.894 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.6 p -115.66 -63.12 1.5 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 124.331 1.019 . . . . 0.0 109.568 179.794 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 132.79 49.25 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.575 0 C-N-CA 127.345 2.258 . . . . 0.0 109.592 -179.941 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.475 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 6.5 tt -98.22 153.27 18.61 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 179.856 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.9 ttm105 -107.73 137.25 46.09 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.973 -1.467 . . . . 0.0 109.432 -179.66 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.42 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 29.1 t -116.81 -51.54 2.57 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-N 113.854 -1.521 . . . . 0.0 107.669 179.874 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 12' ' ' SER . . . 92.09 -32.94 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.321 0 O-C-N 126.296 2.247 . . . . 0.0 110.385 179.982 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -136.58 136.23 39.08 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 124.253 0.971 . . . . 0.0 110.379 -179.872 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 53.4 p -39.75 -50.3 2.34 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 124.05 0.844 . . . . 0.0 109.555 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.9 t -29.82 -41.38 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 O-C-N 125.627 1.829 . . . . 0.0 115.39 179.593 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -102.29 -40.81 6.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 123.787 0.68 . . . . 0.0 109.696 -179.643 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -46.31 -42.92 15.37 Favored 'General case' 0 N--CA 1.505 2.31 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 179.662 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -45.85 -68.65 0.18 Allowed 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.905 179.347 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.5 p -53.94 -45.98 71.42 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 113.531 -1.668 . . . . 0.0 111.145 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.468 ' CE1' HD13 ' A' ' 10' ' ' LEU . 74.0 t60 -46.47 -65.38 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.671 1.232 . . . . 0.0 112.054 -179.954 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.7 mt -49.9 -56.65 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 124.292 0.995 . . . . 0.0 111.963 -179.645 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -51.12 -48.59 61.71 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -179.806 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 m -82.17 -37.09 26.64 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 118.609 2.818 . . . . 0.0 118.609 -179.218 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -96.31 -15.28 22.01 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -179.65 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -126.4 15.53 7.71 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.686 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.1 m . . . . . 0 N--CA 1.51 2.571 0 N-CA-C 115.789 1.774 . . . . 0.0 115.789 179.602 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.433 ' CE1' ' HA ' ' A' ' 14' ' ' ASP . 6.6 m-85 . . . . . 0 N--CA 1.494 1.751 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -131.91 164.15 26.74 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 179.704 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.468 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 42.3 t -106.34 159.34 16.21 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 105.903 -1.888 . . . . 0.0 105.903 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.0 pm0 -122.82 35.03 4.98 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.887 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -132.36 -50.76 0.93 Allowed 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.81 -1.541 . . . . 0.0 108.676 179.9 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.5 p -112.69 -42.13 3.68 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.215 0.947 . . . . 0.0 109.282 179.849 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 97.19 54.07 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.138 0 O-C-N 126.265 2.228 . . . . 0.0 109.956 179.809 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.468 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 5.5 tt -104.23 148.32 26.47 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 103.434 -2.802 . . . . 0.0 103.434 179.652 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.453 ' HD2' ' C ' ' A' ' 10' ' ' LEU . 5.4 mpt_? -108.69 141.89 39.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 124.362 1.039 . . . . 0.0 110.69 -179.501 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.5 m -124.13 -166.47 1.5 Allowed 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 113.305 -1.77 . . . . 0.0 108.75 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -104.89 -42.82 5.24 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.753 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.613 ' H ' HD21 ' A' ' 17' ' ' ASN . 34.5 t70 -129.92 -165.54 1.55 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 123.94 0.775 . . . . 0.0 109.698 -179.803 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.496 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 45.5 t -93.01 -42.55 9.37 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 179.735 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.8 m -47.3 -43.69 22.77 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-O 121.944 0.878 . . . . 0.0 110.802 179.861 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.613 HD21 ' H ' ' A' ' 14' ' ' ASP . 16.8 p30 -83.53 -24.48 31.63 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.623 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.401 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 27.4 tp -67.79 -46.55 71.64 Favored 'General case' 0 N--CA 1.506 2.37 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -51.28 -52.45 44.95 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.0 m -57.36 -53.21 60.75 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.882 179.549 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 26.7 t60 -40.44 -59.59 1.29 Allowed 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.348 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -51.69 -60.47 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.96 179.633 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -34.89 -50.13 0.47 Allowed 'General case' 0 N--CA 1.503 2.206 0 O-C-N 124.539 1.15 . . . . 0.0 113.038 179.555 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.3 m -114.64 45.89 1.49 Allowed 'General case' 0 N--CA 1.501 2.12 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -179.751 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -156.09 -37.15 0.08 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 121.389 0.614 . . . . 0.0 110.406 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -119.65 -38.58 2.97 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-N 114.203 -1.362 . . . . 0.0 113.28 -179.252 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 p . . . . . 0 N--CA 1.496 1.843 0 O-C-N 124.275 0.985 . . . . 0.0 112.618 -179.596 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.467 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 1.0 OUTLIER . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 105.569 -2.011 . . . . 0.0 105.569 . . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -126.53 165.87 18.33 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 179.588 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.443 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 44.8 t -94.49 -66.19 0.93 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.96 -179.945 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 28.2 tt0 90.92 -10.5 0.28 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 125.13 1.519 . . . . 0.0 111.53 179.885 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -91.7 -47.51 7.33 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.733 -179.769 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.2 p -111.45 -24.26 10.27 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.925 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 94.16 53.61 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 126.775 2.03 . . . . 0.0 111.084 179.446 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.449 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 11.5 tp -107.64 162.34 14.06 Favored 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 114.122 -1.399 . . . . 0.0 107.482 179.79 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.449 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 15.3 ttt85 -125.27 157.94 35.35 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 179.452 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.9 m -122.54 176.02 6.15 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.411 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.25 -47.59 2.93 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 124.676 1.235 . . . . 0.0 110.018 -179.903 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -123.45 162.59 22.53 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 123.761 0.663 . . . . 0.0 110.192 -179.974 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.6 p -50.42 -47.64 56.55 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-O 121.837 0.827 . . . . 0.0 108.92 179.584 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.5 m -56.63 -55.16 37.45 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.4 -1.727 . . . . 0.0 108.192 -179.989 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -40.69 -54.23 2.64 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.873 179.727 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -64.04 -57.17 10.45 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.831 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp -39.92 -54.7 2.14 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 124.201 0.938 . . . . 0.0 110.932 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.2 p -60.44 -54.43 45.64 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.065 -179.99 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 44.6 t60 -42.98 -59.17 2.11 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 119.611 -0.835 . . . . 0.0 109.536 179.802 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.38 -69.71 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 124.277 0.985 . . . . 0.0 109.756 179.522 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mmtm -41.51 -34.17 0.53 Allowed 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 -179.762 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.0 m -91.46 -41.46 10.83 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 118.658 2.836 . . . . 0.0 118.658 -179.549 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -103.56 -4.9 23.3 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -132.76 -40.92 0.95 Allowed 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -179.944 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 81.7 p . . . . . 0 N--CA 1.504 2.245 0 O-C-N 125.187 1.554 . . . . 0.0 107.191 -179.198 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.518 ' CE1' ' HB2' ' A' ' 15' ' ' SER . 82.9 m-85 . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -111.94 163.77 13.87 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 104.284 -2.487 . . . . 0.0 104.284 -179.962 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.6 t -103.21 153.79 20.0 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.817 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -119.79 35.81 4.72 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 122.131 0.967 . . . . 0.0 109.278 -179.812 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -131.52 -52.25 1.01 Allowed 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 113.772 -1.558 . . . . 0.0 107.676 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.7 p -119.86 -116.82 0.32 Allowed 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 103.538 -2.764 . . . . 0.0 103.538 179.717 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -161.94 58.8 0.25 Allowed 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.395 0.617 . . . . 0.0 109.81 179.74 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.1 tt -107.28 115.25 29.84 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 179.816 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -116.31 137.04 52.48 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.587 -179.834 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.5 p -128.38 -174.84 3.33 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-N 112.486 -2.143 . . . . 0.0 109.0 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.07 -23.88 8.82 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.52 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -115.12 174.76 5.82 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.364 1.04 . . . . 0.0 110.687 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.518 ' HB2' ' CE1' ' A' ' 3' ' ' TYR . 22.2 t -115.23 52.45 0.87 Allowed 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 p -110.72 -45.17 3.53 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 112.999 -1.91 . . . . 0.0 110.432 -179.698 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -106.44 -14.65 15.02 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 125.383 1.677 . . . . 0.0 113.085 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -74.13 -53.7 9.35 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.676 -179.875 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -47.85 -48.31 31.08 Favored 'General case' 0 N--CA 1.5 2.067 0 CA-C-O 121.196 0.522 . . . . 0.0 109.795 179.669 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.3 p -65.6 -52.4 52.37 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.263 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -36.3 -64.55 0.32 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 123.954 0.784 . . . . 0.0 110.354 179.58 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.6 mt -51.52 -61.01 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 123.751 0.657 . . . . 0.0 111.152 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -38.18 -43.31 0.75 Allowed 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.9 p -98.63 -38.7 9.02 Favored 'General case' 0 N--CA 1.508 2.455 0 N-CA-C 120.008 3.336 . . . . 0.0 120.008 -179.407 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -79.1 -26.27 42.96 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -179.235 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -116.04 -59.31 2.0 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.7 t . . . . . 0 N--CA 1.507 2.414 0 O-C-N 125.124 1.515 . . . . 0.0 111.7 179.797 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.9 pttp . . . . . 0 N--CA 1.492 1.652 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.9 t -130.68 -178.49 4.81 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 121.964 0.887 . . . . 0.0 108.754 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.474 ' CD1' ' HA ' ' A' ' 14' ' ' ASP . 2.4 m-85 -114.95 134.94 54.75 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 105.149 -2.167 . . . . 0.0 105.149 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -108.57 175.46 5.46 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 124.736 1.273 . . . . 0.0 109.255 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.2 t -89.92 172.73 8.66 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -118.66 13.97 13.43 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 123.862 0.726 . . . . 0.0 111.032 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -129.87 -47.92 1.13 Allowed 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.511 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.1 p -112.78 -116.47 0.32 Allowed 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -164.08 42.76 0.1 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -106.68 131.63 53.59 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.586 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.427 ' C ' ' HD3' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -114.06 168.81 9.5 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.695 179.954 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.6 t -129.15 -83.84 0.56 Allowed 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -164.88 -66.99 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 103.07 -2.937 . . . . 0.0 103.07 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.474 ' HA ' ' CD1' ' A' ' 3' ' ' TYR . 2.4 m-20 -134.44 162.28 32.67 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 124.782 1.301 . . . . 0.0 110.961 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.3 p -36.67 -53.09 0.9 Allowed 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.813 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.6 p -15.39 -50.51 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 126.329 2.268 . . . . 0.0 116.905 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -106.28 -45.39 4.3 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 114.658 -1.156 . . . . 0.0 110.397 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.6 tt -40.78 -45.1 2.37 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.17 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -43.12 -49.69 6.29 Favored 'General case' 0 N--CA 1.507 2.408 0 CA-C-O 121.455 0.645 . . . . 0.0 111.172 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.8 m -57.15 -55.86 29.28 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.436 -1.256 . . . . 0.0 109.741 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -37.68 -61.37 0.63 Allowed 'General case' 0 N--CA 1.507 2.407 0 O-C-N 124.649 1.218 . . . . 0.0 109.454 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.0 mt -47.34 -69.13 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.2 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -40.42 -39.17 0.94 Allowed 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.2 p -92.21 -36.55 13.2 Favored 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 118.692 2.849 . . . . 0.0 118.692 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.44 ' N ' ' HD2' ' A' ' 25' ' ' LYS . 13.8 mptt -95.07 -13.86 24.78 Favored 'General case' 0 N--CA 1.508 2.427 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.9 m-70 -122.02 -33.35 3.55 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.55 0.531 . . . . 0.0 109.829 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 79.1 p 40.25 75.29 0.08 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 124.871 1.357 . . . . 0.0 113.177 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp 8.12 -87.34 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.308 0 CA-C-N 112.361 -2.2 . . . . 0.0 115.52 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -134.46 47.12 2.42 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.27 1.033 . . . . 0.0 108.37 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.5 mttm . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 179.973 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.2 m -119.88 164.76 15.54 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-O 121.593 0.711 . . . . 0.0 109.656 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -131.98 145.65 51.6 Favored 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 113.926 -1.488 . . . . 0.0 108.152 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -137.8 165.65 25.93 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 44.6 t -82.18 161.13 22.88 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -119.76 28.7 7.97 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.151 0.907 . . . . 0.0 109.256 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -132.62 -55.12 0.95 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.005 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.7 p -111.72 -113.72 0.32 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.72 43.64 0.38 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.3 tt -90.62 148.91 22.35 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 11' ' ' ARG . 1.1 ptp85 -124.08 143.59 50.37 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 124.712 1.258 . . . . 0.0 111.099 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -140.52 168.43 19.81 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.423 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.16 2.75 11.43 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -125.51 -173.2 2.77 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.614 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.8 p -107.45 -49.69 3.21 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.5 p -42.21 -62.15 1.01 Allowed 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 121.922 0.868 . . . . 0.0 111.202 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -45.28 -48.94 12.95 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 113.728 -1.578 . . . . 0.0 111.223 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.432 HD13 HD13 ' A' ' 22' ' ' ILE . 3.4 tm? -62.25 -59.56 4.85 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.123 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -40.28 -53.69 2.5 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 124.234 0.959 . . . . 0.0 111.457 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.2 p -64.22 -51.02 65.71 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.445 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -37.78 -57.7 0.97 Allowed 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.433 ' N ' HD12 ' A' ' 22' ' ' ILE . 2.4 mp -57.67 -62.65 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 124.764 1.29 . . . . 0.0 111.859 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 tttt -42.74 -37.57 1.8 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.5 m -83.19 -58.74 2.72 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 118.484 2.772 . . . . 0.0 118.484 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -87.48 -4.58 59.0 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 116.956 2.206 . . . . 0.0 116.956 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -125.76 -33.91 2.68 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.3 m -109.37 -17.63 13.75 Favored 'General case' 0 N--CA 1.504 2.246 0 N-CA-C 118.67 2.841 . . . . 0.0 118.67 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -114.07 -49.63 2.85 Favored 'General case' 0 N--CA 1.507 2.396 0 N-CA-C 116.01 1.856 . . . . 0.0 116.01 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -85.25 75.15 10.32 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 123.152 1.453 . . . . 0.0 108.822 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? . . . . . 0 N--CA 1.492 1.666 0 CA-C-N 111.407 -2.633 . . . . 0.0 109.187 179.9 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.4 t -117.38 -166.04 1.14 Allowed 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.461 ' CE2' ' HB2' ' A' ' 15' ' ' SER . 36.7 m-85 -120.41 118.21 29.72 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.219 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -114.07 154.88 26.97 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.8 t -72.43 -49.39 33.87 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 118.38 2.733 . . . . 0.0 118.38 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 72.93 17.12 4.31 Favored 'General case' 0 N--CA 1.509 2.488 0 C-N-CA 124.328 1.051 . . . . 0.0 112.456 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.479 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 24.4 m-85 -121.38 -50.36 2.12 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.418 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 24.3 p -111.56 -50.2 2.94 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.418 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 45.9 tp10 118.68 66.8 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 126.92 2.637 . . . . 0.0 110.108 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 14.5 tp -106.04 157.63 17.39 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.5 ttt85 -118.49 120.01 36.25 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.8 1.313 . . . . 0.0 108.535 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -122.53 149.58 43.73 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 122.845 1.307 . . . . 0.0 111.364 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -135.09 83.93 2.06 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 101.46 -3.533 . . . . 0.0 101.46 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.457 ' HB2' ' CD1' ' A' ' 3' ' ' TYR . 1.9 p30 -137.24 -153.61 0.5 Allowed 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 126.739 2.016 . . . . 0.0 106.973 0.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.461 ' HB2' ' CE2' ' A' ' 3' ' ' TYR . 43.7 t -26.02 -55.92 0.07 Allowed 'General case' 0 N--CA 1.503 2.211 0 O-C-N 124.23 0.957 . . . . 0.0 112.303 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.5 m -33.37 -38.81 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 CA-C-N 113.005 -1.907 . . . . 0.0 115.841 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 68.7 m-20 -95.11 -50.78 4.92 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.817 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.412 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 2.8 tt -40.46 -46.38 2.42 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 123.853 0.721 . . . . 0.0 110.722 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -44.45 -56.17 4.48 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.118 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.0 p -66.3 -42.36 88.42 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 28.1 t60 -44.61 -61.39 1.58 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.77 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.3 mt -50.25 -61.8 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 O-C-N 124.604 1.19 . . . . 0.0 109.399 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -31.0 -52.23 0.18 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 125.468 1.73 . . . . 0.0 114.178 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.8 t -112.7 36.19 3.55 Favored 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -142.21 -35.38 0.43 Allowed 'General case' 0 N--CA 1.503 2.225 0 CA-C-O 121.411 0.625 . . . . 0.0 109.876 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -119.64 -64.39 1.27 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 113.857 -1.519 . . . . 0.0 107.144 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.5 m 78.47 -59.33 0.42 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 125.673 1.858 . . . . 0.0 113.449 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -130.79 -62.58 0.9 Allowed 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 113.183 -1.826 . . . . 0.0 114.25 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 28.32 69.69 0.07 Allowed 'General case' 0 N--CA 1.501 2.108 0 O-C-N 125.459 1.725 . . . . 0.0 115.494 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.9 mtmm . . . . . 0 N--CA 1.501 2.089 0 CA-C-N 113.855 -1.52 . . . . 0.0 109.978 179.893 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.447 ' N ' ' HD2' ' A' ' 1' ' ' LYS . 3.8 mptp? . . . . . 0 N--CA 1.495 1.807 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.593 ' H ' ' NH2' ' A' ' 11' ' ' ARG . 2.0 m -112.58 -163.65 0.87 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -100.86 146.21 27.61 Favored 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 119.763 -0.775 . . . . 0.0 111.961 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 32.2 tt0 -116.25 153.89 31.1 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 105.031 -2.211 . . . . 0.0 105.031 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.432 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 53.9 t -74.65 159.77 31.68 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.028 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -120.76 37.05 4.4 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.432 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 54.2 m-85 -137.5 -50.45 0.62 Allowed 'General case' 0 N--CA 1.496 1.872 0 CA-C-N 113.506 -1.679 . . . . 0.0 108.403 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -118.88 -124.35 0.28 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 103.942 -2.614 . . . . 0.0 103.942 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -157.06 48.95 0.44 Allowed 'General case' 0 N--CA 1.499 2.009 0 CA-C-O 121.483 0.659 . . . . 0.0 112.643 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.0 tt -109.23 160.33 16.2 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.711 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.593 ' NH2' ' H ' ' A' ' 2' ' ' THR . 23.2 mtp180 -117.4 145.51 44.05 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 123.844 0.715 . . . . 0.0 109.17 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.6 m -130.93 146.18 52.26 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 114.781 -1.099 . . . . 0.0 112.064 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -127.6 91.96 3.4 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 125.137 1.523 . . . . 0.0 107.934 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -122.42 -97.32 0.45 Allowed 'General case' 0 N--CA 1.501 2.113 0 CA-C-N 121.636 2.017 . . . . 0.0 110.067 0.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.575 ' N ' ' HB3' ' A' ' 16' ' ' SER . 79.7 p -144.37 63.99 1.31 Allowed 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.575 ' HB3' ' N ' ' A' ' 15' ' ' SER . 4.6 t 50.21 -155.31 0.12 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 117.224 -3.422 . . . . 0.0 112.848 0.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.1 m-20 -25.43 -30.15 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 118.592 2.812 . . . . 0.0 118.592 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -84.58 -59.91 2.22 Favored 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.434 ' C ' ' HD3' ' A' ' 19' ' ' LYS . 8.0 tmtm? -46.37 -48.96 18.47 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.4 p -63.39 -51.85 64.1 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 113.093 -1.867 . . . . 0.0 109.959 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -41.05 -58.11 1.84 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 76.0 mt -52.02 -63.21 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 124.356 1.035 . . . . 0.0 108.822 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -31.7 -42.0 0.05 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 125.201 1.563 . . . . 0.0 113.853 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.541 ' HA ' ' H ' ' A' ' 29' ' ' GLU . 65.9 p -101.55 -42.82 6.1 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.24 -21.29 42.96 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -120.36 -37.17 3.08 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 123.704 0.627 . . . . 0.0 111.422 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.9 t -109.24 54.81 0.65 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 123.912 0.758 . . . . 0.0 111.464 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.6 tptm 7.0 74.74 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.651 0 O-C-N 124.912 1.382 . . . . 0.0 114.465 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.541 ' H ' ' HA ' ' A' ' 24' ' ' THR . 38.9 tt0 10.31 60.38 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 CA-C-N 112.904 -1.953 . . . . 0.0 115.654 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 85.7 tttt . . . . . 0 N--CA 1.502 2.161 0 CA-C-O 124.328 2.013 . . . . 0.0 111.114 179.741 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.437 ' HA ' ' HE2' ' A' ' 1' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 67.3 p -111.04 160.63 16.67 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 15' ' ' SER . 4.4 m-85 -128.74 151.86 49.08 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.975 -2.602 . . . . 0.0 103.975 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -132.15 160.43 36.07 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 119.401 -0.919 . . . . 0.0 113.283 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.433 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.5 t -102.44 149.96 23.85 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 114.029 -1.442 . . . . 0.0 108.676 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -120.93 41.78 3.21 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 124.209 0.943 . . . . 0.0 108.798 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.433 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 71.8 m-85 -131.66 -42.56 1.03 Allowed 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 113.55 -1.659 . . . . 0.0 109.944 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.7 p -116.07 -49.92 2.68 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 124.227 0.954 . . . . 0.0 111.7 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 144.39 -40.5 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.661 0 O-C-N 125.608 1.817 . . . . 0.0 109.612 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.5 tt -24.9 143.94 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 116.592 2.071 . . . . 0.0 116.592 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.7 ttt85 -124.35 145.89 49.16 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 113.469 -1.696 . . . . 0.0 106.987 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.6 p -124.87 164.43 20.07 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.81 0.94 20.63 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 123.836 0.71 . . . . 0.0 111.349 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -137.24 177.08 8.14 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 124.006 0.816 . . . . 0.0 110.355 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.487 ' HB2' ' CZ ' ' A' ' 3' ' ' TYR . 27.1 t -115.32 40.21 2.75 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.3 t -120.21 -49.87 2.27 Favored 'General case' 0 N--CA 1.496 1.825 0 CA-C-N 114.433 -1.258 . . . . 0.0 109.807 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -102.97 32.6 3.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.267 0.979 . . . . 0.0 110.905 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.469 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 2.7 tm? -109.21 -61.65 1.59 Allowed 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -46.29 -56.75 5.33 Favored 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 62.3 p -56.5 -45.14 81.16 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 112.767 -2.015 . . . . 0.0 110.407 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.469 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 82.4 t60 -43.77 -70.09 0.12 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 124.226 0.954 . . . . 0.0 110.796 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mp -47.5 -64.98 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.051 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -35.5 -52.37 0.65 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 68.0 p -114.99 26.94 9.76 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 116.694 2.109 . . . . 0.0 116.694 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.461 ' HA ' ' HE2' ' A' ' 25' ' ' LYS . 10.4 mmpt? -128.98 -32.77 2.04 Favored 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.7 m-70 -109.26 -27.76 9.37 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 124.168 0.917 . . . . 0.0 112.49 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 m -89.58 45.96 1.33 Allowed 'General case' 0 N--CA 1.501 2.124 0 C-N-CA 118.685 -1.206 . . . . 0.0 108.958 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -126.83 142.16 51.62 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.408 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -124.42 46.74 2.23 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm . . . . . 0 N--CA 1.497 1.894 0 CA-C-N 113.653 -1.612 . . . . 0.0 109.616 -179.964 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 120.992 0.425 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.466 HG22 ' H ' ' A' ' 3' ' ' TYR . 96.5 m -114.59 177.01 4.8 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.466 ' H ' HG22 ' A' ' 2' ' ' THR . 24.4 m-85 -105.32 84.3 2.08 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.195 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -122.17 155.02 36.66 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.88 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.39 166.53 8.11 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.221 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -123.87 23.5 8.62 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.696 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.507 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 91.0 m-85 -139.57 -49.62 0.49 Allowed 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 115.721 1.749 . . . . 0.0 115.721 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.407 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 28.7 p -107.18 -64.36 1.2 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 118.218 -0.896 . . . . 0.0 112.889 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.407 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 14.3 pt-20 143.72 52.39 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.535 0 O-C-N 125.503 1.752 . . . . 0.0 110.927 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.7 tt -104.45 154.56 19.72 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.7 ptt85 -117.02 146.13 43.25 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 64.6 m -131.81 179.2 6.21 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 113.01 -1.904 . . . . 0.0 106.425 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -123.35 -38.17 2.59 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.953 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -125.33 165.34 18.53 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 124.25 0.969 . . . . 0.0 112.51 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 40.6 t -115.72 147.06 41.32 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 105.967 -1.864 . . . . 0.0 105.967 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 75.6 m -96.82 56.79 1.49 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 121.151 1.796 . . . . 0.0 112.15 0.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -98.39 12.97 33.24 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.0 -51.97 2.82 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 101.22 -3.622 . . . . 0.0 101.22 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -53.59 -46.23 70.27 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.9 m -43.33 -50.84 6.61 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 124.474 1.109 . . . . 0.0 110.598 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 54.2 t60 -58.69 -63.2 1.37 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.529 1.143 . . . . 0.0 108.968 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.5 mt -41.62 -61.96 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 O-C-N 125.053 1.471 . . . . 0.0 111.119 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 28' ' ' LYS . 25.2 tptp -37.54 -63.83 0.43 Allowed 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.709 -1.587 . . . . 0.0 112.881 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.8 m -66.08 -45.26 81.89 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 120.873 3.657 . . . . 0.0 120.873 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -94.69 -7.53 40.44 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.507 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 68.9 m-70 -126.75 -37.1 2.17 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 77.8 p -122.64 43.48 2.9 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 23' ' ' LYS . 11.0 tmtt? -141.12 -57.13 0.5 Allowed 'General case' 0 N--CA 1.504 2.259 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -110.24 -41.76 4.32 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 113.502 -1.681 . . . . 0.0 112.578 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.7 tptt . . . . . 0 N--CA 1.506 2.329 0 N-CA-C 116.223 1.934 . . . . 0.0 116.223 -179.934 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 121.542 0.687 . . . . 0.0 109.889 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 78.1 m -131.62 172.43 12.26 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.625 -1.17 . . . . 0.0 109.057 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -122.51 145.58 48.19 Favored 'General case' 0 N--CA 1.499 1.993 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.301 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -135.22 161.25 35.91 Favored 'General case' 0 N--CA 1.501 2.082 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.476 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 52.9 t -99.85 141.99 31.92 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.217 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -118.45 44.45 2.25 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 124.56 1.163 . . . . 0.0 109.027 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.493 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 79.1 m-85 -129.27 -46.8 1.21 Allowed 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 113.173 -1.83 . . . . 0.0 106.707 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -118.04 -52.24 2.42 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 124.577 1.173 . . . . 0.0 111.015 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 147.82 -39.47 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.772 0 O-C-N 125.025 1.453 . . . . 0.0 112.248 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.6 tt -29.92 153.43 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 116.625 2.084 . . . . 0.0 116.625 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 62.7 mtt-85 -119.22 152.17 37.09 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.622 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.5 m -124.05 -162.87 1.1 Allowed 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 113.91 -1.496 . . . . 0.0 107.574 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.24 -63.71 1.3 Allowed 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -124.42 171.57 9.84 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 124.221 0.95 . . . . 0.0 109.455 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.1 t -47.72 -52.34 18.79 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.0 p -43.27 -50.89 6.46 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.901 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -68.68 -48.72 63.22 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.441 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.8 -50.07 14.46 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -49.74 -56.15 11.3 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 179.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.5 m -40.46 -55.58 2.24 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 124.863 1.352 . . . . 0.0 108.769 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -53.37 -68.18 0.2 Allowed 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 113.069 -1.878 . . . . 0.0 109.277 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.3 mm -39.48 -67.03 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 124.536 1.148 . . . . 0.0 110.922 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -36.6 -52.51 0.88 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 124.812 1.32 . . . . 0.0 114.344 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.6 p -108.79 37.76 2.45 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 116.083 1.882 . . . . 0.0 116.083 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -144.81 -36.62 0.31 Allowed 'General case' 0 N--CA 1.501 2.09 0 CA-C-O 121.262 0.553 . . . . 0.0 109.543 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -127.75 -61.17 1.13 Allowed 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.428 ' O ' ' CB ' ' A' ' 28' ' ' LYS . 87.4 p 119.93 -35.14 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.429 0 O-C-N 126.758 2.536 . . . . 0.0 110.166 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.428 ' CB ' ' O ' ' A' ' 27' ' ' SER . 5.0 ttmp? 104.99 63.21 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 100.77 -3.789 . . . . 0.0 100.77 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 28.08 56.35 0.09 Allowed 'General case' 0 N--CA 1.501 2.121 0 CA-C-N 113.895 -1.502 . . . . 0.0 113.925 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 93.3 mttt . . . . . 0 N--CA 1.511 2.576 0 C-N-CA 126.902 2.081 . . . . 0.0 109.486 179.834 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 121.867 0.841 . . . . 0.0 109.094 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 51.2 p -130.67 -178.1 4.64 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.863 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -114.45 135.11 54.46 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.7 tp60 -120.76 157.67 29.18 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.799 1.312 . . . . 0.0 108.257 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.9 t -99.89 149.31 23.53 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -119.15 43.64 2.54 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 122.19 0.995 . . . . 0.0 110.593 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -133.23 -52.06 0.89 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 112.994 -1.912 . . . . 0.0 105.868 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.9 p -119.51 -124.49 0.28 Allowed 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 102.149 -3.278 . . . . 0.0 102.149 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -147.61 56.21 1.09 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 123.993 0.808 . . . . 0.0 108.927 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.472 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 24.2 tp -105.29 139.19 40.31 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.033 -1.067 . . . . 0.0 111.61 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.472 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -134.92 146.44 49.16 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.583 -1.644 . . . . 0.0 111.569 179.392 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.2 t -142.03 171.96 13.35 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 112.875 -1.966 . . . . 0.0 108.449 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.17 -12.79 25.76 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -121.66 -173.69 2.7 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 124.26 0.975 . . . . 0.0 108.55 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.7 t -119.19 -38.46 3.04 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.8 p -31.66 -46.12 0.1 Allowed 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.3 p30 -84.54 -36.82 21.89 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 119.017 -1.073 . . . . 0.0 109.969 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 23.6 tp -49.21 -41.61 37.63 Favored 'General case' 0 N--CA 1.503 2.22 0 CA-C-O 121.505 0.669 . . . . 0.0 109.837 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.7 tmtp? -51.97 -53.65 38.91 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -61.29 -52.94 62.6 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.118 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.411 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 70.1 t60 -35.41 -59.18 0.55 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.145 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 71.2 mt -53.06 -57.96 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-O 121.494 0.664 . . . . 0.0 109.361 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.436 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 4.1 ttmp? -45.61 -41.86 10.61 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.689 -1.141 . . . . 0.0 113.094 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -87.68 -37.83 16.38 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 121.276 3.806 . . . . 0.0 121.276 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.3 mtpt -108.11 0.1 21.42 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 115.141 1.534 . . . . 0.0 115.141 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 47.3 m-70 -125.52 -40.25 2.1 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.3 p -92.58 -67.56 0.85 Allowed 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.543 -0.863 . . . . 0.0 111.286 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.65 -174.28 2.77 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -111.63 45.11 1.26 Allowed 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 106.287 -1.745 . . . . 0.0 106.287 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.4 tttp . . . . . 0 N--CA 1.499 1.99 0 CA-C-N 112.812 -1.995 . . . . 0.0 115.273 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 122.061 0.934 . . . . 0.0 111.44 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.1 m -116.0 163.84 15.31 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -124.74 104.06 8.44 Favored 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 113.737 -1.574 . . . . 0.0 107.816 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -112.88 114.95 27.69 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 124.011 0.819 . . . . 0.0 109.058 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 53.2 t -23.31 -70.48 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.46 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 64.1 tt0 109.62 -23.06 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.723 0 O-C-N 126.094 2.122 . . . . 0.0 110.305 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -99.5 -52.65 3.43 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.436 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 29.7 p -103.55 -49.45 3.69 Favored 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 34.4 tt0 119.12 64.02 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 126.695 2.497 . . . . 0.0 109.236 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.406 HD13 ' ND1' ' A' ' 21' ' ' HIS . 9.1 tt -106.51 137.64 44.14 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 103.461 -2.792 . . . . 0.0 103.461 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 24.9 ttp85 -115.0 134.49 55.14 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 122.27 1.033 . . . . 0.0 113.604 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 t -129.41 179.3 5.87 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 112.135 -2.302 . . . . 0.0 106.16 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -117.06 -21.41 8.88 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.086 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -141.33 -172.38 3.5 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 124.337 1.023 . . . . 0.0 108.774 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 16' ' ' SER . 30.7 t -105.75 171.71 7.19 Favored 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 15' ' ' SER . 25.1 t 101.02 -31.13 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.795 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -106.48 -16.15 14.61 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-N 113.071 -1.877 . . . . 0.0 109.61 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.41 -55.13 2.46 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 104.503 -2.406 . . . . 0.0 104.503 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HG3' ' HE2' ' A' ' 23' ' ' LYS . 1.1 tppp? -50.7 -53.04 34.57 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 56.5 m -60.84 -50.35 73.8 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 114.31 -1.314 . . . . 0.0 108.44 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.406 ' ND1' HD13 ' A' ' 10' ' ' LEU . 39.2 t60 -40.6 -59.15 1.43 Allowed 'General case' 0 N--CA 1.503 2.206 0 O-C-N 124.091 0.87 . . . . 0.0 108.768 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.3 mt -54.15 -59.58 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 123.782 0.676 . . . . 0.0 109.786 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.406 ' HE2' ' HG3' ' A' ' 19' ' ' LYS . 22.1 mtmt -44.46 -28.97 0.63 Allowed 'General case' 0 N--CA 1.503 2.2 0 N-CA-C 114.779 1.399 . . . . 0.0 114.779 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.1 m -101.92 -40.91 6.68 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 118.138 2.644 . . . . 0.0 118.138 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -89.95 -14.93 33.06 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.9 m-70 -127.37 -46.55 1.47 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.0 t -107.06 54.9 0.66 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.423 1.077 . . . . 0.0 108.434 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -31.05 170.22 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 117.508 2.411 . . . . 0.0 117.508 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -92.31 -42.67 9.69 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.551 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? . . . . . 0 N--CA 1.497 1.88 0 CA-C-O 122.339 1.066 . . . . 0.0 109.888 179.805 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 27.8 tptp . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.018 0.437 . . . . 0.0 109.848 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 28.2 m -121.45 169.64 10.44 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.592 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -117.81 136.75 53.21 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.418 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 69.4 tp60 -121.23 158.1 28.81 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.418 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 40.4 t -105.75 139.14 40.78 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 104.772 -2.307 . . . . 0.0 104.772 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -113.58 47.12 1.19 Allowed 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 122.701 1.238 . . . . 0.0 109.747 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 67.0 m-85 -136.08 -55.64 0.76 Allowed 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 112.263 -2.244 . . . . 0.0 108.548 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -121.3 -117.22 0.31 Allowed 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.337 1.023 . . . . 0.0 110.189 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.2 mp0 -122.16 -49.73 2.05 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 tt -23.49 129.93 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 117.04 2.237 . . . . 0.0 117.04 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -131.77 145.56 51.66 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.5 m -128.56 173.9 9.85 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 123.869 0.73 . . . . 0.0 110.212 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.17 35.14 3.73 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -132.4 -62.92 0.81 Allowed 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.353 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.4 t 125.61 -58.4 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 104.274 -2.491 . . . . 0.0 104.274 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.6 m -44.97 -58.07 3.4 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 124.149 0.906 . . . . 0.0 110.378 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -46.91 -60.56 2.36 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 114.182 -1.372 . . . . 0.0 110.255 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.419 HD13 ' C ' ' A' ' 18' ' ' LEU . 3.0 tm? -50.99 -52.95 37.56 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.209 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -47.69 -55.95 8.36 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 121.093 0.473 . . . . 0.0 110.038 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.1 m -56.45 -47.37 79.28 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.059 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 37.4 t60 -50.4 -58.08 6.52 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 123.765 0.665 . . . . 0.0 109.654 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.6 mt -54.07 -60.34 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.48 -23.02 5.44 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 23.9 m -96.08 -45.16 7.0 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 117.725 2.491 . . . . 0.0 117.725 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -97.36 -7.25 32.33 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 56.6 m-70 -122.79 -48.09 2.04 Favored 'General case' 0 N--CA 1.501 2.11 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.077 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.2 t -111.54 48.18 0.97 Allowed 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -52.65 160.6 0.86 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 113.56 -1.654 . . . . 0.0 112.268 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -131.69 58.0 1.75 Allowed 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.7 ttmp? . . . . . 0 N--CA 1.498 1.965 0 CA-C-N 114.576 -1.193 . . . . 0.0 108.573 -179.904 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 83.3 tttt . . . . . 0 N--CA 1.489 1.478 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.5 p -102.06 167.97 9.69 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -123.32 148.67 45.74 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 113.867 -1.515 . . . . 0.0 107.115 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -123.6 164.06 19.78 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 51.0 t -93.79 155.24 17.32 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -114.37 32.08 6.17 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 124.003 0.814 . . . . 0.0 109.665 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -137.26 -53.91 0.69 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 114.746 -1.116 . . . . 0.0 111.141 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.7 p -114.62 -116.64 0.32 Allowed 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.44 52.37 0.53 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.558 0.694 . . . . 0.0 111.801 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.2 tt -105.65 140.42 38.74 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.6 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -122.97 152.18 41.13 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 124.412 1.07 . . . . 0.0 109.952 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.2 p -140.14 179.02 6.87 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.613 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -103.35 -43.92 5.3 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.021 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -109.68 -168.01 1.27 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 124.35 1.032 . . . . 0.0 110.339 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 p -97.51 -45.65 6.34 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.802 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.1 m -40.46 -52.07 2.81 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -80.23 1.92 26.51 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -107.29 -46.78 3.8 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.484 ' HG3' ' N ' ' A' ' 20' ' ' THR . 0.2 OUTLIER -55.84 -49.48 73.2 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.598 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.484 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 8.8 t -51.47 -40.98 60.55 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 123.645 0.591 . . . . 0.0 110.417 179.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.3 t60 -59.88 -66.24 0.55 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.8 mt -46.29 -53.55 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-O 121.256 0.551 . . . . 0.0 109.944 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -38.55 -48.28 1.4 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.936 -1.484 . . . . 0.0 114.058 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 44.9 p -110.07 -9.23 14.73 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -102.69 -22.54 13.93 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -127.82 -38.03 1.89 Allowed 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.424 ' O ' ' CB ' ' A' ' 28' ' ' LYS . 29.3 p -100.9 -70.37 0.74 Allowed 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 -179.375 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.43 ' HG2' ' N ' ' A' ' 29' ' ' GLU . 62.2 tttp 128.37 173.66 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.665 0 C-N-CA 127.675 2.39 . . . . 0.0 105.456 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.43 ' N ' ' HG2' ' A' ' 28' ' ' LYS . 35.5 tt0 -70.3 -49.76 46.28 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt . . . . . 0 N--CA 1.499 2.014 0 CA-C-O 122.312 1.054 . . . . 0.0 109.606 -179.97 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 49.7 mttm . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.4 m -116.81 171.45 7.89 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.4 m-30 -113.17 169.2 9.11 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.573 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 64.7 tp60 -125.7 170.35 11.62 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 114.646 -1.161 . . . . 0.0 108.816 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.573 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 32.5 t -104.52 -54.51 2.51 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.502 ' H ' HE21 ' A' ' 4' ' ' GLN . 40.4 tt0 80.63 16.3 0.64 Allowed 'General case' 0 N--CA 1.505 2.294 0 O-C-N 125.252 1.595 . . . . 0.0 109.793 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -126.78 -45.71 1.59 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 118.974 -0.536 . . . . 0.0 112.404 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 p -116.16 -117.59 0.32 Allowed 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -140.27 28.09 2.08 Favored 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.7 tt -109.25 155.13 21.48 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.62 157.06 39.91 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 105.553 -2.017 . . . . 0.0 105.553 179.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -126.34 168.2 14.47 Favored 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 120.661 -0.416 . . . . 0.0 109.968 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.58 -52.49 2.76 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 124.01 0.819 . . . . 0.0 110.387 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -109.36 155.04 21.7 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 122.049 0.928 . . . . 0.0 110.347 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.417 ' C ' ' HZ3' ' A' ' 19' ' ' LYS . 50.1 m -49.57 -56.42 10.0 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 113.141 -1.845 . . . . 0.0 110.802 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.4 t -45.95 -62.67 1.22 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 124.545 1.153 . . . . 0.0 110.025 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -43.2 -58.19 2.62 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 124.417 1.073 . . . . 0.0 111.701 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.403 ' C ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -52.88 -57.04 11.58 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.417 ' HZ3' ' C ' ' A' ' 15' ' ' SER . 38.3 mtmm -53.17 -49.3 66.93 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 119.819 -0.752 . . . . 0.0 109.829 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 67.1 m -53.39 -50.98 64.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 124.033 0.833 . . . . 0.0 109.029 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -51.02 -58.77 5.21 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.281 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.0 mt -57.39 -26.07 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.62 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.463 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.05 -48.23 25.02 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.749 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.9 p -85.33 -29.15 24.75 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -101.55 -22.29 14.53 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 123.762 0.664 . . . . 0.0 110.569 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -131.68 33.69 3.98 Favored 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 119.018 -1.073 . . . . 0.0 113.099 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.0 p -21.5 -61.66 0.03 OUTLIER 'General case' 0 N--CA 1.513 2.682 0 O-C-N 124.413 1.07 . . . . 0.0 113.634 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -117.21 175.88 5.4 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 26.63 56.19 0.06 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 124.278 0.986 . . . . 0.0 113.074 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 95.2 mttt . . . . . 0 N--CA 1.504 2.253 0 CA-C-N 112.227 -2.26 . . . . 0.0 116.56 -179.89 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 62.4 mttp . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 32.1 m -125.09 167.4 14.84 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 114.892 -1.049 . . . . 0.0 108.732 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -123.25 139.99 53.48 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.429 ' HG3' ' H ' ' A' ' 5' ' ' CYS . 2.1 tt0 -125.58 177.06 6.44 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.428 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.429 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 51.0 t -106.46 161.87 14.21 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.201 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -118.9 29.72 7.56 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 124.132 0.895 . . . . 0.0 108.895 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -137.19 -49.84 0.62 Allowed 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.063 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 9' ' ' GLU . 30.0 p -114.75 -48.78 2.83 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 124.093 0.871 . . . . 0.0 110.991 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 31.2 mm-40 129.56 -2.51 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.918 0 C-N-CA 127.054 2.142 . . . . 0.0 113.389 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -44.83 135.36 5.16 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 124.082 0.864 . . . . 0.0 109.314 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -124.03 144.55 49.77 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 124.396 1.06 . . . . 0.0 112.737 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.3 t -126.98 -176.01 3.59 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-N 112.649 -2.069 . . . . 0.0 107.926 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.5 -9.2 12.1 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.303 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -135.74 -177.0 4.48 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 124.478 1.111 . . . . 0.0 111.782 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.5 m -113.61 38.87 2.8 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.031 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.7 t -117.71 -54.49 2.35 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 104.945 -2.243 . . . . 0.0 104.945 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -75.42 -43.03 52.1 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 113.514 -1.675 . . . . 0.0 109.385 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.54 -53.28 60.14 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.165 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.461 ' C ' ' HD3' ' A' ' 19' ' ' LYS . 13.1 tmtt? -50.31 -60.29 3.13 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 120.191 -0.603 . . . . 0.0 109.576 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.4 p -52.36 -42.27 63.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 123.804 0.69 . . . . 0.0 112.436 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -49.69 -62.65 1.44 Allowed 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.33 179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.54 HD12 ' H ' ' A' ' 22' ' ' ILE . 2.9 mp -50.07 -59.62 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 O-C-N 123.737 0.648 . . . . 0.0 110.473 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -36.58 -51.82 0.85 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 23.1 m -85.37 -42.6 14.4 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 119.358 3.095 . . . . 0.0 119.358 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.59 -8.34 56.38 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.16 0.913 . . . . 0.0 112.867 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -150.18 70.65 1.04 Allowed 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 102.506 -3.146 . . . . 0.0 102.506 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.7 p -163.66 43.71 0.11 Allowed 'General case' 0 N--CA 1.501 2.075 0 O-C-N 118.702 -2.498 . . . . 0.0 109.757 0.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm 94.78 158.96 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.515 0 C-N-CA 125.498 1.519 . . . . 0.0 108.681 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.9 mp0 -130.81 -56.9 1.05 Allowed 'General case' 0 N--CA 1.496 1.852 0 O-C-N 124.087 0.867 . . . . 0.0 110.5 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.3 pttp . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 122.216 1.008 . . . . 0.0 110.565 -179.884 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.446 ' HA ' ' HE2' ' A' ' 1' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.409 HG22 ' H ' ' A' ' 3' ' ' TYR . 26.8 m 89.82 170.4 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.603 0 O-C-N 125.385 1.678 . . . . 0.0 108.75 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.409 ' H ' HG22 ' A' ' 2' ' ' THR . 2.9 m-85 -103.96 145.64 29.85 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.528 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 31.6 tt0 -121.75 173.97 7.13 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 124.995 1.434 . . . . 0.0 107.63 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.528 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 48.0 t -100.7 163.36 12.37 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.66 25.96 9.42 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 124.219 0.949 . . . . 0.0 109.676 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.482 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 63.2 m-85 -123.35 -53.83 1.8 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 107.243 -1.392 . . . . 0.0 107.243 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -118.04 -121.23 0.3 Allowed 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 104.116 -2.55 . . . . 0.0 104.116 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -159.42 51.28 0.35 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.541 0.686 . . . . 0.0 109.824 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.3 tt -106.48 158.51 16.86 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.938 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -118.95 161.75 19.67 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.193 0.997 . . . . 0.0 113.539 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.8 m -125.23 -158.81 0.85 Allowed 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 112.537 -2.119 . . . . 0.0 110.225 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.79 -55.0 2.54 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.8 p-10 -122.15 -43.95 2.3 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 116.121 1.896 . . . . 0.0 116.121 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.6 p 156.02 -49.49 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.8 p -47.09 -42.7 19.37 Favored 'General case' 0 N--CA 1.507 2.398 0 CA-C-O 121.51 0.672 . . . . 0.0 109.305 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -67.78 -47.52 68.95 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -46.13 -45.53 16.58 Favored 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 179.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -51.59 -59.65 4.03 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 124.314 1.009 . . . . 0.0 108.837 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.6 p -51.4 -46.27 62.8 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 124.111 0.882 . . . . 0.0 110.916 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -48.47 -66.69 0.36 Allowed 'General case' 0 N--CA 1.502 2.141 0 C-N-CA 119.811 -0.755 . . . . 0.0 109.02 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.1 mt -48.94 -55.74 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 124.264 0.978 . . . . 0.0 111.499 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -33.25 -57.72 0.4 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 125.193 1.558 . . . . 0.0 113.996 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 50.2 m -115.07 48.11 1.2 Allowed 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 122.233 1.016 . . . . 0.0 113.406 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -145.31 -39.1 0.25 Allowed 'General case' 0 N--CA 1.5 2.073 0 CA-C-N 114.664 -1.153 . . . . 0.0 109.539 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -121.36 -40.33 2.59 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 114.152 -1.385 . . . . 0.0 111.575 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 73.2 p -111.31 65.27 0.62 Allowed 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt 126.85 69.89 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.753 0 C-N-CA 127.766 2.427 . . . . 0.0 106.802 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -118.41 -39.6 3.01 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 112.41 -2.177 . . . . 0.0 107.537 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.507 2.392 0 O-C-N 125.893 1.996 . . . . 0.0 116.145 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 121.106 0.479 . . . . 0.0 109.933 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.6 p -107.87 159.14 16.75 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-O 121.426 0.632 . . . . 0.0 112.406 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -127.22 159.08 35.4 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 113.624 -1.625 . . . . 0.0 108.488 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.438 ' HG3' ' H ' ' A' ' 6' ' ' GLN . 4.1 tp-100 -124.28 156.22 37.29 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 124.425 1.078 . . . . 0.0 111.017 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 14.7 t -107.09 -17.87 14.05 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 114.435 -1.257 . . . . 0.0 113.819 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.438 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 9.7 pt20 40.89 30.39 0.09 Allowed 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 116.374 1.991 . . . . 0.0 116.374 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -135.43 -59.93 0.76 Allowed 'General case' 0 N--CA 1.504 2.259 0 N-CA-C 106.055 -1.831 . . . . 0.0 106.055 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.448 ' SG ' ' HB2' ' A' ' 10' ' ' LEU . 17.8 p -118.45 29.57 7.69 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 105.396 -2.076 . . . . 0.0 105.396 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 24.72 55.03 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 112.646 -2.07 . . . . 0.0 112.373 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.448 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 4.3 tp -90.96 146.42 23.89 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 104.132 -2.544 . . . . 0.0 104.132 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -114.35 149.32 36.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 124.325 1.016 . . . . 0.0 109.151 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.6 t -138.9 170.97 15.02 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.116 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.62 -4.59 10.28 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 125.137 1.523 . . . . 0.0 108.817 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -127.47 169.8 13.27 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.5 p -104.99 -45.79 4.45 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 124.206 0.942 . . . . 0.0 112.744 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.425 ' HA ' ' NZ ' ' A' ' 19' ' ' LYS . 22.7 t -50.39 -53.35 29.9 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 122.071 0.939 . . . . 0.0 112.528 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.0 p-10 -60.33 -30.17 69.34 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.38 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -72.15 -53.41 12.78 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 118.862 -0.589 . . . . 0.0 110.19 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.443 ' HG3' ' N ' ' A' ' 20' ' ' THR . 17.6 pttm -52.15 -48.12 65.09 Favored 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.21 -1.396 . . . . 0.0 109.73 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.443 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 41.1 p -62.29 -51.06 69.2 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.743 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.477 ' CE1' ' HD2' ' A' ' 25' ' ' LYS . 68.1 t60 -38.11 -59.51 0.85 Allowed 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.031 0.443 . . . . 0.0 110.192 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 86.0 mt -54.64 -59.65 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.654 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -40.67 -42.78 1.8 Allowed 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.5 t -101.35 -19.86 15.44 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 120.107 3.373 . . . . 0.0 120.107 -179.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.477 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 47.0 mttp -106.51 -14.62 15.01 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.472 ' O ' ' HA ' ' A' ' 30' ' ' LYS . 70.8 m-70 -122.75 -46.22 2.13 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 120.318 -0.553 . . . . 0.0 112.296 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.3 p -93.93 30.53 1.83 Allowed 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 118.146 -1.422 . . . . 0.0 108.178 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 29' ' ' GLU . 53.3 tptt -155.5 60.69 0.62 Allowed 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 31.0 tt0 129.83 -64.19 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.575 0 C-N-CA 126.178 1.791 . . . . 0.0 109.498 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.472 ' HA ' ' O ' ' A' ' 26' ' ' HIS . 0.1 OUTLIER . . . . . 0 N--CA 1.513 2.703 0 O-C-N 125.751 1.907 . . . . 0.0 106.403 -179.669 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.425 ' HD3' ' H ' ' A' ' 2' ' ' THR . 8.5 tmtt? . . . . . 0 N--CA 1.495 1.786 0 N-CA-C 105.58 -2.008 . . . . 0.0 105.58 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.425 ' H ' ' HD3' ' A' ' 1' ' ' LYS . 9.7 t -113.87 178.13 4.39 Favored 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 122.433 1.111 . . . . 0.0 113.005 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.406 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 4.9 m-85 -108.5 179.23 4.25 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-N 112.147 -2.297 . . . . 0.0 106.89 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -141.24 167.54 21.93 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 41.8 t -105.33 -68.61 0.85 Allowed 'General case' 0 N--CA 1.504 2.257 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.945 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.45 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 31.5 tp60 107.42 -27.09 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.572 0 O-C-N 125.816 1.947 . . . . 0.0 109.955 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -83.38 -46.02 13.03 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.768 0.668 . . . . 0.0 110.511 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -115.53 -40.85 3.33 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 109.42 49.03 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.176 0 O-C-N 126.887 2.617 . . . . 0.0 110.643 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.556 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 44.2 tp -98.39 158.97 15.25 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.556 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 55.7 mtt-85 -121.54 -176.91 3.41 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.297 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.442 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 24.0 t -141.24 -70.83 0.36 Allowed 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.738 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.442 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 108.49 -20.09 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.546 0 O-C-N 125.909 2.006 . . . . 0.0 109.047 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.459 ' O ' ' CB ' ' A' ' 15' ' ' SER . 3.6 p-10 -119.29 -45.42 2.54 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.459 ' CB ' ' O ' ' A' ' 14' ' ' ASP . 37.5 t 121.85 -51.02 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.878 0 C-N-CA 126.016 1.727 . . . . 0.0 109.596 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.1 t -47.85 -52.46 19.04 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.846 0.831 . . . . 0.0 111.922 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -64.71 2.71 0.63 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-N 112.714 -2.039 . . . . 0.0 114.379 -179.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -106.52 -52.03 2.85 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 103.533 -2.766 . . . . 0.0 103.533 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.4 mtmm -54.29 -54.45 40.09 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.294 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.5 t -62.99 -39.71 95.55 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 123.79 0.682 . . . . 0.0 109.259 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.429 ' CG ' HD23 ' A' ' 10' ' ' LEU . 13.8 t60 -51.01 -63.3 1.17 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 123.996 0.81 . . . . 0.0 109.219 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.6 mt -46.84 -59.83 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.452 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -49.48 -31.99 11.18 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -93.4 -41.1 10.01 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 118.067 2.617 . . . . 0.0 118.067 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -92.29 -15.24 27.68 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 -121.28 -43.48 2.42 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 123.444 0.465 . . . . 0.0 111.243 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.6 m -109.26 38.11 2.4 Favored 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 122.112 0.958 . . . . 0.0 109.116 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 23.1 ttpp -12.58 92.36 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 112.192 -2.276 . . . . 0.0 116.286 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.36 39.18 1.63 Allowed 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? . . . . . 0 N--CA 1.496 1.864 0 CA-C-N 114.43 -1.259 . . . . 0.0 109.647 -179.775 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 103.586 -2.746 . . . . 0.0 103.586 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.473 HG22 ' H ' ' A' ' 3' ' ' TYR . 1.4 m -128.28 -163.1 1.24 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 112.215 -2.266 . . . . 0.0 109.429 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.473 ' H ' HG22 ' A' ' 2' ' ' THR . 25.4 m-85 -109.81 82.12 1.54 Allowed 'General case' 0 N--CA 1.492 1.668 1 N-CA-C 99.966 -4.087 . . . . 0.0 99.966 179.577 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 24.2 tt0 -107.73 161.67 14.67 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.606 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.513 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 36.0 t -87.0 162.61 17.54 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 113.163 -1.835 . . . . 0.0 108.632 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -122.73 36.79 4.56 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 124.297 0.998 . . . . 0.0 110.582 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 52.1 m-85 -136.08 -49.48 0.68 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.708 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 9' ' ' GLU . 27.3 p -111.82 -63.62 1.4 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.765 1.291 . . . . 0.0 110.605 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.484 ' HB3' ' O ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER 135.55 41.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.532 0 O-C-N 126.004 2.065 . . . . 0.0 108.932 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.469 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 49.7 tp -83.4 157.03 22.65 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.523 HH11 ' H ' ' A' ' 13' ' ' ALA . 10.9 ttp85 -119.55 119.53 34.07 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 125.279 1.612 . . . . 0.0 107.696 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -132.88 77.1 1.72 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.523 ' H ' HH11 ' A' ' 11' ' ' ARG . . . -75.75 68.55 2.33 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 122.717 1.246 . . . . 0.0 112.658 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -139.19 -61.35 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.567 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p 127.3 -62.1 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.476 0 O-C-N 126.803 2.564 . . . . 0.0 109.865 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 m -57.59 -54.92 41.46 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 121.49 0.662 . . . . 0.0 109.364 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -42.52 -51.73 4.97 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.605 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -56.62 -54.69 43.07 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.034 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -43.47 -59.04 2.31 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 124.105 0.878 . . . . 0.0 111.718 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.8 t -60.56 -48.42 81.85 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 117.373 -1.299 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -40.31 -64.55 0.5 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.427 1.012 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.4 mt -43.66 -64.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 124.606 1.191 . . . . 0.0 113.956 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -58.72 -32.6 69.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.7 p -104.14 23.98 12.17 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.8 mmmm -142.02 -28.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.416 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 85.9 m-70 -119.29 -56.21 2.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 124.828 1.33 . . . . 0.0 108.651 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.7 m 81.58 -60.42 0.21 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 126.092 2.12 . . . . 0.0 107.948 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 30' ' ' LYS . 22.3 tptm -142.06 -41.57 0.35 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 113.711 -1.586 . . . . 0.0 111.39 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 26.43 -68.98 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.434 0 O-C-N 127.385 2.928 . . . . 0.0 115.123 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 28' ' ' LYS . 20.1 mtpp . . . . . 0 N--CA 1.499 2.013 0 CA-C-O 122.486 1.136 . . . . 0.0 108.595 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 103.586 -2.746 . . . . 0.0 103.586 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.473 HG22 ' H ' ' A' ' 3' ' ' TYR . 1.4 m -128.28 -163.1 1.24 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 112.215 -2.266 . . . . 0.0 109.429 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.473 ' H ' HG22 ' A' ' 2' ' ' THR . 25.4 m-85 -109.81 82.12 1.54 Allowed 'General case' 0 N--CA 1.492 1.668 1 N-CA-C 99.966 -4.087 . . . . 0.0 99.966 179.577 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 24.2 tt0 -107.73 161.67 14.67 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.606 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.513 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 36.0 t -87.0 162.61 17.54 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 113.163 -1.835 . . . . 0.0 108.632 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -122.73 36.79 4.56 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 124.297 0.998 . . . . 0.0 110.582 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 52.1 m-85 -136.08 -49.48 0.68 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.708 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 9' ' ' GLU . 27.3 p -111.82 -63.62 1.4 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.765 1.291 . . . . 0.0 110.605 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.484 ' HB3' ' O ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER 135.55 41.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.532 0 O-C-N 126.004 2.065 . . . . 0.0 108.932 -179.808 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.469 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 49.7 tp -83.4 157.03 22.65 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.523 HH11 ' H ' ' A' ' 13' ' ' ALA . 10.9 ttp85 -119.55 119.53 34.07 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 125.279 1.612 . . . . 0.0 107.696 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -132.88 77.1 1.72 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.523 ' H ' HH11 ' A' ' 11' ' ' ARG . . . -75.75 68.55 2.33 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 122.717 1.246 . . . . 0.0 112.658 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -139.19 -61.35 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.567 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p 127.3 -62.1 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.476 0 O-C-N 126.803 2.564 . . . . 0.0 109.865 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 m -57.59 -54.92 41.46 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 121.49 0.662 . . . . 0.0 109.364 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -42.52 -51.73 4.97 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.605 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -56.62 -54.69 43.07 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.034 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -43.47 -59.04 2.31 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 124.105 0.878 . . . . 0.0 111.718 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.8 t -60.56 -48.42 81.85 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 117.373 -1.299 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -40.31 -64.55 0.5 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.427 1.012 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.4 mt -43.66 -64.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 124.606 1.191 . . . . 0.0 113.956 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -58.72 -32.6 69.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -179.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.7 p -104.14 23.98 12.17 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.8 mmmm -142.02 -28.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.416 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 85.9 m-70 -119.29 -56.21 2.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 124.828 1.33 . . . . 0.0 108.651 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.7 m 81.58 -60.42 0.21 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 126.092 2.12 . . . . 0.0 107.948 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 30' ' ' LYS . 22.3 tptm -142.06 -41.57 0.35 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 113.711 -1.586 . . . . 0.0 111.39 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 26.43 -68.98 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.434 0 O-C-N 127.385 2.928 . . . . 0.0 115.123 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 28' ' ' LYS . 20.1 mtpp . . . . . 0 N--CA 1.499 2.013 0 CA-C-O 122.486 1.136 . . . . 0.0 108.595 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.5 pttt . . . . . 0 N--CA 1.496 1.87 0 N-CA-C 104.802 -2.295 . . . . 0.0 104.802 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.5 m -121.07 166.84 13.32 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 112.92 -1.945 . . . . 0.0 112.549 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -119.04 76.91 1.14 Allowed 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 104.207 -2.516 . . . . 0.0 104.207 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -124.96 144.56 50.3 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 125.591 1.807 . . . . 0.0 108.565 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.0 t -63.38 163.16 11.15 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 114.24 -1.346 . . . . 0.0 113.211 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -126.28 38.88 4.05 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.519 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 80.8 m-85 -139.47 -47.58 0.47 Allowed 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 114.331 -1.304 . . . . 0.0 112.325 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.8 p -109.69 -65.37 1.16 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 124.037 0.836 . . . . 0.0 112.465 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 140.14 41.73 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.596 0 C-N-CA 126.487 1.915 . . . . 0.0 110.264 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.442 HD23 ' C ' ' A' ' 10' ' ' LEU . 6.8 tt -101.18 131.05 47.34 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.7 ptt85 -123.6 150.18 44.43 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 123.891 0.744 . . . . 0.0 110.032 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.435 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 53.7 p -128.25 -55.93 1.25 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 124.182 0.926 . . . . 0.0 112.076 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 118.03 -18.54 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.781 0 O-C-N 125.725 1.891 . . . . 0.0 109.542 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -129.3 -178.86 4.84 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.09 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.7 t -111.44 176.65 4.94 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.361 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.3 m 99.73 -52.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.549 0 C-N-CA 126.07 1.748 . . . . 0.0 106.691 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.45 ' ND2' ' H ' ' A' ' 17' ' ' ASN . 2.9 p30 -79.86 -51.47 9.1 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.106 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.9 tp -60.87 -42.83 98.68 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.177 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -52.55 -60.5 3.16 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 61.0 m -48.54 -57.46 6.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 124.984 1.427 . . . . 0.0 109.907 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -40.08 -71.23 0.08 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 124.828 1.33 . . . . 0.0 110.926 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -47.42 -63.04 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.399 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -39.03 -53.68 1.76 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.0 t -106.02 5.65 30.52 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 118.022 2.601 . . . . 0.0 118.022 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -113.6 -25.33 8.77 Favored 'General case' 0 N--CA 1.504 2.27 0 CA-C-N 118.241 0.473 . . . . 0.0 111.645 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.519 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 62.4 m-70 -115.72 -40.25 3.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 123.928 0.768 . . . . 0.0 112.793 -179.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.2 t -91.74 -57.37 2.77 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 124.087 0.867 . . . . 0.0 111.563 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.403 ' HB3' ' NZ ' ' A' ' 28' ' ' LYS . 5.6 ttpm? -110.38 71.56 0.76 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 123.8 0.687 . . . . 0.0 109.188 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -52.45 89.4 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.078 0 O-C-N 124.065 0.853 . . . . 0.0 110.988 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.3 mttp . . . . . 0 N--CA 1.506 2.33 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 -179.916 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.672 0.748 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.0 m -118.78 165.8 13.57 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 103.463 -2.791 . . . . 0.0 103.463 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -121.87 162.09 21.6 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.856 0.836 . . . . 0.0 112.148 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.417 ' HG3' ' H ' ' A' ' 5' ' ' CYS . 10.6 tp-100 -120.52 179.18 4.4 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 112.374 -2.194 . . . . 0.0 106.204 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.417 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 44.5 t -106.01 169.13 8.67 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -116.6 25.43 10.59 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 123.981 0.801 . . . . 0.0 109.789 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -141.39 -52.46 0.45 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.439 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.5 p -117.67 -125.91 0.28 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.74 25.56 3.38 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.834 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.673 HD22 ' H ' ' A' ' 11' ' ' ARG . 1.3 tm? -69.19 164.41 22.7 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.099 -1.04 . . . . 0.0 108.323 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.673 ' H ' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -132.68 147.9 52.34 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 112.507 -2.133 . . . . 0.0 108.256 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.43 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 68.9 m -126.34 -32.27 2.71 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -179.435 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.43 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 112.02 -53.29 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.487 0 O-C-N 126.307 2.254 . . . . 0.0 105.122 -179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.405 ' CG ' ' H ' ' A' ' 15' ' ' SER . 35.1 t70 -137.02 -172.19 3.13 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 113.831 -1.531 . . . . 0.0 107.13 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.405 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 43.1 t -101.61 51.08 0.84 Allowed 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.6 t -122.98 -36.95 2.79 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 112.096 -2.32 . . . . 0.0 106.825 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.9 m-20 -106.36 -1.98 22.72 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.885 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 tp -85.39 -51.69 6.38 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -43.48 -47.74 7.2 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.164 0.915 . . . . 0.0 109.697 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.8 p -59.76 -59.43 5.44 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.233 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.405 ' CE1' ' HG ' ' A' ' 10' ' ' LEU . 51.7 t60 -41.98 -53.5 3.84 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 123.63 0.581 . . . . 0.0 109.555 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 67.2 mt -53.08 -58.95 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 123.995 0.809 . . . . 0.0 111.429 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -45.87 -39.38 8.53 Favored 'General case' 0 N--CA 1.504 2.267 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.9 m -92.35 -38.89 11.78 Favored 'General case' 0 N--CA 1.506 2.341 0 N-CA-C 119.08 2.992 . . . . 0.0 119.08 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -98.3 -6.72 30.39 Favored 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.9 m-70 -129.33 -47.93 1.19 Allowed 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.2 p -10.13 -65.33 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.536 0 O-C-N 125.867 1.979 . . . . 0.0 113.408 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.3 tptt -134.23 163.29 29.94 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-N 113.156 -1.838 . . . . 0.0 106.853 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -127.41 58.53 1.46 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 106.26 -1.755 . . . . 0.0 106.26 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp . . . . . 0 N--CA 1.494 1.769 0 CA-C-N 113.259 -1.791 . . . . 0.0 109.611 -179.747 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 53.7 pttt . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 122.415 1.102 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.6 t -143.11 -156.32 0.67 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 113.428 -1.714 . . . . 0.0 107.534 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.7 m-85 -82.47 115.07 21.32 Favored 'General case' 0 N--CA 1.502 2.162 0 N-CA-C 106.231 -1.766 . . . . 0.0 106.231 179.894 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -106.77 171.81 7.16 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 123.37 0.419 . . . . 0.0 110.294 -179.683 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 40.5 t -98.64 166.15 11.47 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 123.292 0.37 . . . . 0.0 111.638 -179.692 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -121.32 27.8 8.14 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 124.163 0.914 . . . . 0.0 110.996 -179.704 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -134.76 -51.89 0.79 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.132 -179.706 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 32.1 p -109.37 -46.24 3.59 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.243 0.965 . . . . 0.0 111.673 -179.599 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 135.9 -52.03 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.323 0 O-C-N 125.935 2.022 . . . . 0.0 108.386 -179.848 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.5 tt -22.06 130.7 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.461 0 O-C-N 125.377 1.673 . . . . 0.0 113.892 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -111.76 168.18 9.77 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.18 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.7 m -125.37 178.6 5.52 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-N 112.103 -2.317 . . . . 0.0 108.512 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.43 -31.39 10.94 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.281 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -117.36 -160.34 0.77 Allowed 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.682 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.9 p -99.87 -55.89 2.52 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 t -43.75 -50.03 7.82 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 124.085 0.866 . . . . 0.0 110.689 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -49.5 -61.2 2.23 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 114.295 -1.32 . . . . 0.0 110.615 179.766 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.08 -52.94 62.5 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.825 -179.911 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -40.61 -56.39 2.12 Favored 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 121.848 0.832 . . . . 0.0 109.341 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 87.4 m -55.61 -58.48 7.64 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 113.357 -1.747 . . . . 0.0 109.32 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -39.35 -60.78 0.87 Allowed 'General case' 0 N--CA 1.506 2.34 0 O-C-N 124.318 1.012 . . . . 0.0 109.915 179.688 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.1 mm -48.27 -66.51 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.127 179.743 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -38.67 -46.2 1.2 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.6 t -93.32 -31.92 14.49 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 119.475 3.139 . . . . 0.0 119.475 -179.414 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -93.83 -17.1 23.44 Favored 'General case' 0 N--CA 1.503 2.179 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.772 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -122.55 -45.62 2.18 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 123.525 0.516 . . . . 0.0 111.525 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.1 p 45.08 16.06 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -179.851 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -118.54 -179.09 3.69 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-O 121.586 0.708 . . . . 0.0 110.455 -179.863 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -91.85 -49.51 6.21 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.068 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? . . . . . 0 N--CA 1.496 1.831 0 O-C-N 124.488 1.118 . . . . 0.0 109.968 179.8 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? . . . . . 0 N--CA 1.484 1.258 0 N-CA-C 105.486 -2.042 . . . . 0.0 105.486 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.1 m -111.29 167.25 10.43 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.163 -1.586 . . . . 0.0 111.037 0.148 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.407 ' CE2' ' HB2' ' A' ' 15' ' ' SER . 19.3 m-85 -129.89 152.06 49.78 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.778 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.5 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 7.4 tt0 -126.68 169.71 12.86 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 179.69 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.511 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 51.5 t -100.84 154.54 18.56 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.758 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -127.04 42.99 3.21 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.511 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 63.9 m-85 -133.93 -51.17 0.84 Allowed 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 113.182 -1.827 . . . . 0.0 108.321 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 9' ' ' GLU . 22.1 p -112.94 -52.98 2.75 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.547 1.154 . . . . 0.0 109.972 179.898 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 4.1 tm-20 148.79 -46.93 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.568 0 O-C-N 125.609 1.818 . . . . 0.0 107.813 -179.685 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.429 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 0.9 OUTLIER -20.64 149.88 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.555 0 N-CA-C 116.693 2.108 . . . . 0.0 116.693 -179.845 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.429 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 2.3 ptm180 -106.1 155.54 19.32 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.226 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.2 t -134.63 159.37 41.43 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 114.165 -1.38 . . . . 0.0 107.839 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.14 -63.62 1.02 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 179.814 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -137.0 169.92 16.97 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 120.45 -0.5 . . . . 0.0 109.696 179.69 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.407 ' HB2' ' CE2' ' A' ' 3' ' ' TYR . 39.3 t -47.77 -51.73 21.3 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 179.567 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 87.0 p -35.09 -37.38 0.07 Allowed 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 111.62 -2.537 . . . . 0.0 113.983 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -97.83 -48.4 5.2 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 124.255 0.972 . . . . 0.0 109.529 -179.783 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.9 tp -39.2 -47.3 1.61 Allowed 'General case' 0 N--CA 1.503 2.217 0 CA-C-O 122.044 0.926 . . . . 0.0 111.147 179.548 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -42.64 -48.21 5.42 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.62 179.733 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.8 p -73.9 -41.94 61.38 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.851 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -43.98 -56.05 4.22 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 179.393 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.8 mt -49.6 -66.03 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-N 113.706 -1.588 . . . . 0.0 108.986 179.52 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -32.8 -43.46 0.09 Allowed 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 179.742 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 51.1 m -89.26 -45.56 9.43 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.148 2.647 . . . . 0.0 118.148 -179.539 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.41 ' HB3' ' NZ ' ' A' ' 25' ' ' LYS . 3.5 mmmp? -83.89 -18.08 38.63 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 -179.332 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -124.28 -105.14 0.36 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 123.611 0.569 . . . . 0.0 111.067 -179.714 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 54.6 m 19.93 71.93 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -179.868 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -106.58 56.76 0.65 Allowed 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 112.559 -2.109 . . . . 0.0 109.583 -179.936 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -125.28 -42.6 1.98 Allowed 'General case' 0 N--CA 1.499 2.009 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.426 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp . . . . . 0 N--CA 1.504 2.259 0 O-C-N 125.964 2.04 . . . . 0.0 116.275 -179.936 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.466 HG22 ' H ' ' A' ' 3' ' ' TYR . 2.4 m -121.47 -165.71 1.28 Allowed 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.466 ' H ' HG22 ' A' ' 2' ' ' THR . 6.4 m-85 -83.92 85.28 7.34 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 101.713 -3.44 . . . . 0.0 101.713 179.509 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -106.51 162.75 13.45 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -179.402 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 38.9 t -72.82 165.98 23.82 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 114.033 -1.44 . . . . 0.0 112.158 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -125.16 24.63 7.41 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.265 -179.918 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -127.5 -47.9 1.42 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.135 -179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.441 ' SG ' ' N ' ' A' ' 9' ' ' GLU . 30.5 p -116.02 -114.72 0.33 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.441 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 16.0 tp10 -136.81 -40.08 0.62 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 123.761 0.663 . . . . 0.0 112.442 -179.794 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -28.77 136.22 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -179.561 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.7 ptp180 -128.83 158.35 38.95 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.4 179.458 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -114.41 -163.13 0.85 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 105.308 -2.108 . . . . 0.0 105.308 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.47 -48.48 2.87 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -132.64 175.79 9.01 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 113.991 -1.459 . . . . 0.0 107.411 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.2 p -38.6 -36.97 0.28 Allowed 'General case' 0 N--CA 1.508 2.462 0 CA-C-O 122.789 1.28 . . . . 0.0 109.659 179.337 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 17' ' ' ASN . 27.8 m -108.27 134.22 51.4 Favored 'General case' 0 C--N 1.308 -1.207 1 N-CA-C 98.925 -4.472 . . . . 0.0 98.925 179.798 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.4 ' HA ' ' HA ' ' A' ' 16' ' ' SER . 49.1 p-10 -104.5 65.25 0.77 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 118.877 -2.389 . . . . 0.0 113.32 0.49 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.8 tp -99.82 -50.93 3.87 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-N 113.485 -1.689 . . . . 0.0 107.34 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -36.64 -61.13 0.55 Allowed 'General case' 0 N--CA 1.507 2.392 0 O-C-N 124.082 0.863 . . . . 0.0 110.649 179.454 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.8 t -47.93 -49.72 29.21 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 113.833 -1.53 . . . . 0.0 111.539 179.767 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.454 ' ND1' ' HD2' ' A' ' 25' ' ' LYS . 74.6 t60 -48.88 -71.66 0.06 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 124.033 0.833 . . . . 0.0 110.788 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 51.3 mt -43.46 -48.47 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 124.362 1.039 . . . . 0.0 112.339 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -56.96 -55.98 27.66 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 92.8 m -79.59 -32.59 41.96 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 119.642 3.201 . . . . 0.0 119.642 -179.256 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.454 ' HD2' ' ND1' ' A' ' 21' ' ' HIS . 53.4 mttp -96.84 -11.71 24.49 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -179.312 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -129.44 -59.86 1.07 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.2 m -45.93 -65.64 0.52 Allowed 'General case' 0 N--CA 1.505 2.323 0 O-C-N 123.903 0.752 . . . . 0.0 111.21 -179.845 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 37.8 pttt -120.31 109.73 15.72 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 179.601 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -113.08 50.62 0.87 Allowed 'General case' 0 N--CA 1.497 1.896 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.678 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.7 pttp . . . . . 0 N--CA 1.506 2.366 0 N-CA-C 117.12 2.267 . . . . 0.0 117.12 179.662 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 98.2 mttt . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 119.235 -0.412 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.7 m -118.53 164.68 14.94 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.059 -1.65 . . . . 0.0 108.399 -0.06 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -123.49 154.08 39.63 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 124.324 1.015 . . . . 0.0 109.432 179.954 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -129.41 166.92 18.61 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.96 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 39.8 t -83.85 161.18 20.99 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -122.95 32.98 5.53 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 123.771 0.669 . . . . 0.0 110.575 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -137.21 -42.24 0.57 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.997 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.8 p -110.77 -59.52 1.95 Allowed 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 160.74 -46.85 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.327 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -27.5 148.33 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 O-C-N 125.634 1.834 . . . . 0.0 115.123 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.6 ttm-85 -109.99 153.82 24.02 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.767 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.7 p -124.55 -174.91 3.13 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 179.949 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.684 ' H ' HD22 ' A' ' 17' ' ' ASN . . . -115.05 -61.81 1.69 Allowed 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 120.557 -0.457 . . . . 0.0 109.906 -179.973 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -125.48 177.12 6.37 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 124.368 1.042 . . . . 0.0 112.159 -179.838 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.6 t -94.99 46.62 1.13 Allowed 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 122.93 1.348 . . . . 0.0 110.629 -179.689 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.407 ' H ' ' H ' ' A' ' 17' ' ' ASN . 92.0 p -128.53 -28.38 2.52 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 112.672 -2.058 . . . . 0.0 105.979 179.572 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.684 HD22 ' H ' ' A' ' 13' ' ' ALA . 5.9 p-10 -107.09 -49.43 3.28 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 113.042 -1.89 . . . . 0.0 110.894 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 62.1 tp -40.82 -45.11 2.4 Favored 'General case' 0 N--CA 1.509 2.485 0 CA-C-N 117.977 0.353 . . . . 0.0 111.25 179.778 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -49.71 -60.79 2.56 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.949 179.624 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.5 t -50.47 -43.14 55.28 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 124.219 0.949 . . . . 0.0 111.286 -179.723 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -55.45 -64.14 0.94 Allowed 'General case' 0 N--CA 1.5 2.073 0 O-C-N 124.25 0.969 . . . . 0.0 109.273 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -49.41 -63.43 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.002 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -38.91 -33.15 0.1 Allowed 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -179.932 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.1 m -97.1 -44.08 7.12 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 118.283 2.697 . . . . 0.0 118.283 -179.383 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -91.37 -12.97 33.33 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 115.286 1.588 . . . . 0.0 115.286 -179.366 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -127.2 -40.79 1.81 Allowed 'General case' 0 N--CA 1.496 1.87 0 O-C-N 123.733 0.645 . . . . 0.0 110.951 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 t 62.47 41.55 9.71 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-N 114.15 -1.386 . . . . 0.0 108.002 -179.75 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? 0.28 66.98 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.393 0 N-CA-C 117.093 2.257 . . . . 0.0 117.093 -179.928 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 26.92 53.02 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 CA-C-O 122.855 1.312 . . . . 0.0 112.63 -179.935 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 85.2 tttt . . . . . 0 N--CA 1.495 1.793 0 CA-C-N 112.017 -2.356 . . . . 0.0 108.651 -179.937 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp . . . . . 0 N--CA 1.494 1.775 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.444 HG22 ' H ' ' A' ' 3' ' ' TYR . 35.5 m 87.92 168.63 0.05 Allowed 'General case' 0 N--CA 1.508 2.428 0 O-C-N 125.52 1.763 . . . . 0.0 109.117 179.808 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.444 ' H ' HG22 ' A' ' 2' ' ' THR . 57.1 m-85 -107.69 75.31 1.0 Allowed 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 105.375 -2.083 . . . . 0.0 105.375 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.403 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 51.3 tt0 -122.81 173.66 7.62 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-N 111.196 -2.729 . . . . 0.0 106.286 179.763 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.548 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 51.1 t -97.43 156.93 16.26 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.631 -179.868 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -121.46 37.08 4.43 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 124.268 0.98 . . . . 0.0 109.355 -179.87 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -133.12 -50.4 0.88 Allowed 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.093 -1.412 . . . . 0.0 109.043 179.867 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 27.5 p -113.25 -51.77 2.8 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 124.509 1.131 . . . . 0.0 108.431 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 33.7 tt0 112.97 61.08 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.599 0 O-C-N 126.305 2.253 . . . . 0.0 110.79 179.799 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.548 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 8.2 tt -107.37 135.66 48.48 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 104.642 -2.355 . . . . 0.0 104.642 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.401 ' HA ' ' HA ' ' A' ' 4' ' ' GLN . 19.1 ttt180 -115.16 147.72 39.91 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-O 121.838 0.828 . . . . 0.0 111.301 -179.906 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 62.2 m -118.64 -48.35 2.49 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-N 112.859 -1.973 . . . . 0.0 106.201 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.415 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 108.77 -38.22 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.431 0 O-C-N 126.633 2.458 . . . . 0.0 109.089 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -122.12 -176.67 3.4 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.978 -179.847 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.47 161.57 18.4 Favored 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 -179.985 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 71.0 m -112.2 41.07 2.05 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 123.014 2.643 . . . . 0.0 107.88 0.019 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -72.04 -41.7 67.16 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 103.085 -2.931 . . . . 0.0 103.085 179.743 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.4 tp -57.08 -51.89 67.48 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.434 179.527 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -45.38 -58.52 3.27 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 179.708 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.6 m -48.35 -56.86 7.01 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.213 179.57 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -45.31 -67.5 0.28 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.828 0.705 . . . . 0.0 109.701 179.642 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.8 mm -37.92 -57.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 124.622 1.201 . . . . 0.0 112.775 179.835 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -58.16 -40.27 80.97 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 63.9 p -88.41 -32.13 18.49 Favored 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -179.592 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -92.77 -24.74 18.46 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 123.73 0.644 . . . . 0.0 110.895 -179.943 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -127.55 29.77 5.45 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 123.892 0.745 . . . . 0.0 111.881 179.979 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.8 t -32.73 -36.49 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 179.372 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -95.09 163.04 13.47 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 123.899 0.749 . . . . 0.0 110.91 -179.43 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -116.7 141.17 48.55 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.909 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 87.3 tttt . . . . . 0 N--CA 1.504 2.232 0 CA-C-N 121.643 2.02 . . . . 0.0 108.24 -0.117 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 49.4 tttm . . . . . 0 N--CA 1.492 1.632 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.462 HG22 ' H ' ' A' ' 3' ' ' TYR . 62.9 m -127.54 177.71 6.58 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.811 -1.54 . . . . 0.0 107.568 -179.87 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.462 ' H ' HG22 ' A' ' 2' ' ' THR . 7.2 m-85 -89.24 101.7 14.37 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.497 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 11.7 tt0 -113.61 -170.68 1.74 Allowed 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 103.853 -2.647 . . . . 0.0 103.853 179.579 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.497 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 50.1 t -107.04 158.35 17.12 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -122.9 36.09 4.73 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 179.807 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.422 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 86.3 m-85 -137.94 -54.78 0.66 Allowed 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 113.961 -1.472 . . . . 0.0 108.779 179.966 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.3 p -117.6 -129.38 0.29 Allowed 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 102.302 -3.222 . . . . 0.0 102.302 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -147.64 52.2 1.05 Allowed 'General case' 0 N--CA 1.501 2.089 0 O-C-N 123.692 0.62 . . . . 0.0 111.967 -179.696 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.9 tt -107.62 148.87 28.76 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.23 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -107.04 145.27 32.56 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 124.585 1.178 . . . . 0.0 108.005 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.407 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 58.3 m -114.9 -43.51 3.11 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.754 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.407 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 110.15 -60.76 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.291 0 O-C-N 126.55 2.406 . . . . 0.0 105.621 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -135.9 162.47 32.75 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.859 1.35 . . . . 0.0 110.283 179.623 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.426 ' HA ' ' CE2' ' A' ' 3' ' ' TYR . 1.9 t -37.01 -52.7 0.97 Allowed 'General case' 0 N--CA 1.505 2.32 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.049 179.588 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.7 t -27.86 -41.42 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 CA-C-N 112.91 -1.95 . . . . 0.0 116.187 179.813 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -105.04 -37.66 6.86 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 123.693 0.62 . . . . 0.0 111.077 -179.564 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 tp -48.5 -27.29 2.61 Favored 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.478 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 10.2 mtpm? -106.46 124.73 50.04 Favored 'General case' 0 C--N 1.308 -1.207 1 N-CA-C 96.08 -5.526 . . . . 0.0 96.08 178.814 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 19.2 p -97.38 26.83 4.58 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 119.256 -2.152 . . . . 0.0 114.605 0.678 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.412 ' ND1' ' HD2' ' A' ' 25' ' ' LYS . 80.0 t60 -44.07 -61.15 1.57 Allowed 'General case' 0 N--CA 1.507 2.377 0 CA-C-N 119.647 1.112 . . . . 0.0 109.963 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.4 mt -56.03 -69.75 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.258 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.458 ' HB3' ' HB ' ' A' ' 20' ' ' THR . 40.5 ttmt -31.99 -48.51 0.16 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 179.783 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.4 m -95.13 -26.44 16.01 Favored 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 118.312 2.708 . . . . 0.0 118.312 -179.257 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.412 ' HD2' ' ND1' ' A' ' 21' ' ' HIS . 55.5 mttp -101.71 -10.69 19.76 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 -179.459 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.4 m-70 -129.05 -35.47 1.83 Allowed 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 115.549 1.685 . . . . 0.0 115.549 -179.952 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.1 t -93.04 -55.19 3.43 Favored 'General case' 0 N--CA 1.501 2.083 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -179.453 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -89.32 -61.85 1.61 Allowed 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.662 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 85.36 -45.01 0.06 Allowed 'General case' 0 N--CA 1.506 2.341 0 O-C-N 125.431 1.707 . . . . 0.0 109.636 179.828 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp . . . . . 0 N--CA 1.495 1.82 0 CA-C-N 114.218 -1.356 . . . . 0.0 109.373 -179.968 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 11.2 pttp . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.762 0.791 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.7 m -107.43 169.2 8.73 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.882 -179.864 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -114.21 108.06 16.45 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 114.443 -1.253 . . . . 0.0 108.27 -179.879 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -113.28 178.77 4.17 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.475 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 42.0 t -106.94 159.07 16.55 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 120.072 -0.651 . . . . 0.0 112.127 -179.912 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -123.21 33.52 5.36 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.02 -1.445 . . . . 0.0 110.292 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -134.74 -49.12 0.76 Allowed 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.682 -1.144 . . . . 0.0 108.278 179.894 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.6 p -115.66 -63.12 1.5 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 124.331 1.019 . . . . 0.0 109.568 179.794 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 132.79 49.25 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.575 0 C-N-CA 127.345 2.258 . . . . 0.0 109.592 -179.941 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.475 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 6.5 tt -98.22 153.27 18.61 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 179.856 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.9 ttm105 -107.73 137.25 46.09 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.973 -1.467 . . . . 0.0 109.432 -179.66 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.42 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 29.1 t -116.81 -51.54 2.57 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-N 113.854 -1.521 . . . . 0.0 107.669 179.874 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 12' ' ' SER . . . 92.09 -32.94 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.321 0 O-C-N 126.296 2.247 . . . . 0.0 110.385 179.982 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -136.58 136.23 39.08 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 124.253 0.971 . . . . 0.0 110.379 -179.872 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 53.4 p -39.75 -50.3 2.34 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 124.05 0.844 . . . . 0.0 109.555 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.9 t -29.82 -41.38 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 O-C-N 125.627 1.829 . . . . 0.0 115.39 179.593 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -102.29 -40.81 6.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 123.787 0.68 . . . . 0.0 109.696 -179.643 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -46.31 -42.92 15.37 Favored 'General case' 0 N--CA 1.505 2.31 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 179.662 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -45.85 -68.65 0.18 Allowed 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.905 179.347 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.5 p -53.94 -45.98 71.42 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 113.531 -1.668 . . . . 0.0 111.145 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.468 ' CE1' HD13 ' A' ' 10' ' ' LEU . 74.0 t60 -46.47 -65.38 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.671 1.232 . . . . 0.0 112.054 -179.954 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.7 mt -49.9 -56.65 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 124.292 0.995 . . . . 0.0 111.963 -179.645 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -51.12 -48.59 61.71 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -179.806 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 m -82.17 -37.09 26.64 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 118.609 2.818 . . . . 0.0 118.609 -179.218 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -96.31 -15.28 22.01 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -179.65 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -126.4 15.53 7.71 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.686 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.1 m -9.63 -58.33 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.571 0 N-CA-C 115.789 1.774 . . . . 0.0 115.789 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -114.53 62.04 0.67 Allowed 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 114.042 -1.436 . . . . 0.0 108.652 -179.945 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -9.14 -67.46 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 CA-C-N 112.982 -1.917 . . . . 0.0 115.504 -179.783 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.506 ' HB3' ' NZ ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 122.391 1.091 . . . . 0.0 111.661 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.9 pttm . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 120.366 0.127 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.7 p -114.85 171.79 7.44 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 122.397 1.094 . . . . 0.0 112.573 -179.947 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.433 ' CE1' ' HA ' ' A' ' 14' ' ' ASP . 6.6 m-85 -114.02 165.06 13.01 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.136 -2.302 . . . . 0.0 106.197 179.852 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -131.91 164.15 26.74 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 179.704 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.468 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 42.3 t -106.34 159.34 16.21 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 105.903 -1.888 . . . . 0.0 105.903 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.0 pm0 -122.82 35.03 4.98 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.887 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -132.36 -50.76 0.93 Allowed 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.81 -1.541 . . . . 0.0 108.676 179.9 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.5 p -112.69 -42.13 3.68 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.215 0.947 . . . . 0.0 109.282 179.849 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 97.19 54.07 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.138 0 O-C-N 126.265 2.228 . . . . 0.0 109.956 179.809 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.468 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 5.5 tt -104.23 148.32 26.47 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 103.434 -2.802 . . . . 0.0 103.434 179.652 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.453 ' HD2' ' C ' ' A' ' 10' ' ' LEU . 5.4 mpt_? -108.69 141.89 39.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 124.362 1.039 . . . . 0.0 110.69 -179.501 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.5 m -124.13 -166.47 1.5 Allowed 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 113.305 -1.77 . . . . 0.0 108.75 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -104.89 -42.82 5.24 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.753 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.613 ' H ' HD21 ' A' ' 17' ' ' ASN . 34.5 t70 -129.92 -165.54 1.55 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 123.94 0.775 . . . . 0.0 109.698 -179.803 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.496 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 45.5 t -93.01 -42.55 9.37 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 179.735 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.8 m -47.3 -43.69 22.77 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-O 121.944 0.878 . . . . 0.0 110.802 179.861 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.613 HD21 ' H ' ' A' ' 14' ' ' ASP . 16.8 p30 -83.53 -24.48 31.63 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.623 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.401 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 27.4 tp -67.79 -46.55 71.64 Favored 'General case' 0 N--CA 1.506 2.37 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -51.28 -52.45 44.95 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.0 m -57.36 -53.21 60.75 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.882 179.549 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 26.7 t60 -40.44 -59.59 1.29 Allowed 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.348 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -51.69 -60.47 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.96 179.633 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -34.89 -50.13 0.47 Allowed 'General case' 0 N--CA 1.503 2.206 0 O-C-N 124.539 1.15 . . . . 0.0 113.038 179.555 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.47 ' HA ' ' HB2' ' A' ' 28' ' ' LYS . 24.3 m -114.64 45.89 1.49 Allowed 'General case' 0 N--CA 1.501 2.12 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -179.751 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -156.09 -37.15 0.08 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 121.389 0.614 . . . . 0.0 110.406 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -119.65 -38.58 2.97 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-N 114.203 -1.362 . . . . 0.0 113.28 -179.252 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 p -113.48 51.43 0.85 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.275 0.985 . . . . 0.0 112.618 -179.596 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.47 ' HB2' ' HA ' ' A' ' 24' ' ' THR . 1.1 tmmm? -127.26 -67.79 0.82 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 103.547 -2.761 . . . . 0.0 103.547 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.597 ' H ' ' CD ' ' A' ' 29' ' ' GLU . 12.3 mp0 -6.56 79.78 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.099 0 O-C-N 126.676 2.485 . . . . 0.0 113.854 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.4 ttmt . . . . . 0 N--CA 1.496 1.863 0 CA-C-O 122.513 1.149 . . . . 0.0 108.838 -179.879 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.8 pttp . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 69.0 p -107.55 165.95 11.03 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.835 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.467 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 1.0 OUTLIER -131.27 167.28 19.48 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 105.569 -2.011 . . . . 0.0 105.569 179.895 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -126.53 165.87 18.33 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 179.588 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.443 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 44.8 t -94.49 -66.19 0.93 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.96 -179.945 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 28.2 tt0 90.92 -10.5 0.28 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 125.13 1.519 . . . . 0.0 111.53 179.885 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -91.7 -47.51 7.33 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.733 -179.769 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.2 p -111.45 -24.26 10.27 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.925 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 94.16 53.61 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 126.775 2.03 . . . . 0.0 111.084 179.446 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.449 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 11.5 tp -107.64 162.34 14.06 Favored 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 114.122 -1.399 . . . . 0.0 107.482 179.79 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.449 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 15.3 ttt85 -125.27 157.94 35.35 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 179.452 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.9 m -122.54 176.02 6.15 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.411 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.25 -47.59 2.93 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 124.676 1.235 . . . . 0.0 110.018 -179.903 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -123.45 162.59 22.53 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 123.761 0.663 . . . . 0.0 110.192 -179.974 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.6 p -50.42 -47.64 56.55 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-O 121.837 0.827 . . . . 0.0 108.92 179.584 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.5 m -56.63 -55.16 37.45 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.4 -1.727 . . . . 0.0 108.192 -179.989 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -40.69 -54.23 2.64 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.873 179.727 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -64.04 -57.17 10.45 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.831 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp -39.92 -54.7 2.14 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 124.201 0.938 . . . . 0.0 110.932 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.2 p -60.44 -54.43 45.64 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.065 -179.99 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 44.6 t60 -42.98 -59.17 2.11 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 119.611 -0.835 . . . . 0.0 109.536 179.802 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.38 -69.71 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 124.277 0.985 . . . . 0.0 109.756 179.522 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mmtm -41.51 -34.17 0.53 Allowed 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 -179.762 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.0 m -91.46 -41.46 10.83 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 118.658 2.836 . . . . 0.0 118.658 -179.549 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -103.56 -4.9 23.3 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -132.76 -40.92 0.95 Allowed 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -179.944 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 81.7 p 40.52 54.55 2.97 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 125.187 1.554 . . . . 0.0 107.191 -179.198 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 30' ' ' LYS . 22.5 ttmm 58.19 65.69 1.24 Allowed 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 112.067 -2.333 . . . . 0.0 104.847 -179.559 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 37.84 -77.58 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.049 0 CA-C-N 112.163 -2.29 . . . . 0.0 113.544 -179.487 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.016 0 CA-C-O 122.25 1.024 . . . . 0.0 108.722 179.758 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 99.0 mttt . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.67 0.748 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.476 HG22 ' H ' ' A' ' 3' ' ' TYR . 95.5 m -129.28 174.77 9.3 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 179.594 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.518 ' CE1' ' HB2' ' A' ' 15' ' ' SER . 82.9 m-85 -123.05 76.27 1.36 Allowed 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 179.876 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -111.94 163.77 13.87 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 104.284 -2.487 . . . . 0.0 104.284 -179.962 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.6 t -103.21 153.79 20.0 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.817 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -119.79 35.81 4.72 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 122.131 0.967 . . . . 0.0 109.278 -179.812 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -131.52 -52.25 1.01 Allowed 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 113.772 -1.558 . . . . 0.0 107.676 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.7 p -119.86 -116.82 0.32 Allowed 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 103.538 -2.764 . . . . 0.0 103.538 179.717 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -161.94 58.8 0.25 Allowed 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.395 0.617 . . . . 0.0 109.81 179.74 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.1 tt -107.28 115.25 29.84 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 179.816 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -116.31 137.04 52.48 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.587 -179.834 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.5 p -128.38 -174.84 3.33 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-N 112.486 -2.143 . . . . 0.0 109.0 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.07 -23.88 8.82 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.52 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -115.12 174.76 5.82 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.364 1.04 . . . . 0.0 110.687 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.518 ' HB2' ' CE1' ' A' ' 3' ' ' TYR . 22.2 t -115.23 52.45 0.87 Allowed 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 p -110.72 -45.17 3.53 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 112.999 -1.91 . . . . 0.0 110.432 -179.698 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -106.44 -14.65 15.02 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 125.383 1.677 . . . . 0.0 113.085 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -74.13 -53.7 9.35 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.676 -179.875 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -47.85 -48.31 31.08 Favored 'General case' 0 N--CA 1.5 2.067 0 CA-C-O 121.196 0.522 . . . . 0.0 109.795 179.669 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.3 p -65.6 -52.4 52.37 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.263 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -36.3 -64.55 0.32 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 123.954 0.784 . . . . 0.0 110.354 179.58 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.6 mt -51.52 -61.01 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 123.751 0.657 . . . . 0.0 111.152 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -38.18 -43.31 0.75 Allowed 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.9 p -98.63 -38.7 9.02 Favored 'General case' 0 N--CA 1.508 2.455 0 N-CA-C 120.008 3.336 . . . . 0.0 120.008 -179.407 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -79.1 -26.27 42.96 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -179.235 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -116.04 -59.31 2.0 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.7 t 76.85 -56.54 0.55 Allowed 'General case' 0 N--CA 1.507 2.414 0 O-C-N 125.124 1.515 . . . . 0.0 111.7 179.797 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -123.72 -174.97 3.1 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 113.67 -1.604 . . . . 0.0 109.449 -179.949 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -122.0 82.84 2.01 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 179.893 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.506 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.886 0 O-C-N 119.721 -1.862 . . . . 0.0 111.105 -0.14 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.474 ' CD1' ' HA ' ' A' ' 14' ' ' ASP . 2.4 m-85 . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 105.149 -2.167 . . . . 0.0 105.149 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -108.57 175.46 5.46 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 124.736 1.273 . . . . 0.0 109.255 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.2 t -89.92 172.73 8.66 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -118.66 13.97 13.43 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 123.862 0.726 . . . . 0.0 111.032 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -129.87 -47.92 1.13 Allowed 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.511 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.1 p -112.78 -116.47 0.32 Allowed 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -164.08 42.76 0.1 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -106.68 131.63 53.59 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.586 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.427 ' C ' ' HD3' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -114.06 168.81 9.5 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.695 179.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.6 t -129.15 -83.84 0.56 Allowed 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -164.88 -66.99 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 103.07 -2.937 . . . . 0.0 103.07 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.474 ' HA ' ' CD1' ' A' ' 3' ' ' TYR . 2.4 m-20 -134.44 162.28 32.67 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 124.782 1.301 . . . . 0.0 110.961 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.3 p -36.67 -53.09 0.9 Allowed 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.813 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.6 p -15.39 -50.51 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 126.329 2.268 . . . . 0.0 116.905 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -106.28 -45.39 4.3 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 114.658 -1.156 . . . . 0.0 110.397 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.6 tt -40.78 -45.1 2.37 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.17 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -43.12 -49.69 6.29 Favored 'General case' 0 N--CA 1.507 2.408 0 CA-C-O 121.455 0.645 . . . . 0.0 111.172 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.8 m -57.15 -55.86 29.28 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.436 -1.256 . . . . 0.0 109.741 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -37.68 -61.37 0.63 Allowed 'General case' 0 N--CA 1.507 2.407 0 O-C-N 124.649 1.218 . . . . 0.0 109.454 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.0 mt -47.34 -69.13 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.2 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -40.42 -39.17 0.94 Allowed 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.2 p -92.21 -36.55 13.2 Favored 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 118.692 2.849 . . . . 0.0 118.692 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.44 ' N ' ' HD2' ' A' ' 25' ' ' LYS . 13.8 mptt -95.07 -13.86 24.78 Favored 'General case' 0 N--CA 1.508 2.427 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.9 m-70 -122.02 -33.35 3.55 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.55 0.531 . . . . 0.0 109.829 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 79.1 p . . . . . 0 N--CA 1.5 2.045 0 O-C-N 124.871 1.357 . . . . 0.0 113.177 179.905 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 . . . . . 0 N--CA 1.496 1.859 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -137.8 165.65 25.93 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 44.6 t -82.18 161.13 22.88 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -119.76 28.7 7.97 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.151 0.907 . . . . 0.0 109.256 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -132.62 -55.12 0.95 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.005 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.7 p -111.72 -113.72 0.32 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.72 43.64 0.38 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.3 tt -90.62 148.91 22.35 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 11' ' ' ARG . 1.1 ptp85 -124.08 143.59 50.37 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 124.712 1.258 . . . . 0.0 111.099 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -140.52 168.43 19.81 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.423 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.16 2.75 11.43 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -125.51 -173.2 2.77 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.614 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.8 p -107.45 -49.69 3.21 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.5 p -42.21 -62.15 1.01 Allowed 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 121.922 0.868 . . . . 0.0 111.202 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -45.28 -48.94 12.95 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 113.728 -1.578 . . . . 0.0 111.223 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.432 HD13 HD13 ' A' ' 22' ' ' ILE . 3.4 tm? -62.25 -59.56 4.85 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.123 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -40.28 -53.69 2.5 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 124.234 0.959 . . . . 0.0 111.457 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.2 p -64.22 -51.02 65.71 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.445 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -37.78 -57.7 0.97 Allowed 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.433 ' N ' HD12 ' A' ' 22' ' ' ILE . 2.4 mp -57.67 -62.65 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 124.764 1.29 . . . . 0.0 111.859 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 tttt -42.74 -37.57 1.8 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.5 m -83.19 -58.74 2.72 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 118.484 2.772 . . . . 0.0 118.484 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -87.48 -4.58 59.0 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 116.956 2.206 . . . . 0.0 116.956 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -125.76 -33.91 2.68 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.3 m . . . . . 0 N--CA 1.504 2.246 0 N-CA-C 118.67 2.841 . . . . 0.0 118.67 -179.64 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.461 ' CE2' ' HB2' ' A' ' 15' ' ' SER . 36.7 m-85 . . . . . 0 N--CA 1.493 1.711 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.559 HE22 ' H ' ' A' ' 6' ' ' GLN . 2.1 tm0? -114.07 154.88 26.97 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.8 t -72.43 -49.39 33.87 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 118.38 2.733 . . . . 0.0 118.38 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.559 ' H ' HE22 ' A' ' 4' ' ' GLN . 0.0 OUTLIER 72.93 17.12 4.31 Favored 'General case' 0 N--CA 1.509 2.488 0 C-N-CA 124.328 1.051 . . . . 0.0 112.456 -179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.479 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 24.4 m-85 -121.38 -50.36 2.12 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.418 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 24.3 p -111.56 -50.2 2.94 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.431 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 45.9 tp10 118.68 66.8 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 126.92 2.637 . . . . 0.0 110.108 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 14.5 tp -106.04 157.63 17.39 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.5 ttt85 -118.49 120.01 36.25 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.8 1.313 . . . . 0.0 108.535 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -122.53 149.58 43.73 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 122.845 1.307 . . . . 0.0 111.364 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -135.09 83.93 2.06 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 101.46 -3.533 . . . . 0.0 101.46 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.457 ' HB2' ' CD1' ' A' ' 3' ' ' TYR . 1.9 p30 -137.24 -153.61 0.5 Allowed 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 126.739 2.016 . . . . 0.0 106.973 0.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.461 ' HB2' ' CE2' ' A' ' 3' ' ' TYR . 43.7 t -26.02 -55.92 0.07 Allowed 'General case' 0 N--CA 1.503 2.211 0 O-C-N 124.23 0.957 . . . . 0.0 112.303 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.5 m -33.37 -38.81 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 CA-C-N 113.005 -1.907 . . . . 0.0 115.841 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -95.11 -50.78 4.92 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.817 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.412 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 2.8 tt -40.46 -46.38 2.42 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 123.853 0.721 . . . . 0.0 110.722 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -44.45 -56.17 4.48 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.118 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.0 p -66.3 -42.36 88.42 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 28.1 t60 -44.61 -61.39 1.58 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.77 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.3 mt -50.25 -61.8 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 O-C-N 124.604 1.19 . . . . 0.0 109.399 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -31.0 -52.23 0.18 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 125.468 1.73 . . . . 0.0 114.178 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.8 t -112.7 36.19 3.55 Favored 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -142.21 -35.38 0.43 Allowed 'General case' 0 N--CA 1.503 2.225 0 CA-C-O 121.411 0.625 . . . . 0.0 109.876 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -119.64 -64.39 1.27 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 113.857 -1.519 . . . . 0.0 107.144 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.495 1.822 0 O-C-N 125.673 1.858 . . . . 0.0 113.449 179.507 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.405 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 32.2 tt0 -116.25 153.89 31.1 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 105.031 -2.211 . . . . 0.0 105.031 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.432 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 53.9 t -74.65 159.77 31.68 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.028 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -120.76 37.05 4.4 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.432 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 54.2 m-85 -137.5 -50.45 0.62 Allowed 'General case' 0 N--CA 1.496 1.872 0 CA-C-N 113.506 -1.679 . . . . 0.0 108.403 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -118.88 -124.35 0.28 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 103.942 -2.614 . . . . 0.0 103.942 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -157.06 48.95 0.44 Allowed 'General case' 0 N--CA 1.499 2.009 0 CA-C-O 121.483 0.659 . . . . 0.0 112.643 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.0 tt -109.23 160.33 16.2 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.711 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.2 mtp180 -117.4 145.51 44.05 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 123.844 0.715 . . . . 0.0 109.17 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.6 m -130.93 146.18 52.26 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 114.781 -1.099 . . . . 0.0 112.064 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -127.6 91.96 3.4 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 125.137 1.523 . . . . 0.0 107.934 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -122.42 -97.32 0.45 Allowed 'General case' 0 N--CA 1.501 2.113 0 CA-C-N 121.636 2.017 . . . . 0.0 110.067 0.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.575 ' N ' ' HB3' ' A' ' 16' ' ' SER . 79.7 p -144.37 63.99 1.31 Allowed 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.575 ' HB3' ' N ' ' A' ' 15' ' ' SER . 4.6 t 50.21 -155.31 0.12 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 117.224 -3.422 . . . . 0.0 112.848 0.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.442 HD22 ' N ' ' A' ' 17' ' ' ASN . 1.5 m120 -25.43 -30.15 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 118.592 2.812 . . . . 0.0 118.592 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -84.58 -59.91 2.22 Favored 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.434 ' C ' ' HD3' ' A' ' 19' ' ' LYS . 8.0 tmtm? -46.37 -48.96 18.47 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.4 p -63.39 -51.85 64.1 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 113.093 -1.867 . . . . 0.0 109.959 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -41.05 -58.11 1.84 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 76.0 mt -52.02 -63.21 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 124.356 1.035 . . . . 0.0 108.822 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -31.7 -42.0 0.05 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 125.201 1.563 . . . . 0.0 113.853 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 65.9 p -101.55 -42.82 6.1 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.24 -21.29 42.96 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -120.36 -37.17 3.08 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 123.704 0.627 . . . . 0.0 111.422 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.9 t . . . . . 0 N--CA 1.5 2.059 0 O-C-N 123.912 0.758 . . . . 0.0 111.464 -179.846 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 15' ' ' SER . 4.4 m-85 . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 103.975 -2.602 . . . . 0.0 103.975 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -132.15 160.43 36.07 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 119.401 -0.919 . . . . 0.0 113.283 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.433 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.5 t -102.44 149.96 23.85 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 114.029 -1.442 . . . . 0.0 108.676 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -120.93 41.78 3.21 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 124.209 0.943 . . . . 0.0 108.798 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.433 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 71.8 m-85 -131.66 -42.56 1.03 Allowed 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 113.55 -1.659 . . . . 0.0 109.944 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.7 p -116.07 -49.92 2.68 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 124.227 0.954 . . . . 0.0 111.7 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 144.39 -40.5 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.661 0 O-C-N 125.608 1.817 . . . . 0.0 109.612 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.5 tt -24.9 143.94 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 116.592 2.071 . . . . 0.0 116.592 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.7 ttt85 -124.35 145.89 49.16 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 113.469 -1.696 . . . . 0.0 106.987 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.6 p -124.87 164.43 20.07 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.81 0.94 20.63 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 123.836 0.71 . . . . 0.0 111.349 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -137.24 177.08 8.14 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 124.006 0.816 . . . . 0.0 110.355 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.487 ' HB2' ' CZ ' ' A' ' 3' ' ' TYR . 27.1 t -115.32 40.21 2.75 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.3 t -120.21 -49.87 2.27 Favored 'General case' 0 N--CA 1.496 1.825 0 CA-C-N 114.433 -1.258 . . . . 0.0 109.807 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -102.97 32.6 3.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.267 0.979 . . . . 0.0 110.905 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.469 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 2.7 tm? -109.21 -61.65 1.59 Allowed 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -46.29 -56.75 5.33 Favored 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 62.3 p -56.5 -45.14 81.16 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 112.767 -2.015 . . . . 0.0 110.407 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.469 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 82.4 t60 -43.77 -70.09 0.12 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 124.226 0.954 . . . . 0.0 110.796 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mp -47.5 -64.98 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.051 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -35.5 -52.37 0.65 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 68.0 p -114.99 26.94 9.76 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 116.694 2.109 . . . . 0.0 116.694 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.461 ' HA ' ' HE2' ' A' ' 25' ' ' LYS . 10.4 mmpt? -128.98 -32.77 2.04 Favored 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.7 m-70 -109.26 -27.76 9.37 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 124.168 0.917 . . . . 0.0 112.49 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.501 2.124 0 C-N-CA 118.685 -1.206 . . . . 0.0 108.958 179.777 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 24.4 m-85 . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -122.17 155.02 36.66 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.88 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.39 166.53 8.11 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.221 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -123.87 23.5 8.62 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.696 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.507 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 91.0 m-85 -139.57 -49.62 0.49 Allowed 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 115.721 1.749 . . . . 0.0 115.721 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.407 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 28.7 p -107.18 -64.36 1.2 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 118.218 -0.896 . . . . 0.0 112.889 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.407 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 14.3 pt-20 143.72 52.39 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.535 0 O-C-N 125.503 1.752 . . . . 0.0 110.927 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.7 tt -104.45 154.56 19.72 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.7 ptt85 -117.02 146.13 43.25 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 64.6 m -131.81 179.2 6.21 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 113.01 -1.904 . . . . 0.0 106.425 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -123.35 -38.17 2.59 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.953 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -125.33 165.34 18.53 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 124.25 0.969 . . . . 0.0 112.51 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 40.6 t -115.72 147.06 41.32 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 105.967 -1.864 . . . . 0.0 105.967 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 75.6 m -96.82 56.79 1.49 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 121.151 1.796 . . . . 0.0 112.15 0.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -98.39 12.97 33.24 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.0 -51.97 2.82 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 101.22 -3.622 . . . . 0.0 101.22 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -53.59 -46.23 70.27 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.9 m -43.33 -50.84 6.61 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 124.474 1.109 . . . . 0.0 110.598 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 54.2 t60 -58.69 -63.2 1.37 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.529 1.143 . . . . 0.0 108.968 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.5 mt -41.62 -61.96 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 O-C-N 125.053 1.471 . . . . 0.0 111.119 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -37.54 -63.83 0.43 Allowed 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.709 -1.587 . . . . 0.0 112.881 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.8 m -66.08 -45.26 81.89 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 120.873 3.657 . . . . 0.0 120.873 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -94.69 -7.53 40.44 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.507 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 68.9 m-70 -126.75 -37.1 2.17 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 77.8 p . . . . . 0 N--CA 1.501 2.098 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 179.877 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 . . . . . 0 N--CA 1.499 1.993 0 CA-C-O 120.493 0.187 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -135.22 161.25 35.91 Favored 'General case' 0 N--CA 1.501 2.082 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.476 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 52.9 t -99.85 141.99 31.92 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.217 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -118.45 44.45 2.25 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 124.56 1.163 . . . . 0.0 109.027 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.493 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 79.1 m-85 -129.27 -46.8 1.21 Allowed 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 113.173 -1.83 . . . . 0.0 106.707 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -118.04 -52.24 2.42 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 124.577 1.173 . . . . 0.0 111.015 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 147.82 -39.47 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.772 0 O-C-N 125.025 1.453 . . . . 0.0 112.248 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.6 tt -29.92 153.43 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 116.625 2.084 . . . . 0.0 116.625 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 62.7 mtt-85 -119.22 152.17 37.09 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.622 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.5 m -124.05 -162.87 1.1 Allowed 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 113.91 -1.496 . . . . 0.0 107.574 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.24 -63.71 1.3 Allowed 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -124.42 171.57 9.84 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 124.221 0.95 . . . . 0.0 109.455 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.1 t -47.72 -52.34 18.79 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.0 p -43.27 -50.89 6.46 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.901 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -68.68 -48.72 63.22 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.441 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.8 -50.07 14.46 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -49.74 -56.15 11.3 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 179.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.5 m -40.46 -55.58 2.24 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 124.863 1.352 . . . . 0.0 108.769 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -53.37 -68.18 0.2 Allowed 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 113.069 -1.878 . . . . 0.0 109.277 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.3 mm -39.48 -67.03 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 124.536 1.148 . . . . 0.0 110.922 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -36.6 -52.51 0.88 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 124.812 1.32 . . . . 0.0 114.344 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.6 p -108.79 37.76 2.45 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 116.083 1.882 . . . . 0.0 116.083 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -144.81 -36.62 0.31 Allowed 'General case' 0 N--CA 1.501 2.09 0 CA-C-O 121.262 0.553 . . . . 0.0 109.543 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -127.75 -61.17 1.13 Allowed 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 87.4 p . . . . . 0 N--CA 1.508 2.429 0 O-C-N 126.758 2.536 . . . . 0.0 110.166 179.917 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 . . . . . 0 N--CA 1.495 1.806 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.7 tp60 -120.76 157.67 29.18 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.799 1.312 . . . . 0.0 108.257 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.9 t -99.89 149.31 23.53 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -119.15 43.64 2.54 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 122.19 0.995 . . . . 0.0 110.593 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -133.23 -52.06 0.89 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 112.994 -1.912 . . . . 0.0 105.868 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.9 p -119.51 -124.49 0.28 Allowed 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 102.149 -3.278 . . . . 0.0 102.149 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -147.61 56.21 1.09 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 123.993 0.808 . . . . 0.0 108.927 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.472 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 24.2 tp -105.29 139.19 40.31 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.033 -1.067 . . . . 0.0 111.61 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.472 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -134.92 146.44 49.16 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.583 -1.644 . . . . 0.0 111.569 179.392 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.2 t -142.03 171.96 13.35 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 112.875 -1.966 . . . . 0.0 108.449 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.17 -12.79 25.76 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -121.66 -173.69 2.7 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 124.26 0.975 . . . . 0.0 108.55 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.7 t -119.19 -38.46 3.04 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.8 p -31.66 -46.12 0.1 Allowed 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.3 p30 -84.54 -36.82 21.89 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 119.017 -1.073 . . . . 0.0 109.969 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 23.6 tp -49.21 -41.61 37.63 Favored 'General case' 0 N--CA 1.503 2.22 0 CA-C-O 121.505 0.669 . . . . 0.0 109.837 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.7 tmtp? -51.97 -53.65 38.91 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -61.29 -52.94 62.6 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.118 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.411 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 70.1 t60 -35.41 -59.18 0.55 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.145 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 71.2 mt -53.06 -57.96 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-O 121.494 0.664 . . . . 0.0 109.361 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.436 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 4.1 ttmp? -45.61 -41.86 10.61 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.689 -1.141 . . . . 0.0 113.094 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -87.68 -37.83 16.38 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 121.276 3.806 . . . . 0.0 121.276 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.3 mtpt -108.11 0.1 21.42 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 115.141 1.534 . . . . 0.0 115.141 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 47.3 m-70 -125.52 -40.25 2.1 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.3 p . . . . . 0 N--CA 1.504 2.249 0 C-N-CA 119.543 -0.863 . . . . 0.0 111.286 179.834 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 -112.88 114.95 27.69 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 124.011 0.819 . . . . 0.0 109.058 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 53.2 t -23.31 -70.48 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.46 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 7.9 tt0 109.62 -23.06 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.723 0 O-C-N 126.094 2.122 . . . . 0.0 110.305 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -99.5 -52.65 3.43 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.436 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 29.7 p -103.55 -49.45 3.69 Favored 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 34.4 tt0 119.12 64.02 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 126.695 2.497 . . . . 0.0 109.236 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.406 HD13 ' ND1' ' A' ' 21' ' ' HIS . 9.1 tt -106.51 137.64 44.14 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 103.461 -2.792 . . . . 0.0 103.461 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 24.9 ttp85 -115.0 134.49 55.14 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 122.27 1.033 . . . . 0.0 113.604 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 t -129.41 179.3 5.87 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 112.135 -2.302 . . . . 0.0 106.16 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -117.06 -21.41 8.88 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.086 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -141.33 -172.38 3.5 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 124.337 1.023 . . . . 0.0 108.774 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 16' ' ' SER . 30.7 t -105.75 171.71 7.19 Favored 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 15' ' ' SER . 25.1 t 101.02 -31.13 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.795 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -106.48 -16.15 14.61 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-N 113.071 -1.877 . . . . 0.0 109.61 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.41 -55.13 2.46 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 104.503 -2.406 . . . . 0.0 104.503 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HG3' ' HE2' ' A' ' 23' ' ' LYS . 1.1 tppp? -50.7 -53.04 34.57 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 56.5 m -60.84 -50.35 73.8 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 114.31 -1.314 . . . . 0.0 108.44 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.406 ' ND1' HD13 ' A' ' 10' ' ' LEU . 39.2 t60 -40.6 -59.15 1.43 Allowed 'General case' 0 N--CA 1.503 2.206 0 O-C-N 124.091 0.87 . . . . 0.0 108.768 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.3 mt -54.15 -59.58 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 123.782 0.676 . . . . 0.0 109.786 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.406 ' HE2' ' HG3' ' A' ' 19' ' ' LYS . 22.1 mtmt -44.46 -28.97 0.63 Allowed 'General case' 0 N--CA 1.503 2.2 0 N-CA-C 114.779 1.399 . . . . 0.0 114.779 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.1 m -101.92 -40.91 6.68 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 118.138 2.644 . . . . 0.0 118.138 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -89.95 -14.93 33.06 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.9 m-70 -127.37 -46.55 1.47 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.0 t . . . . . 0 N--CA 1.495 1.801 0 O-C-N 124.423 1.077 . . . . 0.0 108.434 -179.739 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 . . . . . 0 N--CA 1.496 1.866 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.418 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 69.4 tp60 -121.23 158.1 28.81 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.418 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 40.4 t -105.75 139.14 40.78 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 104.772 -2.307 . . . . 0.0 104.772 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -113.58 47.12 1.19 Allowed 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 122.701 1.238 . . . . 0.0 109.747 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 67.0 m-85 -136.08 -55.64 0.76 Allowed 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 112.263 -2.244 . . . . 0.0 108.548 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -121.3 -117.22 0.31 Allowed 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.337 1.023 . . . . 0.0 110.189 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.2 mp0 -122.16 -49.73 2.05 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 tt -23.49 129.93 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 117.04 2.237 . . . . 0.0 117.04 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -131.77 145.56 51.66 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.5 m -128.56 173.9 9.85 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 123.869 0.73 . . . . 0.0 110.212 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.17 35.14 3.73 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -132.4 -62.92 0.81 Allowed 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.353 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.4 t 125.61 -58.4 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 104.274 -2.491 . . . . 0.0 104.274 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.6 m -44.97 -58.07 3.4 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 124.149 0.906 . . . . 0.0 110.378 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -46.91 -60.56 2.36 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 114.182 -1.372 . . . . 0.0 110.255 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.419 HD13 ' C ' ' A' ' 18' ' ' LEU . 3.0 tm? -50.99 -52.95 37.56 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.209 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -47.69 -55.95 8.36 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 121.093 0.473 . . . . 0.0 110.038 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.1 m -56.45 -47.37 79.28 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.059 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 37.4 t60 -50.4 -58.08 6.52 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 123.765 0.665 . . . . 0.0 109.654 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.6 mt -54.07 -60.34 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.48 -23.02 5.44 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 23.9 m -96.08 -45.16 7.0 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 117.725 2.491 . . . . 0.0 117.725 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -97.36 -7.25 32.33 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 56.6 m-70 -122.79 -48.09 2.04 Favored 'General case' 0 N--CA 1.501 2.11 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.077 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.95 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.4 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 65.4 tp60 -123.6 164.06 19.78 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.4 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 51.0 t -93.79 155.24 17.32 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -114.37 32.08 6.17 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 124.003 0.814 . . . . 0.0 109.665 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -137.26 -53.91 0.69 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 114.746 -1.116 . . . . 0.0 111.141 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.7 p -114.62 -116.64 0.32 Allowed 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.44 52.37 0.53 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.558 0.694 . . . . 0.0 111.801 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.2 tt -105.65 140.42 38.74 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.6 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -122.97 152.18 41.13 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 124.412 1.07 . . . . 0.0 109.952 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.2 p -140.14 179.02 6.87 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.613 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -103.35 -43.92 5.3 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.021 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -109.68 -168.01 1.27 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 124.35 1.032 . . . . 0.0 110.339 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 p -97.51 -45.65 6.34 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.802 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.1 m -40.46 -52.07 2.81 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -80.23 1.92 26.51 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -107.29 -46.78 3.8 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.484 ' HG3' ' N ' ' A' ' 20' ' ' THR . 0.2 OUTLIER -55.84 -49.48 73.2 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.598 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.484 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 8.8 t -51.47 -40.98 60.55 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 123.645 0.591 . . . . 0.0 110.417 179.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.3 t60 -59.88 -66.24 0.55 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.8 mt -46.29 -53.55 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-O 121.256 0.551 . . . . 0.0 109.944 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -38.55 -48.28 1.4 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.936 -1.484 . . . . 0.0 114.058 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 44.9 p -110.07 -9.23 14.73 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -102.69 -22.54 13.93 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -127.82 -38.03 1.89 Allowed 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.503 2.211 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 -179.375 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.4 m-30 . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.573 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 64.7 tp60 -125.7 170.35 11.62 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 114.646 -1.161 . . . . 0.0 108.816 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.573 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 32.5 t -104.52 -54.51 2.51 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.502 ' H ' HE21 ' A' ' 4' ' ' GLN . 5.6 tt0 80.63 16.3 0.64 Allowed 'General case' 0 N--CA 1.505 2.294 0 O-C-N 125.252 1.595 . . . . 0.0 109.793 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -126.78 -45.71 1.59 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 118.974 -0.536 . . . . 0.0 112.404 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 p -116.16 -117.59 0.32 Allowed 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -140.27 28.09 2.08 Favored 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.7 tt -109.25 155.13 21.48 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.62 157.06 39.91 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 105.553 -2.017 . . . . 0.0 105.553 179.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -126.34 168.2 14.47 Favored 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 120.661 -0.416 . . . . 0.0 109.968 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.58 -52.49 2.76 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 124.01 0.819 . . . . 0.0 110.387 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -109.36 155.04 21.7 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 122.049 0.928 . . . . 0.0 110.347 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.417 ' C ' ' HZ3' ' A' ' 19' ' ' LYS . 50.1 m -49.57 -56.42 10.0 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 113.141 -1.845 . . . . 0.0 110.802 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.4 t -45.95 -62.67 1.22 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 124.545 1.153 . . . . 0.0 110.025 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -43.2 -58.19 2.62 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 124.417 1.073 . . . . 0.0 111.701 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.403 ' C ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -52.88 -57.04 11.58 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.417 ' HZ3' ' C ' ' A' ' 15' ' ' SER . 38.3 mtmm -53.17 -49.3 66.93 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 119.819 -0.752 . . . . 0.0 109.829 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 67.1 m -53.39 -50.98 64.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 124.033 0.833 . . . . 0.0 109.029 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -51.02 -58.77 5.21 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.281 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.0 mt -57.39 -26.07 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.62 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.463 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.05 -48.23 25.02 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.749 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.9 p -85.33 -29.15 24.75 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -101.55 -22.29 14.53 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 123.762 0.664 . . . . 0.0 110.569 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -131.68 33.69 3.98 Favored 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 119.018 -1.073 . . . . 0.0 113.099 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.0 p . . . . . 0 N--CA 1.513 2.682 0 O-C-N 124.413 1.07 . . . . 0.0 113.634 179.685 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 . . . . . 0 N--CA 1.496 1.852 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.457 HE21 ' HE ' ' A' ' 11' ' ' ARG . 2.2 tt0 -125.58 177.06 6.44 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.428 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.429 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 51.0 t -106.46 161.87 14.21 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.201 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -118.9 29.72 7.56 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 124.132 0.895 . . . . 0.0 108.895 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -137.19 -49.84 0.62 Allowed 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.063 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 9' ' ' GLU . 30.0 p -114.75 -48.78 2.83 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 124.093 0.871 . . . . 0.0 110.991 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 31.2 mm-40 129.56 -2.51 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.918 0 C-N-CA 127.054 2.142 . . . . 0.0 113.389 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -44.83 135.36 5.16 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 124.082 0.864 . . . . 0.0 109.314 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.457 ' HE ' HE21 ' A' ' 4' ' ' GLN . 4.6 ptp180 -124.03 144.55 49.77 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 124.396 1.06 . . . . 0.0 112.737 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.3 t -126.98 -176.01 3.59 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-N 112.649 -2.069 . . . . 0.0 107.926 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.5 -9.2 12.1 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.303 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -135.74 -177.0 4.48 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 124.478 1.111 . . . . 0.0 111.782 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.5 m -113.61 38.87 2.8 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.031 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.7 t -117.71 -54.49 2.35 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 104.945 -2.243 . . . . 0.0 104.945 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -75.42 -43.03 52.1 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 113.514 -1.675 . . . . 0.0 109.385 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.54 -53.28 60.14 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.165 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.461 ' C ' ' HD3' ' A' ' 19' ' ' LYS . 13.1 tmtt? -50.31 -60.29 3.13 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 120.191 -0.603 . . . . 0.0 109.576 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.4 p -52.36 -42.27 63.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 123.804 0.69 . . . . 0.0 112.436 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -49.69 -62.65 1.44 Allowed 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.33 179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.54 HD12 ' H ' ' A' ' 22' ' ' ILE . 2.9 mp -50.07 -59.62 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 O-C-N 123.737 0.648 . . . . 0.0 110.473 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -36.58 -51.82 0.85 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 23.1 m -85.37 -42.6 14.4 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 119.358 3.095 . . . . 0.0 119.358 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.59 -8.34 56.38 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.16 0.913 . . . . 0.0 112.867 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -150.18 70.65 1.04 Allowed 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 102.506 -3.146 . . . . 0.0 102.506 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.7 p . . . . . 0 N--CA 1.501 2.075 0 O-C-N 118.702 -2.498 . . . . 0.0 109.757 0.401 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 N--CA 1.501 2.097 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.528 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 31.6 tt0 -121.75 173.97 7.13 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 124.995 1.434 . . . . 0.0 107.63 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.528 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 48.0 t -100.7 163.36 12.37 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.66 25.96 9.42 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 124.219 0.949 . . . . 0.0 109.676 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.482 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 63.2 m-85 -123.35 -53.83 1.8 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 107.243 -1.392 . . . . 0.0 107.243 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -118.04 -121.23 0.3 Allowed 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 104.116 -2.55 . . . . 0.0 104.116 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -159.42 51.28 0.35 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.541 0.686 . . . . 0.0 109.824 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.3 tt -106.48 158.51 16.86 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.938 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -118.95 161.75 19.67 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.193 0.997 . . . . 0.0 113.539 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.8 m -125.23 -158.81 0.85 Allowed 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 112.537 -2.119 . . . . 0.0 110.225 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.79 -55.0 2.54 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.8 p-10 -122.15 -43.95 2.3 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 116.121 1.896 . . . . 0.0 116.121 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.6 p 156.02 -49.49 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.8 p -47.09 -42.7 19.37 Favored 'General case' 0 N--CA 1.507 2.398 0 CA-C-O 121.51 0.672 . . . . 0.0 109.305 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -67.78 -47.52 68.95 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -46.13 -45.53 16.58 Favored 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 179.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -51.59 -59.65 4.03 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 124.314 1.009 . . . . 0.0 108.837 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.6 p -51.4 -46.27 62.8 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 124.111 0.882 . . . . 0.0 110.916 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -48.47 -66.69 0.36 Allowed 'General case' 0 N--CA 1.502 2.141 0 C-N-CA 119.811 -0.755 . . . . 0.0 109.02 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.1 mt -48.94 -55.74 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 124.264 0.978 . . . . 0.0 111.499 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -33.25 -57.72 0.4 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 125.193 1.558 . . . . 0.0 113.996 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 50.2 m -115.07 48.11 1.2 Allowed 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 122.233 1.016 . . . . 0.0 113.406 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -145.31 -39.1 0.25 Allowed 'General case' 0 N--CA 1.5 2.073 0 CA-C-N 114.664 -1.153 . . . . 0.0 109.539 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -121.36 -40.33 2.59 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 114.152 -1.385 . . . . 0.0 111.575 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 73.2 p . . . . . 0 N--CA 1.5 2.071 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -179.401 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.438 ' HG3' ' H ' ' A' ' 6' ' ' GLN . 4.1 tp-100 -124.28 156.22 37.29 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 124.425 1.078 . . . . 0.0 111.017 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 14.7 t -107.09 -17.87 14.05 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 114.435 -1.257 . . . . 0.0 113.819 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.438 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 9.7 pt20 40.89 30.39 0.09 Allowed 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 116.374 1.991 . . . . 0.0 116.374 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -135.43 -59.93 0.76 Allowed 'General case' 0 N--CA 1.504 2.259 0 N-CA-C 106.055 -1.831 . . . . 0.0 106.055 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.448 ' SG ' ' HB2' ' A' ' 10' ' ' LEU . 17.8 p -118.45 29.57 7.69 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 105.396 -2.076 . . . . 0.0 105.396 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 24.72 55.03 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 112.646 -2.07 . . . . 0.0 112.373 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.448 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 4.3 tp -90.96 146.42 23.89 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 104.132 -2.544 . . . . 0.0 104.132 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -114.35 149.32 36.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 124.325 1.016 . . . . 0.0 109.151 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.6 t -138.9 170.97 15.02 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.116 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.62 -4.59 10.28 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 125.137 1.523 . . . . 0.0 108.817 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -127.47 169.8 13.27 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.5 p -104.99 -45.79 4.45 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 124.206 0.942 . . . . 0.0 112.744 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.425 ' HA ' ' NZ ' ' A' ' 19' ' ' LYS . 22.7 t -50.39 -53.35 29.9 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 122.071 0.939 . . . . 0.0 112.528 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.0 p-10 -60.33 -30.17 69.34 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.38 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -72.15 -53.41 12.78 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 118.862 -0.589 . . . . 0.0 110.19 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.443 ' HG3' ' N ' ' A' ' 20' ' ' THR . 17.6 pttm -52.15 -48.12 65.09 Favored 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.21 -1.396 . . . . 0.0 109.73 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.443 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 41.1 p -62.29 -51.06 69.2 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.743 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.477 ' CE1' ' HD2' ' A' ' 25' ' ' LYS . 68.1 t60 -38.11 -59.51 0.85 Allowed 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.031 0.443 . . . . 0.0 110.192 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 86.0 mt -54.64 -59.65 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.654 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -40.67 -42.78 1.8 Allowed 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.5 t -101.35 -19.86 15.44 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 120.107 3.373 . . . . 0.0 120.107 -179.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.477 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 47.0 mttp -106.51 -14.62 15.01 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -122.75 -46.22 2.13 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 120.318 -0.553 . . . . 0.0 112.296 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.3 p . . . . . 0 N--CA 1.504 2.264 0 C-N-CA 118.146 -1.422 . . . . 0.0 108.178 179.952 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.406 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 4.9 m-85 . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.563 HE22 ' N ' ' A' ' 6' ' ' GLN . 8.6 tm0? -141.24 167.54 21.93 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 41.8 t -105.33 -68.61 0.85 Allowed 'General case' 0 N--CA 1.504 2.257 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.945 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.563 ' N ' HE22 ' A' ' 4' ' ' GLN . 3.1 tp-100 107.42 -27.09 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.572 0 O-C-N 125.816 1.947 . . . . 0.0 109.955 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -83.38 -46.02 13.03 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.768 0.668 . . . . 0.0 110.511 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -115.53 -40.85 3.33 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 109.42 49.03 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.176 0 O-C-N 126.887 2.617 . . . . 0.0 110.643 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.556 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 44.2 tp -98.39 158.97 15.25 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.556 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 55.7 mtt-85 -121.54 -176.91 3.41 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.297 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.442 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 24.0 t -141.24 -70.83 0.36 Allowed 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.738 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.442 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 108.49 -20.09 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.546 0 O-C-N 125.909 2.006 . . . . 0.0 109.047 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.459 ' O ' ' CB ' ' A' ' 15' ' ' SER . 3.6 p-10 -119.29 -45.42 2.54 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.459 ' CB ' ' O ' ' A' ' 14' ' ' ASP . 37.5 t 121.85 -51.02 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.878 0 C-N-CA 126.016 1.727 . . . . 0.0 109.596 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.1 t -47.85 -52.46 19.04 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.846 0.831 . . . . 0.0 111.922 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.437 HD22 ' N ' ' A' ' 17' ' ' ASN . 1.9 m120 -64.71 2.71 0.63 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-N 112.714 -2.039 . . . . 0.0 114.379 -179.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -106.52 -52.03 2.85 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 103.533 -2.766 . . . . 0.0 103.533 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.4 mtmm -54.29 -54.45 40.09 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.294 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.5 t -62.99 -39.71 95.55 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 123.79 0.682 . . . . 0.0 109.259 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.429 ' CG ' HD23 ' A' ' 10' ' ' LEU . 13.8 t60 -51.01 -63.3 1.17 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 123.996 0.81 . . . . 0.0 109.219 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.6 mt -46.84 -59.83 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.452 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -49.48 -31.99 11.18 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -93.4 -41.1 10.01 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 118.067 2.617 . . . . 0.0 118.067 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -92.29 -15.24 27.68 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 -121.28 -43.48 2.42 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 123.444 0.465 . . . . 0.0 111.243 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.503 2.188 0 CA-C-O 122.112 0.958 . . . . 0.0 109.116 179.941 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 . . . . . 0 N--CA 1.492 1.668 1 N-CA-C 99.966 -4.087 . . . . 0.0 99.966 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 24.2 tt0 -107.73 161.67 14.67 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.606 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.513 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 36.0 t -87.0 162.61 17.54 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 113.163 -1.835 . . . . 0.0 108.632 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -122.73 36.79 4.56 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 124.297 0.998 . . . . 0.0 110.582 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 52.1 m-85 -136.08 -49.48 0.68 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.708 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 9' ' ' GLU . 27.3 p -111.82 -63.62 1.4 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.765 1.291 . . . . 0.0 110.605 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.484 ' HB3' ' O ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER 135.55 41.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.532 0 O-C-N 126.004 2.065 . . . . 0.0 108.932 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.469 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 49.7 tp -83.4 157.03 22.65 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.523 HH11 ' H ' ' A' ' 13' ' ' ALA . 10.9 ttp85 -119.55 119.53 34.07 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 125.279 1.612 . . . . 0.0 107.696 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -132.88 77.1 1.72 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.523 ' H ' HH11 ' A' ' 11' ' ' ARG . . . -75.75 68.55 2.33 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 122.717 1.246 . . . . 0.0 112.658 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -139.19 -61.35 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.567 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p 127.3 -62.1 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.476 0 O-C-N 126.803 2.564 . . . . 0.0 109.865 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 m -57.59 -54.92 41.46 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 121.49 0.662 . . . . 0.0 109.364 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -42.52 -51.73 4.97 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.605 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -56.62 -54.69 43.07 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.034 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -43.47 -59.04 2.31 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 124.105 0.878 . . . . 0.0 111.718 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.8 t -60.56 -48.42 81.85 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 117.373 -1.299 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -40.31 -64.55 0.5 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.427 1.012 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.4 mt -43.66 -64.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 124.606 1.191 . . . . 0.0 113.956 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -58.72 -32.6 69.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.7 p -104.14 23.98 12.17 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.8 mmmm -142.02 -28.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.416 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 85.9 m-70 -119.29 -56.21 2.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 124.828 1.33 . . . . 0.0 108.651 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.501 2.079 0 O-C-N 126.092 2.12 . . . . 0.0 107.948 -179.985 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 . . . . . 0 N--CA 1.492 1.668 1 N-CA-C 99.966 -4.087 . . . . 0.0 99.966 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 24.2 tt0 -107.73 161.67 14.67 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.606 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.513 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 36.0 t -87.0 162.61 17.54 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 113.163 -1.835 . . . . 0.0 108.632 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -122.73 36.79 4.56 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 124.297 0.998 . . . . 0.0 110.582 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 52.1 m-85 -136.08 -49.48 0.68 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.708 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 9' ' ' GLU . 27.3 p -111.82 -63.62 1.4 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.765 1.291 . . . . 0.0 110.605 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.484 ' HB3' ' O ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER 135.55 41.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.532 0 O-C-N 126.004 2.065 . . . . 0.0 108.932 -179.808 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.469 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 49.7 tp -83.4 157.03 22.65 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.523 HH11 ' H ' ' A' ' 13' ' ' ALA . 10.9 ttp85 -119.55 119.53 34.07 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 125.279 1.612 . . . . 0.0 107.696 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -132.88 77.1 1.72 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.523 ' H ' HH11 ' A' ' 11' ' ' ARG . . . -75.75 68.55 2.33 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 122.717 1.246 . . . . 0.0 112.658 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -139.19 -61.35 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.567 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p 127.3 -62.1 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.476 0 O-C-N 126.803 2.564 . . . . 0.0 109.865 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 m -57.59 -54.92 41.46 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 121.49 0.662 . . . . 0.0 109.364 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -42.52 -51.73 4.97 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.605 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -56.62 -54.69 43.07 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.034 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -43.47 -59.04 2.31 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 124.105 0.878 . . . . 0.0 111.718 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.8 t -60.56 -48.42 81.85 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 117.373 -1.299 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -40.31 -64.55 0.5 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.427 1.012 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.4 mt -43.66 -64.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 124.606 1.191 . . . . 0.0 113.956 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -58.72 -32.6 69.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -179.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.7 p -104.14 23.98 12.17 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.8 mmmm -142.02 -28.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.416 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 85.9 m-70 -119.29 -56.21 2.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 124.828 1.33 . . . . 0.0 108.651 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.501 2.079 0 O-C-N 126.092 2.12 . . . . 0.0 107.948 -179.985 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 104.207 -2.516 . . . . 0.0 104.207 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -124.96 144.56 50.3 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 125.591 1.807 . . . . 0.0 108.565 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.0 t -63.38 163.16 11.15 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 114.24 -1.346 . . . . 0.0 113.211 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -126.28 38.88 4.05 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.519 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 80.8 m-85 -139.47 -47.58 0.47 Allowed 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 114.331 -1.304 . . . . 0.0 112.325 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.8 p -109.69 -65.37 1.16 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 124.037 0.836 . . . . 0.0 112.465 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 140.14 41.73 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.596 0 C-N-CA 126.487 1.915 . . . . 0.0 110.264 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.442 HD23 ' C ' ' A' ' 10' ' ' LEU . 6.8 tt -101.18 131.05 47.34 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.7 ptt85 -123.6 150.18 44.43 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 123.891 0.744 . . . . 0.0 110.032 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.557 ' CB ' HD21 ' A' ' 17' ' ' ASN . 53.7 p -128.25 -55.93 1.25 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 124.182 0.926 . . . . 0.0 112.076 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 118.03 -18.54 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.781 0 O-C-N 125.725 1.891 . . . . 0.0 109.542 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -129.3 -178.86 4.84 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.09 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.7 t -111.44 176.65 4.94 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.361 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.3 m 99.73 -52.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.549 0 C-N-CA 126.07 1.748 . . . . 0.0 106.691 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.557 HD21 ' CB ' ' A' ' 12' ' ' SER . 8.7 p-10 -79.86 -51.47 9.1 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.106 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.9 tp -60.87 -42.83 98.68 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.177 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -52.55 -60.5 3.16 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 61.0 m -48.54 -57.46 6.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 124.984 1.427 . . . . 0.0 109.907 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -40.08 -71.23 0.08 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 124.828 1.33 . . . . 0.0 110.926 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -47.42 -63.04 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.399 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -39.03 -53.68 1.76 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.0 t -106.02 5.65 30.52 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 118.022 2.601 . . . . 0.0 118.022 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -113.6 -25.33 8.77 Favored 'General case' 0 N--CA 1.504 2.27 0 CA-C-N 118.241 0.473 . . . . 0.0 111.645 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.519 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 62.4 m-70 -115.72 -40.25 3.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 123.928 0.768 . . . . 0.0 112.793 -179.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.497 1.887 0 O-C-N 124.087 0.867 . . . . 0.0 111.563 -179.756 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 121.856 0.836 . . . . 0.0 112.148 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.417 ' HG3' ' H ' ' A' ' 5' ' ' CYS . 56.5 tp60 -120.52 179.18 4.4 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 112.374 -2.194 . . . . 0.0 106.204 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.417 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 44.5 t -106.01 169.13 8.67 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -116.6 25.43 10.59 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 123.981 0.801 . . . . 0.0 109.789 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -141.39 -52.46 0.45 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.439 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.5 p -117.67 -125.91 0.28 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.74 25.56 3.38 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.834 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.673 HD22 ' H ' ' A' ' 11' ' ' ARG . 1.3 tm? -69.19 164.41 22.7 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.099 -1.04 . . . . 0.0 108.323 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.673 ' H ' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -132.68 147.9 52.34 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 112.507 -2.133 . . . . 0.0 108.256 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.43 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 68.9 m -126.34 -32.27 2.71 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -179.435 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.43 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 112.02 -53.29 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.487 0 O-C-N 126.307 2.254 . . . . 0.0 105.122 -179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.405 ' CG ' ' H ' ' A' ' 15' ' ' SER . 35.1 t70 -137.02 -172.19 3.13 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 113.831 -1.531 . . . . 0.0 107.13 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.405 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 43.1 t -101.61 51.08 0.84 Allowed 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.6 t -122.98 -36.95 2.79 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 112.096 -2.32 . . . . 0.0 106.825 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.9 m-20 -106.36 -1.98 22.72 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.885 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 tp -85.39 -51.69 6.38 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -43.48 -47.74 7.2 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.164 0.915 . . . . 0.0 109.697 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.8 p -59.76 -59.43 5.44 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.233 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.405 ' CE1' ' HG ' ' A' ' 10' ' ' LEU . 51.7 t60 -41.98 -53.5 3.84 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 123.63 0.581 . . . . 0.0 109.555 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 67.2 mt -53.08 -58.95 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 123.995 0.809 . . . . 0.0 111.429 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -45.87 -39.38 8.53 Favored 'General case' 0 N--CA 1.504 2.267 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.9 m -92.35 -38.89 11.78 Favored 'General case' 0 N--CA 1.506 2.341 0 N-CA-C 119.08 2.992 . . . . 0.0 119.08 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -98.3 -6.72 30.39 Favored 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.9 m-70 -129.33 -47.93 1.19 Allowed 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.2 p . . . . . 0 N--CA 1.51 2.536 0 O-C-N 125.867 1.979 . . . . 0.0 113.408 -179.808 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.7 m-85 . . . . . 0 N--CA 1.502 2.162 0 N-CA-C 106.231 -1.766 . . . . 0.0 106.231 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -106.77 171.81 7.16 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 123.37 0.419 . . . . 0.0 110.294 -179.683 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 40.5 t -98.64 166.15 11.47 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 123.292 0.37 . . . . 0.0 111.638 -179.692 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -121.32 27.8 8.14 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 124.163 0.914 . . . . 0.0 110.996 -179.704 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -134.76 -51.89 0.79 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.132 -179.706 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 32.1 p -109.37 -46.24 3.59 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.243 0.965 . . . . 0.0 111.673 -179.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 135.9 -52.03 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.323 0 O-C-N 125.935 2.022 . . . . 0.0 108.386 -179.848 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.5 tt -22.06 130.7 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.461 0 O-C-N 125.377 1.673 . . . . 0.0 113.892 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -111.76 168.18 9.77 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.18 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.7 m -125.37 178.6 5.52 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-N 112.103 -2.317 . . . . 0.0 108.512 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.43 -31.39 10.94 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.281 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -117.36 -160.34 0.77 Allowed 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.682 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.9 p -99.87 -55.89 2.52 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 t -43.75 -50.03 7.82 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 124.085 0.866 . . . . 0.0 110.689 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -49.5 -61.2 2.23 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 114.295 -1.32 . . . . 0.0 110.615 179.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.08 -52.94 62.5 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.825 -179.911 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -40.61 -56.39 2.12 Favored 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 121.848 0.832 . . . . 0.0 109.341 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 87.4 m -55.61 -58.48 7.64 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 113.357 -1.747 . . . . 0.0 109.32 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -39.35 -60.78 0.87 Allowed 'General case' 0 N--CA 1.506 2.34 0 O-C-N 124.318 1.012 . . . . 0.0 109.915 179.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.1 mm -48.27 -66.51 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.127 179.743 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -38.67 -46.2 1.2 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.6 t -93.32 -31.92 14.49 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 119.475 3.139 . . . . 0.0 119.475 -179.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -93.83 -17.1 23.44 Favored 'General case' 0 N--CA 1.503 2.179 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.772 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -122.55 -45.62 2.18 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 123.525 0.516 . . . . 0.0 111.525 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.1 p . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -179.851 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.407 ' CE2' ' HB2' ' A' ' 15' ' ' SER . 19.3 m-85 . . . . . 0 N--CA 1.504 2.229 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.5 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 7.4 tt0 -126.68 169.71 12.86 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 179.69 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.511 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 51.5 t -100.84 154.54 18.56 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.758 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -127.04 42.99 3.21 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.511 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 63.9 m-85 -133.93 -51.17 0.84 Allowed 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 113.182 -1.827 . . . . 0.0 108.321 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 9' ' ' GLU . 22.1 p -112.94 -52.98 2.75 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.547 1.154 . . . . 0.0 109.972 179.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 4.1 tm-20 148.79 -46.93 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.568 0 O-C-N 125.609 1.818 . . . . 0.0 107.813 -179.685 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.429 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 0.9 OUTLIER -20.64 149.88 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.555 0 N-CA-C 116.693 2.108 . . . . 0.0 116.693 -179.845 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.429 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 2.3 ptm180 -106.1 155.54 19.32 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.226 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.2 t -134.63 159.37 41.43 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 114.165 -1.38 . . . . 0.0 107.839 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.14 -63.62 1.02 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 179.814 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -137.0 169.92 16.97 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 120.45 -0.5 . . . . 0.0 109.696 179.69 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.407 ' HB2' ' CE2' ' A' ' 3' ' ' TYR . 39.3 t -47.77 -51.73 21.3 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 179.567 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 87.0 p -35.09 -37.38 0.07 Allowed 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 111.62 -2.537 . . . . 0.0 113.983 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -97.83 -48.4 5.2 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 124.255 0.972 . . . . 0.0 109.529 -179.783 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.9 tp -39.2 -47.3 1.61 Allowed 'General case' 0 N--CA 1.503 2.217 0 CA-C-O 122.044 0.926 . . . . 0.0 111.147 179.548 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -42.64 -48.21 5.42 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.62 179.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.8 p -73.9 -41.94 61.38 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.851 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -43.98 -56.05 4.22 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 179.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.8 mt -49.6 -66.03 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-N 113.706 -1.588 . . . . 0.0 108.986 179.52 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -32.8 -43.46 0.09 Allowed 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 179.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 51.1 m -89.26 -45.56 9.43 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.148 2.647 . . . . 0.0 118.148 -179.539 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.41 ' HB3' ' NZ ' ' A' ' 25' ' ' LYS . 3.5 mmmp? -83.89 -18.08 38.63 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 -179.332 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -124.28 -105.14 0.36 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 123.611 0.569 . . . . 0.0 111.067 -179.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 54.6 m . . . . . 0 N--CA 1.501 2.114 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -179.868 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 101.713 -3.44 . . . . 0.0 101.713 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -106.51 162.75 13.45 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -179.402 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 38.9 t -72.82 165.98 23.82 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 114.033 -1.44 . . . . 0.0 112.158 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -125.16 24.63 7.41 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.265 -179.918 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -127.5 -47.9 1.42 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.135 -179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.441 ' SG ' ' N ' ' A' ' 9' ' ' GLU . 30.5 p -116.02 -114.72 0.33 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.441 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 16.0 tp10 -136.81 -40.08 0.62 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 123.761 0.663 . . . . 0.0 112.442 -179.794 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -28.77 136.22 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -179.561 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.7 ptp180 -128.83 158.35 38.95 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.4 179.458 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -114.41 -163.13 0.85 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 105.308 -2.108 . . . . 0.0 105.308 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.47 -48.48 2.87 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -132.64 175.79 9.01 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 113.991 -1.459 . . . . 0.0 107.411 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.2 p -38.6 -36.97 0.28 Allowed 'General case' 0 N--CA 1.508 2.462 0 CA-C-O 122.789 1.28 . . . . 0.0 109.659 179.337 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 17' ' ' ASN . 27.8 m -108.27 134.22 51.4 Favored 'General case' 0 C--N 1.308 -1.207 1 N-CA-C 98.925 -4.472 . . . . 0.0 98.925 179.798 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.531 ' H ' HD22 ' A' ' 17' ' ' ASN . 0.0 OUTLIER -104.5 65.25 0.77 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 118.877 -2.389 . . . . 0.0 113.32 0.49 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.8 tp -99.82 -50.93 3.87 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-N 113.485 -1.689 . . . . 0.0 107.34 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -36.64 -61.13 0.55 Allowed 'General case' 0 N--CA 1.507 2.392 0 O-C-N 124.082 0.863 . . . . 0.0 110.649 179.454 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.8 t -47.93 -49.72 29.21 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 113.833 -1.53 . . . . 0.0 111.539 179.767 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.454 ' ND1' ' HD2' ' A' ' 25' ' ' LYS . 74.6 t60 -48.88 -71.66 0.06 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 124.033 0.833 . . . . 0.0 110.788 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 51.3 mt -43.46 -48.47 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 124.362 1.039 . . . . 0.0 112.339 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -56.96 -55.98 27.66 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 92.8 m -79.59 -32.59 41.96 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 119.642 3.201 . . . . 0.0 119.642 -179.256 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.454 ' HD2' ' ND1' ' A' ' 21' ' ' HIS . 53.4 mttp -96.84 -11.71 24.49 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -179.312 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -129.44 -59.86 1.07 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.505 2.323 0 O-C-N 123.903 0.752 . . . . 0.0 111.21 -179.845 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 . . . . . 0 N--CA 1.495 1.804 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -129.41 166.92 18.61 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 39.8 t -83.85 161.18 20.99 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -122.95 32.98 5.53 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 123.771 0.669 . . . . 0.0 110.575 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -137.21 -42.24 0.57 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.997 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.8 p -110.77 -59.52 1.95 Allowed 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 160.74 -46.85 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.327 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -27.5 148.33 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 O-C-N 125.634 1.834 . . . . 0.0 115.123 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.6 ttm-85 -109.99 153.82 24.02 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.767 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.7 p -124.55 -174.91 3.13 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 179.949 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.05 -61.81 1.69 Allowed 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 120.557 -0.457 . . . . 0.0 109.906 -179.973 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.719 ' H ' HD21 ' A' ' 17' ' ' ASN . 39.4 m-20 -125.48 177.12 6.37 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 124.368 1.042 . . . . 0.0 112.159 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.6 t -94.99 46.62 1.13 Allowed 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 122.93 1.348 . . . . 0.0 110.629 -179.689 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.407 ' H ' ' H ' ' A' ' 17' ' ' ASN . 92.0 p -128.53 -28.38 2.52 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 112.672 -2.058 . . . . 0.0 105.979 179.572 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.719 HD21 ' H ' ' A' ' 14' ' ' ASP . 1.1 p30 -107.09 -49.43 3.28 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 113.042 -1.89 . . . . 0.0 110.894 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 62.1 tp -40.82 -45.11 2.4 Favored 'General case' 0 N--CA 1.509 2.485 0 CA-C-N 117.977 0.353 . . . . 0.0 111.25 179.778 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -49.71 -60.79 2.56 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.949 179.624 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.5 t -50.47 -43.14 55.28 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 124.219 0.949 . . . . 0.0 111.286 -179.723 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -55.45 -64.14 0.94 Allowed 'General case' 0 N--CA 1.5 2.073 0 O-C-N 124.25 0.969 . . . . 0.0 109.273 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -49.41 -63.43 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.002 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -38.91 -33.15 0.1 Allowed 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -179.932 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.1 m -97.1 -44.08 7.12 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 118.283 2.697 . . . . 0.0 118.283 -179.383 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -91.37 -12.97 33.33 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 115.286 1.588 . . . . 0.0 115.286 -179.366 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -127.2 -40.79 1.81 Allowed 'General case' 0 N--CA 1.496 1.87 0 O-C-N 123.733 0.645 . . . . 0.0 110.951 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 t . . . . . 0 N--CA 1.497 1.898 0 CA-C-N 114.15 -1.386 . . . . 0.0 108.002 -179.75 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 105.375 -2.083 . . . . 0.0 105.375 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.403 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 51.3 tt0 -122.81 173.66 7.62 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-N 111.196 -2.729 . . . . 0.0 106.286 179.763 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.548 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 51.1 t -97.43 156.93 16.26 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.631 -179.868 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -121.46 37.08 4.43 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 124.268 0.98 . . . . 0.0 109.355 -179.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -133.12 -50.4 0.88 Allowed 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.093 -1.412 . . . . 0.0 109.043 179.867 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 27.5 p -113.25 -51.77 2.8 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 124.509 1.131 . . . . 0.0 108.431 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 33.7 tt0 112.97 61.08 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.599 0 O-C-N 126.305 2.253 . . . . 0.0 110.79 179.799 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.548 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 8.2 tt -107.37 135.66 48.48 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 104.642 -2.355 . . . . 0.0 104.642 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.401 ' HA ' ' HA ' ' A' ' 4' ' ' GLN . 19.1 ttt180 -115.16 147.72 39.91 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-O 121.838 0.828 . . . . 0.0 111.301 -179.906 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 62.2 m -118.64 -48.35 2.49 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-N 112.859 -1.973 . . . . 0.0 106.201 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.415 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 108.77 -38.22 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.431 0 O-C-N 126.633 2.458 . . . . 0.0 109.089 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -122.12 -176.67 3.4 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.978 -179.847 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.47 161.57 18.4 Favored 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 -179.985 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 71.0 m -112.2 41.07 2.05 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 123.014 2.643 . . . . 0.0 107.88 0.019 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -72.04 -41.7 67.16 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 103.085 -2.931 . . . . 0.0 103.085 179.743 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.4 tp -57.08 -51.89 67.48 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.434 179.527 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -45.38 -58.52 3.27 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 179.708 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.6 m -48.35 -56.86 7.01 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.213 179.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -45.31 -67.5 0.28 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.828 0.705 . . . . 0.0 109.701 179.642 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.8 mm -37.92 -57.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 124.622 1.201 . . . . 0.0 112.775 179.835 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -58.16 -40.27 80.97 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 63.9 p -88.41 -32.13 18.49 Favored 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -179.592 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -92.77 -24.74 18.46 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 123.73 0.644 . . . . 0.0 110.895 -179.943 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -127.55 29.77 5.45 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 123.892 0.745 . . . . 0.0 111.881 179.979 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.8 t . . . . . 0 N--CA 1.504 2.27 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 179.372 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.426 ' CE2' ' HA ' ' A' ' 15' ' ' SER . 7.2 m-85 . . . . . 0 N--CA 1.492 1.632 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.497 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 1.6 tt0 -113.61 -170.68 1.74 Allowed 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 103.853 -2.647 . . . . 0.0 103.853 179.579 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.497 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 50.1 t -107.04 158.35 17.12 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -122.9 36.09 4.73 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 179.807 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.422 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 86.3 m-85 -137.94 -54.78 0.66 Allowed 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 113.961 -1.472 . . . . 0.0 108.779 179.966 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.3 p -117.6 -129.38 0.29 Allowed 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 102.302 -3.222 . . . . 0.0 102.302 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -147.64 52.2 1.05 Allowed 'General case' 0 N--CA 1.501 2.089 0 O-C-N 123.692 0.62 . . . . 0.0 111.967 -179.696 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.9 tt -107.62 148.87 28.76 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.23 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -107.04 145.27 32.56 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 124.585 1.178 . . . . 0.0 108.005 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.407 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 58.3 m -114.9 -43.51 3.11 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.754 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.407 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 110.15 -60.76 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.291 0 O-C-N 126.55 2.406 . . . . 0.0 105.621 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -135.9 162.47 32.75 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.859 1.35 . . . . 0.0 110.283 179.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.426 ' HA ' ' CE2' ' A' ' 3' ' ' TYR . 1.9 t -37.01 -52.7 0.97 Allowed 'General case' 0 N--CA 1.505 2.32 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.049 179.588 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.7 t -27.86 -41.42 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 CA-C-N 112.91 -1.95 . . . . 0.0 116.187 179.813 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -105.04 -37.66 6.86 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 123.693 0.62 . . . . 0.0 111.077 -179.564 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 tp -48.5 -27.29 2.61 Favored 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.478 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 10.2 mtpm? -106.46 124.73 50.04 Favored 'General case' 0 C--N 1.308 -1.207 1 N-CA-C 96.08 -5.526 . . . . 0.0 96.08 178.814 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 19.2 p -97.38 26.83 4.58 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 119.256 -2.152 . . . . 0.0 114.605 0.678 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.412 ' ND1' ' HD2' ' A' ' 25' ' ' LYS . 80.0 t60 -44.07 -61.15 1.57 Allowed 'General case' 0 N--CA 1.507 2.377 0 CA-C-N 119.647 1.112 . . . . 0.0 109.963 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.4 mt -56.03 -69.75 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.258 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.458 ' HB3' ' HB ' ' A' ' 20' ' ' THR . 40.5 ttmt -31.99 -48.51 0.16 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 179.783 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.4 m -95.13 -26.44 16.01 Favored 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 118.312 2.708 . . . . 0.0 118.312 -179.257 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.412 ' HD2' ' ND1' ' A' ' 21' ' ' HIS . 55.5 mttp -101.71 -10.69 19.76 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 -179.459 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.4 m-70 -129.05 -35.47 1.83 Allowed 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 115.549 1.685 . . . . 0.0 115.549 -179.952 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.1 t . . . . . 0 N--CA 1.501 2.083 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -179.453 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.7 tp60 -113.28 178.77 4.17 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.475 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 42.0 t -106.94 159.07 16.55 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 120.072 -0.651 . . . . 0.0 112.127 -179.912 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -123.21 33.52 5.36 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.02 -1.445 . . . . 0.0 110.292 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -134.74 -49.12 0.76 Allowed 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.682 -1.144 . . . . 0.0 108.278 179.894 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.6 p -115.66 -63.12 1.5 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 124.331 1.019 . . . . 0.0 109.568 179.794 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 132.79 49.25 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.575 0 C-N-CA 127.345 2.258 . . . . 0.0 109.592 -179.941 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.475 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 6.5 tt -98.22 153.27 18.61 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 179.856 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.9 ttm105 -107.73 137.25 46.09 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.973 -1.467 . . . . 0.0 109.432 -179.66 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.42 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 29.1 t -116.81 -51.54 2.57 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-N 113.854 -1.521 . . . . 0.0 107.669 179.874 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 12' ' ' SER . . . 92.09 -32.94 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.321 0 O-C-N 126.296 2.247 . . . . 0.0 110.385 179.982 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -136.58 136.23 39.08 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 124.253 0.971 . . . . 0.0 110.379 -179.872 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 53.4 p -39.75 -50.3 2.34 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 124.05 0.844 . . . . 0.0 109.555 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.9 t -29.82 -41.38 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 O-C-N 125.627 1.829 . . . . 0.0 115.39 179.593 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -102.29 -40.81 6.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 123.787 0.68 . . . . 0.0 109.696 -179.643 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -46.31 -42.92 15.37 Favored 'General case' 0 N--CA 1.505 2.31 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 179.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -45.85 -68.65 0.18 Allowed 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.905 179.347 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.5 p -53.94 -45.98 71.42 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 113.531 -1.668 . . . . 0.0 111.145 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.468 ' CE1' HD13 ' A' ' 10' ' ' LEU . 74.0 t60 -46.47 -65.38 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.671 1.232 . . . . 0.0 112.054 -179.954 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.7 mt -49.9 -56.65 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 124.292 0.995 . . . . 0.0 111.963 -179.645 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -51.12 -48.59 61.71 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -179.806 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 m -82.17 -37.09 26.64 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 118.609 2.818 . . . . 0.0 118.609 -179.218 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -96.31 -15.28 22.01 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -179.65 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -126.4 15.53 7.71 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.686 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.1 m . . . . . 0 N--CA 1.51 2.571 0 N-CA-C 115.789 1.774 . . . . 0.0 115.789 179.602 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.433 ' CE1' ' HA ' ' A' ' 14' ' ' ASP . 6.6 m-85 . . . . . 0 N--CA 1.494 1.751 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -131.91 164.15 26.74 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 179.704 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.468 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 42.3 t -106.34 159.34 16.21 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 105.903 -1.888 . . . . 0.0 105.903 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.449 ' NE2' ' N ' ' A' ' 6' ' ' GLN . 0.0 OUTLIER -122.82 35.03 4.98 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.887 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -132.36 -50.76 0.93 Allowed 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.81 -1.541 . . . . 0.0 108.676 179.9 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.5 p -112.69 -42.13 3.68 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.215 0.947 . . . . 0.0 109.282 179.849 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 97.19 54.07 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.138 0 O-C-N 126.265 2.228 . . . . 0.0 109.956 179.809 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.468 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 5.5 tt -104.23 148.32 26.47 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 103.434 -2.802 . . . . 0.0 103.434 179.652 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.453 ' HD2' ' C ' ' A' ' 10' ' ' LEU . 5.4 mpt_? -108.69 141.89 39.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 124.362 1.039 . . . . 0.0 110.69 -179.501 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.5 m -124.13 -166.47 1.5 Allowed 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 113.305 -1.77 . . . . 0.0 108.75 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -104.89 -42.82 5.24 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.753 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.613 ' H ' HD21 ' A' ' 17' ' ' ASN . 34.5 t70 -129.92 -165.54 1.55 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 123.94 0.775 . . . . 0.0 109.698 -179.803 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.496 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 45.5 t -93.01 -42.55 9.37 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 179.735 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.8 m -47.3 -43.69 22.77 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-O 121.944 0.878 . . . . 0.0 110.802 179.861 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.613 HD21 ' H ' ' A' ' 14' ' ' ASP . 16.8 p30 -83.53 -24.48 31.63 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.623 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.401 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 27.4 tp -67.79 -46.55 71.64 Favored 'General case' 0 N--CA 1.506 2.37 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -51.28 -52.45 44.95 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.0 m -57.36 -53.21 60.75 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.882 179.549 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 26.7 t60 -40.44 -59.59 1.29 Allowed 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.348 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -51.69 -60.47 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.96 179.633 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -34.89 -50.13 0.47 Allowed 'General case' 0 N--CA 1.503 2.206 0 O-C-N 124.539 1.15 . . . . 0.0 113.038 179.555 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.3 m -114.64 45.89 1.49 Allowed 'General case' 0 N--CA 1.501 2.12 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -179.751 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -156.09 -37.15 0.08 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 121.389 0.614 . . . . 0.0 110.406 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -119.65 -38.58 2.97 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-N 114.203 -1.362 . . . . 0.0 113.28 -179.252 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 p . . . . . 0 N--CA 1.496 1.843 0 O-C-N 124.275 0.985 . . . . 0.0 112.618 -179.596 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.467 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 1.0 OUTLIER . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 105.569 -2.011 . . . . 0.0 105.569 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -126.53 165.87 18.33 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 179.588 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.443 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 44.8 t -94.49 -66.19 0.93 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.96 -179.945 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 28.2 tt0 90.92 -10.5 0.28 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 125.13 1.519 . . . . 0.0 111.53 179.885 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -91.7 -47.51 7.33 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.733 -179.769 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.2 p -111.45 -24.26 10.27 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.925 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 94.16 53.61 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 126.775 2.03 . . . . 0.0 111.084 179.446 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.449 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 11.5 tp -107.64 162.34 14.06 Favored 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 114.122 -1.399 . . . . 0.0 107.482 179.79 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.449 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 15.3 ttt85 -125.27 157.94 35.35 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 179.452 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.9 m -122.54 176.02 6.15 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.411 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.25 -47.59 2.93 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 124.676 1.235 . . . . 0.0 110.018 -179.903 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -123.45 162.59 22.53 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 123.761 0.663 . . . . 0.0 110.192 -179.974 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.6 p -50.42 -47.64 56.55 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-O 121.837 0.827 . . . . 0.0 108.92 179.584 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.5 m -56.63 -55.16 37.45 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.4 -1.727 . . . . 0.0 108.192 -179.989 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -40.69 -54.23 2.64 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.873 179.727 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -64.04 -57.17 10.45 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.831 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp -39.92 -54.7 2.14 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 124.201 0.938 . . . . 0.0 110.932 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.2 p -60.44 -54.43 45.64 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.065 -179.99 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 44.6 t60 -42.98 -59.17 2.11 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 119.611 -0.835 . . . . 0.0 109.536 179.802 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.38 -69.71 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 124.277 0.985 . . . . 0.0 109.756 179.522 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mmtm -41.51 -34.17 0.53 Allowed 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 -179.762 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.0 m -91.46 -41.46 10.83 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 118.658 2.836 . . . . 0.0 118.658 -179.549 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -103.56 -4.9 23.3 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -132.76 -40.92 0.95 Allowed 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -179.944 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 81.7 p . . . . . 0 N--CA 1.504 2.245 0 O-C-N 125.187 1.554 . . . . 0.0 107.191 -179.198 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.518 ' CE1' ' HB2' ' A' ' 15' ' ' SER . 82.9 m-85 . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -111.94 163.77 13.87 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 104.284 -2.487 . . . . 0.0 104.284 -179.962 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.6 t -103.21 153.79 20.0 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.817 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -119.79 35.81 4.72 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 122.131 0.967 . . . . 0.0 109.278 -179.812 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -131.52 -52.25 1.01 Allowed 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 113.772 -1.558 . . . . 0.0 107.676 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.7 p -119.86 -116.82 0.32 Allowed 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 103.538 -2.764 . . . . 0.0 103.538 179.717 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -161.94 58.8 0.25 Allowed 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.395 0.617 . . . . 0.0 109.81 179.74 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.1 tt -107.28 115.25 29.84 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 179.816 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -116.31 137.04 52.48 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.587 -179.834 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.5 p -128.38 -174.84 3.33 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-N 112.486 -2.143 . . . . 0.0 109.0 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.07 -23.88 8.82 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.52 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -115.12 174.76 5.82 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.364 1.04 . . . . 0.0 110.687 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.518 ' HB2' ' CE1' ' A' ' 3' ' ' TYR . 22.2 t -115.23 52.45 0.87 Allowed 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 p -110.72 -45.17 3.53 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 112.999 -1.91 . . . . 0.0 110.432 -179.698 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -106.44 -14.65 15.02 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 125.383 1.677 . . . . 0.0 113.085 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -74.13 -53.7 9.35 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.676 -179.875 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -47.85 -48.31 31.08 Favored 'General case' 0 N--CA 1.5 2.067 0 CA-C-O 121.196 0.522 . . . . 0.0 109.795 179.669 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.3 p -65.6 -52.4 52.37 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.263 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -36.3 -64.55 0.32 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 123.954 0.784 . . . . 0.0 110.354 179.58 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.6 mt -51.52 -61.01 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 123.751 0.657 . . . . 0.0 111.152 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -38.18 -43.31 0.75 Allowed 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.9 p -98.63 -38.7 9.02 Favored 'General case' 0 N--CA 1.508 2.455 0 N-CA-C 120.008 3.336 . . . . 0.0 120.008 -179.407 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -79.1 -26.27 42.96 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -179.235 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -116.04 -59.31 2.0 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.7 t . . . . . 0 N--CA 1.507 2.414 0 O-C-N 125.124 1.515 . . . . 0.0 111.7 179.797 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.9 pttp . . . . . 0 N--CA 1.492 1.652 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.9 t -130.68 -178.49 4.81 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 121.964 0.887 . . . . 0.0 108.754 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.474 ' CD1' ' HA ' ' A' ' 14' ' ' ASP . 2.4 m-85 -114.95 134.94 54.75 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 105.149 -2.167 . . . . 0.0 105.149 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -108.57 175.46 5.46 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 124.736 1.273 . . . . 0.0 109.255 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.2 t -89.92 172.73 8.66 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -118.66 13.97 13.43 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 123.862 0.726 . . . . 0.0 111.032 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -129.87 -47.92 1.13 Allowed 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.511 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.1 p -112.78 -116.47 0.32 Allowed 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -164.08 42.76 0.1 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -106.68 131.63 53.59 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.586 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.427 ' C ' ' HD3' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -114.06 168.81 9.5 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.695 179.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.6 t -129.15 -83.84 0.56 Allowed 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -164.88 -66.99 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 103.07 -2.937 . . . . 0.0 103.07 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.474 ' HA ' ' CD1' ' A' ' 3' ' ' TYR . 2.4 m-20 -134.44 162.28 32.67 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 124.782 1.301 . . . . 0.0 110.961 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.3 p -36.67 -53.09 0.9 Allowed 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.813 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.6 p -15.39 -50.51 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 126.329 2.268 . . . . 0.0 116.905 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -106.28 -45.39 4.3 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 114.658 -1.156 . . . . 0.0 110.397 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.6 tt -40.78 -45.1 2.37 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.17 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -43.12 -49.69 6.29 Favored 'General case' 0 N--CA 1.507 2.408 0 CA-C-O 121.455 0.645 . . . . 0.0 111.172 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.8 m -57.15 -55.86 29.28 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.436 -1.256 . . . . 0.0 109.741 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -37.68 -61.37 0.63 Allowed 'General case' 0 N--CA 1.507 2.407 0 O-C-N 124.649 1.218 . . . . 0.0 109.454 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.0 mt -47.34 -69.13 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.2 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -40.42 -39.17 0.94 Allowed 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.2 p -92.21 -36.55 13.2 Favored 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 118.692 2.849 . . . . 0.0 118.692 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.44 ' N ' ' HD2' ' A' ' 25' ' ' LYS . 13.8 mptt -95.07 -13.86 24.78 Favored 'General case' 0 N--CA 1.508 2.427 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.9 m-70 -122.02 -33.35 3.55 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.55 0.531 . . . . 0.0 109.829 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 79.1 p 40.25 75.29 0.08 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 124.871 1.357 . . . . 0.0 113.177 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp 8.12 -87.34 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.308 0 CA-C-N 112.361 -2.2 . . . . 0.0 115.52 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -134.46 47.12 2.42 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.27 1.033 . . . . 0.0 108.37 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.5 mttm . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 179.973 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.2 m -119.88 164.76 15.54 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-O 121.593 0.711 . . . . 0.0 109.656 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -131.98 145.65 51.6 Favored 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 113.926 -1.488 . . . . 0.0 108.152 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -137.8 165.65 25.93 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 44.6 t -82.18 161.13 22.88 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -119.76 28.7 7.97 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.151 0.907 . . . . 0.0 109.256 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -132.62 -55.12 0.95 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.005 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.7 p -111.72 -113.72 0.32 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.72 43.64 0.38 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.3 tt -90.62 148.91 22.35 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 11' ' ' ARG . 1.1 ptp85 -124.08 143.59 50.37 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 124.712 1.258 . . . . 0.0 111.099 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -140.52 168.43 19.81 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.423 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.16 2.75 11.43 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -125.51 -173.2 2.77 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.614 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.8 p -107.45 -49.69 3.21 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.5 p -42.21 -62.15 1.01 Allowed 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 121.922 0.868 . . . . 0.0 111.202 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -45.28 -48.94 12.95 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 113.728 -1.578 . . . . 0.0 111.223 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.432 HD13 HD13 ' A' ' 22' ' ' ILE . 3.4 tm? -62.25 -59.56 4.85 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.123 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -40.28 -53.69 2.5 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 124.234 0.959 . . . . 0.0 111.457 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.2 p -64.22 -51.02 65.71 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.445 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -37.78 -57.7 0.97 Allowed 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.433 ' N ' HD12 ' A' ' 22' ' ' ILE . 2.4 mp -57.67 -62.65 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 124.764 1.29 . . . . 0.0 111.859 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 tttt -42.74 -37.57 1.8 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.5 m -83.19 -58.74 2.72 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 118.484 2.772 . . . . 0.0 118.484 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -87.48 -4.58 59.0 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 116.956 2.206 . . . . 0.0 116.956 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -125.76 -33.91 2.68 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.3 m -109.37 -17.63 13.75 Favored 'General case' 0 N--CA 1.504 2.246 0 N-CA-C 118.67 2.841 . . . . 0.0 118.67 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -114.07 -49.63 2.85 Favored 'General case' 0 N--CA 1.507 2.396 0 N-CA-C 116.01 1.856 . . . . 0.0 116.01 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -85.25 75.15 10.32 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 123.152 1.453 . . . . 0.0 108.822 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? . . . . . 0 N--CA 1.492 1.666 0 CA-C-N 111.407 -2.633 . . . . 0.0 109.187 179.9 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.4 t -117.38 -166.04 1.14 Allowed 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.461 ' CE2' ' HB2' ' A' ' 15' ' ' SER . 36.7 m-85 -120.41 118.21 29.72 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.219 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.559 HE22 ' H ' ' A' ' 6' ' ' GLN . 2.1 tm0? -114.07 154.88 26.97 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.8 t -72.43 -49.39 33.87 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 118.38 2.733 . . . . 0.0 118.38 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.559 ' H ' HE22 ' A' ' 4' ' ' GLN . 0.0 OUTLIER 72.93 17.12 4.31 Favored 'General case' 0 N--CA 1.509 2.488 0 C-N-CA 124.328 1.051 . . . . 0.0 112.456 -179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.479 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 24.4 m-85 -121.38 -50.36 2.12 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.418 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 24.3 p -111.56 -50.2 2.94 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.431 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 45.9 tp10 118.68 66.8 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 126.92 2.637 . . . . 0.0 110.108 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 14.5 tp -106.04 157.63 17.39 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.5 ttt85 -118.49 120.01 36.25 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.8 1.313 . . . . 0.0 108.535 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -122.53 149.58 43.73 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 122.845 1.307 . . . . 0.0 111.364 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -135.09 83.93 2.06 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 101.46 -3.533 . . . . 0.0 101.46 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.457 ' HB2' ' CD1' ' A' ' 3' ' ' TYR . 1.9 p30 -137.24 -153.61 0.5 Allowed 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 126.739 2.016 . . . . 0.0 106.973 0.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.461 ' HB2' ' CE2' ' A' ' 3' ' ' TYR . 43.7 t -26.02 -55.92 0.07 Allowed 'General case' 0 N--CA 1.503 2.211 0 O-C-N 124.23 0.957 . . . . 0.0 112.303 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.5 m -33.37 -38.81 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 CA-C-N 113.005 -1.907 . . . . 0.0 115.841 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -95.11 -50.78 4.92 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.817 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.412 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 2.8 tt -40.46 -46.38 2.42 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 123.853 0.721 . . . . 0.0 110.722 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -44.45 -56.17 4.48 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.118 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.0 p -66.3 -42.36 88.42 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 28.1 t60 -44.61 -61.39 1.58 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.77 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.3 mt -50.25 -61.8 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 O-C-N 124.604 1.19 . . . . 0.0 109.399 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -31.0 -52.23 0.18 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 125.468 1.73 . . . . 0.0 114.178 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.8 t -112.7 36.19 3.55 Favored 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -142.21 -35.38 0.43 Allowed 'General case' 0 N--CA 1.503 2.225 0 CA-C-O 121.411 0.625 . . . . 0.0 109.876 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -119.64 -64.39 1.27 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 113.857 -1.519 . . . . 0.0 107.144 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.5 m 78.47 -59.33 0.42 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 125.673 1.858 . . . . 0.0 113.449 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -130.79 -62.58 0.9 Allowed 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 113.183 -1.826 . . . . 0.0 114.25 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 28.32 69.69 0.07 Allowed 'General case' 0 N--CA 1.501 2.108 0 O-C-N 125.459 1.725 . . . . 0.0 115.494 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.9 mtmm . . . . . 0 N--CA 1.501 2.089 0 CA-C-N 113.855 -1.52 . . . . 0.0 109.978 179.893 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.447 ' N ' ' HD2' ' A' ' 1' ' ' LYS . 3.8 mptp? . . . . . 0 N--CA 1.495 1.807 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.593 ' H ' ' NH2' ' A' ' 11' ' ' ARG . 2.0 m -112.58 -163.65 0.87 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -100.86 146.21 27.61 Favored 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 119.763 -0.775 . . . . 0.0 111.961 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 32.2 tt0 -116.25 153.89 31.1 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 105.031 -2.211 . . . . 0.0 105.031 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.432 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 53.9 t -74.65 159.77 31.68 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.028 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -120.76 37.05 4.4 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.432 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 54.2 m-85 -137.5 -50.45 0.62 Allowed 'General case' 0 N--CA 1.496 1.872 0 CA-C-N 113.506 -1.679 . . . . 0.0 108.403 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -118.88 -124.35 0.28 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 103.942 -2.614 . . . . 0.0 103.942 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -157.06 48.95 0.44 Allowed 'General case' 0 N--CA 1.499 2.009 0 CA-C-O 121.483 0.659 . . . . 0.0 112.643 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.0 tt -109.23 160.33 16.2 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.711 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.593 ' NH2' ' H ' ' A' ' 2' ' ' THR . 23.2 mtp180 -117.4 145.51 44.05 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 123.844 0.715 . . . . 0.0 109.17 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.6 m -130.93 146.18 52.26 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 114.781 -1.099 . . . . 0.0 112.064 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -127.6 91.96 3.4 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 125.137 1.523 . . . . 0.0 107.934 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -122.42 -97.32 0.45 Allowed 'General case' 0 N--CA 1.501 2.113 0 CA-C-N 121.636 2.017 . . . . 0.0 110.067 0.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.575 ' N ' ' HB3' ' A' ' 16' ' ' SER . 79.7 p -144.37 63.99 1.31 Allowed 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.575 ' HB3' ' N ' ' A' ' 15' ' ' SER . 4.6 t 50.21 -155.31 0.12 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 117.224 -3.422 . . . . 0.0 112.848 0.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.442 HD22 ' N ' ' A' ' 17' ' ' ASN . 1.5 m120 -25.43 -30.15 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 118.592 2.812 . . . . 0.0 118.592 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -84.58 -59.91 2.22 Favored 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.434 ' C ' ' HD3' ' A' ' 19' ' ' LYS . 8.0 tmtm? -46.37 -48.96 18.47 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.4 p -63.39 -51.85 64.1 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 113.093 -1.867 . . . . 0.0 109.959 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -41.05 -58.11 1.84 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 76.0 mt -52.02 -63.21 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 124.356 1.035 . . . . 0.0 108.822 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -31.7 -42.0 0.05 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 125.201 1.563 . . . . 0.0 113.853 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.541 ' HA ' ' H ' ' A' ' 29' ' ' GLU . 65.9 p -101.55 -42.82 6.1 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.24 -21.29 42.96 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -120.36 -37.17 3.08 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 123.704 0.627 . . . . 0.0 111.422 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.9 t -109.24 54.81 0.65 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 123.912 0.758 . . . . 0.0 111.464 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.6 tptm 7.0 74.74 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.651 0 O-C-N 124.912 1.382 . . . . 0.0 114.465 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.541 ' H ' ' HA ' ' A' ' 24' ' ' THR . 38.9 tt0 10.31 60.38 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 CA-C-N 112.904 -1.953 . . . . 0.0 115.654 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 85.7 tttt . . . . . 0 N--CA 1.502 2.161 0 CA-C-O 124.328 2.013 . . . . 0.0 111.114 179.741 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.437 ' HA ' ' HE2' ' A' ' 1' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 67.3 p -111.04 160.63 16.67 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 15' ' ' SER . 4.4 m-85 -128.74 151.86 49.08 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.975 -2.602 . . . . 0.0 103.975 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -132.15 160.43 36.07 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 119.401 -0.919 . . . . 0.0 113.283 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.433 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.5 t -102.44 149.96 23.85 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 114.029 -1.442 . . . . 0.0 108.676 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -120.93 41.78 3.21 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 124.209 0.943 . . . . 0.0 108.798 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.433 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 71.8 m-85 -131.66 -42.56 1.03 Allowed 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 113.55 -1.659 . . . . 0.0 109.944 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.7 p -116.07 -49.92 2.68 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 124.227 0.954 . . . . 0.0 111.7 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 144.39 -40.5 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.661 0 O-C-N 125.608 1.817 . . . . 0.0 109.612 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.5 tt -24.9 143.94 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 116.592 2.071 . . . . 0.0 116.592 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.7 ttt85 -124.35 145.89 49.16 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 113.469 -1.696 . . . . 0.0 106.987 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.6 p -124.87 164.43 20.07 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.81 0.94 20.63 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 123.836 0.71 . . . . 0.0 111.349 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -137.24 177.08 8.14 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 124.006 0.816 . . . . 0.0 110.355 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.487 ' HB2' ' CZ ' ' A' ' 3' ' ' TYR . 27.1 t -115.32 40.21 2.75 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.3 t -120.21 -49.87 2.27 Favored 'General case' 0 N--CA 1.496 1.825 0 CA-C-N 114.433 -1.258 . . . . 0.0 109.807 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -102.97 32.6 3.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.267 0.979 . . . . 0.0 110.905 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.469 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 2.7 tm? -109.21 -61.65 1.59 Allowed 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -46.29 -56.75 5.33 Favored 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 62.3 p -56.5 -45.14 81.16 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 112.767 -2.015 . . . . 0.0 110.407 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.469 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 82.4 t60 -43.77 -70.09 0.12 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 124.226 0.954 . . . . 0.0 110.796 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mp -47.5 -64.98 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.051 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -35.5 -52.37 0.65 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 68.0 p -114.99 26.94 9.76 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 116.694 2.109 . . . . 0.0 116.694 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.461 ' HA ' ' HE2' ' A' ' 25' ' ' LYS . 10.4 mmpt? -128.98 -32.77 2.04 Favored 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.7 m-70 -109.26 -27.76 9.37 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 124.168 0.917 . . . . 0.0 112.49 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 m -89.58 45.96 1.33 Allowed 'General case' 0 N--CA 1.501 2.124 0 C-N-CA 118.685 -1.206 . . . . 0.0 108.958 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -126.83 142.16 51.62 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.408 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -124.42 46.74 2.23 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm . . . . . 0 N--CA 1.497 1.894 0 CA-C-N 113.653 -1.612 . . . . 0.0 109.616 -179.964 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 120.992 0.425 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.466 HG22 ' H ' ' A' ' 3' ' ' TYR . 96.5 m -114.59 177.01 4.8 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.466 ' H ' HG22 ' A' ' 2' ' ' THR . 24.4 m-85 -105.32 84.3 2.08 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.195 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -122.17 155.02 36.66 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.88 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.39 166.53 8.11 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.221 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -123.87 23.5 8.62 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.696 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.507 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 91.0 m-85 -139.57 -49.62 0.49 Allowed 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 115.721 1.749 . . . . 0.0 115.721 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.407 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 28.7 p -107.18 -64.36 1.2 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 118.218 -0.896 . . . . 0.0 112.889 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.407 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 14.3 pt-20 143.72 52.39 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.535 0 O-C-N 125.503 1.752 . . . . 0.0 110.927 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.7 tt -104.45 154.56 19.72 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.7 ptt85 -117.02 146.13 43.25 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 64.6 m -131.81 179.2 6.21 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 113.01 -1.904 . . . . 0.0 106.425 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -123.35 -38.17 2.59 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.953 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -125.33 165.34 18.53 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 124.25 0.969 . . . . 0.0 112.51 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 40.6 t -115.72 147.06 41.32 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 105.967 -1.864 . . . . 0.0 105.967 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 75.6 m -96.82 56.79 1.49 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 121.151 1.796 . . . . 0.0 112.15 0.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -98.39 12.97 33.24 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.0 -51.97 2.82 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 101.22 -3.622 . . . . 0.0 101.22 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -53.59 -46.23 70.27 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.9 m -43.33 -50.84 6.61 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 124.474 1.109 . . . . 0.0 110.598 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 54.2 t60 -58.69 -63.2 1.37 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.529 1.143 . . . . 0.0 108.968 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.5 mt -41.62 -61.96 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 O-C-N 125.053 1.471 . . . . 0.0 111.119 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 28' ' ' LYS . 25.2 tptp -37.54 -63.83 0.43 Allowed 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.709 -1.587 . . . . 0.0 112.881 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.8 m -66.08 -45.26 81.89 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 120.873 3.657 . . . . 0.0 120.873 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -94.69 -7.53 40.44 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.507 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 68.9 m-70 -126.75 -37.1 2.17 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 77.8 p -122.64 43.48 2.9 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 23' ' ' LYS . 11.0 tmtt? -141.12 -57.13 0.5 Allowed 'General case' 0 N--CA 1.504 2.259 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -110.24 -41.76 4.32 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 113.502 -1.681 . . . . 0.0 112.578 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.7 tptt . . . . . 0 N--CA 1.506 2.329 0 N-CA-C 116.223 1.934 . . . . 0.0 116.223 -179.934 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 121.542 0.687 . . . . 0.0 109.889 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 78.1 m -131.62 172.43 12.26 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.625 -1.17 . . . . 0.0 109.057 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -122.51 145.58 48.19 Favored 'General case' 0 N--CA 1.499 1.993 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.301 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -135.22 161.25 35.91 Favored 'General case' 0 N--CA 1.501 2.082 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.476 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 52.9 t -99.85 141.99 31.92 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.217 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -118.45 44.45 2.25 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 124.56 1.163 . . . . 0.0 109.027 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.493 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 79.1 m-85 -129.27 -46.8 1.21 Allowed 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 113.173 -1.83 . . . . 0.0 106.707 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -118.04 -52.24 2.42 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 124.577 1.173 . . . . 0.0 111.015 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 147.82 -39.47 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.772 0 O-C-N 125.025 1.453 . . . . 0.0 112.248 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.6 tt -29.92 153.43 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 116.625 2.084 . . . . 0.0 116.625 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 62.7 mtt-85 -119.22 152.17 37.09 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.622 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.5 m -124.05 -162.87 1.1 Allowed 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 113.91 -1.496 . . . . 0.0 107.574 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.24 -63.71 1.3 Allowed 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -124.42 171.57 9.84 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 124.221 0.95 . . . . 0.0 109.455 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.1 t -47.72 -52.34 18.79 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.0 p -43.27 -50.89 6.46 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.901 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -68.68 -48.72 63.22 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.441 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.8 -50.07 14.46 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -49.74 -56.15 11.3 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 179.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.5 m -40.46 -55.58 2.24 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 124.863 1.352 . . . . 0.0 108.769 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -53.37 -68.18 0.2 Allowed 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 113.069 -1.878 . . . . 0.0 109.277 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.3 mm -39.48 -67.03 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 124.536 1.148 . . . . 0.0 110.922 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -36.6 -52.51 0.88 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 124.812 1.32 . . . . 0.0 114.344 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.6 p -108.79 37.76 2.45 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 116.083 1.882 . . . . 0.0 116.083 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -144.81 -36.62 0.31 Allowed 'General case' 0 N--CA 1.501 2.09 0 CA-C-O 121.262 0.553 . . . . 0.0 109.543 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -127.75 -61.17 1.13 Allowed 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.428 ' O ' ' CB ' ' A' ' 28' ' ' LYS . 87.4 p 119.93 -35.14 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.429 0 O-C-N 126.758 2.536 . . . . 0.0 110.166 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.428 ' CB ' ' O ' ' A' ' 27' ' ' SER . 5.0 ttmp? 104.99 63.21 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 100.77 -3.789 . . . . 0.0 100.77 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 28.08 56.35 0.09 Allowed 'General case' 0 N--CA 1.501 2.121 0 CA-C-N 113.895 -1.502 . . . . 0.0 113.925 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 93.3 mttt . . . . . 0 N--CA 1.511 2.576 0 C-N-CA 126.902 2.081 . . . . 0.0 109.486 179.834 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 121.867 0.841 . . . . 0.0 109.094 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 51.2 p -130.67 -178.1 4.64 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.863 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -114.45 135.11 54.46 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.7 tp60 -120.76 157.67 29.18 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.799 1.312 . . . . 0.0 108.257 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.9 t -99.89 149.31 23.53 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -119.15 43.64 2.54 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 122.19 0.995 . . . . 0.0 110.593 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -133.23 -52.06 0.89 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 112.994 -1.912 . . . . 0.0 105.868 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.9 p -119.51 -124.49 0.28 Allowed 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 102.149 -3.278 . . . . 0.0 102.149 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -147.61 56.21 1.09 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 123.993 0.808 . . . . 0.0 108.927 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.472 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 24.2 tp -105.29 139.19 40.31 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.033 -1.067 . . . . 0.0 111.61 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.472 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -134.92 146.44 49.16 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.583 -1.644 . . . . 0.0 111.569 179.392 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.2 t -142.03 171.96 13.35 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 112.875 -1.966 . . . . 0.0 108.449 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.17 -12.79 25.76 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -121.66 -173.69 2.7 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 124.26 0.975 . . . . 0.0 108.55 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.7 t -119.19 -38.46 3.04 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.8 p -31.66 -46.12 0.1 Allowed 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.3 p30 -84.54 -36.82 21.89 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 119.017 -1.073 . . . . 0.0 109.969 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 23.6 tp -49.21 -41.61 37.63 Favored 'General case' 0 N--CA 1.503 2.22 0 CA-C-O 121.505 0.669 . . . . 0.0 109.837 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.7 tmtp? -51.97 -53.65 38.91 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -61.29 -52.94 62.6 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.118 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.411 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 70.1 t60 -35.41 -59.18 0.55 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.145 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 71.2 mt -53.06 -57.96 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-O 121.494 0.664 . . . . 0.0 109.361 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.436 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 4.1 ttmp? -45.61 -41.86 10.61 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.689 -1.141 . . . . 0.0 113.094 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -87.68 -37.83 16.38 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 121.276 3.806 . . . . 0.0 121.276 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.3 mtpt -108.11 0.1 21.42 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 115.141 1.534 . . . . 0.0 115.141 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 47.3 m-70 -125.52 -40.25 2.1 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.3 p -92.58 -67.56 0.85 Allowed 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.543 -0.863 . . . . 0.0 111.286 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.65 -174.28 2.77 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -111.63 45.11 1.26 Allowed 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 106.287 -1.745 . . . . 0.0 106.287 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.4 tttp . . . . . 0 N--CA 1.499 1.99 0 CA-C-N 112.812 -1.995 . . . . 0.0 115.273 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 122.061 0.934 . . . . 0.0 111.44 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.1 m -116.0 163.84 15.31 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -124.74 104.06 8.44 Favored 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 113.737 -1.574 . . . . 0.0 107.816 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.8 tp60 -112.88 114.95 27.69 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 124.011 0.819 . . . . 0.0 109.058 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 53.2 t -23.31 -70.48 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.46 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 7.9 tt0 109.62 -23.06 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.723 0 O-C-N 126.094 2.122 . . . . 0.0 110.305 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -99.5 -52.65 3.43 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.436 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 29.7 p -103.55 -49.45 3.69 Favored 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 34.4 tt0 119.12 64.02 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 126.695 2.497 . . . . 0.0 109.236 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.406 HD13 ' ND1' ' A' ' 21' ' ' HIS . 9.1 tt -106.51 137.64 44.14 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 103.461 -2.792 . . . . 0.0 103.461 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 24.9 ttp85 -115.0 134.49 55.14 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 122.27 1.033 . . . . 0.0 113.604 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 t -129.41 179.3 5.87 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 112.135 -2.302 . . . . 0.0 106.16 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -117.06 -21.41 8.88 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.086 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -141.33 -172.38 3.5 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 124.337 1.023 . . . . 0.0 108.774 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 16' ' ' SER . 30.7 t -105.75 171.71 7.19 Favored 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 15' ' ' SER . 25.1 t 101.02 -31.13 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.795 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -106.48 -16.15 14.61 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-N 113.071 -1.877 . . . . 0.0 109.61 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.41 -55.13 2.46 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 104.503 -2.406 . . . . 0.0 104.503 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HG3' ' HE2' ' A' ' 23' ' ' LYS . 1.1 tppp? -50.7 -53.04 34.57 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 56.5 m -60.84 -50.35 73.8 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 114.31 -1.314 . . . . 0.0 108.44 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.406 ' ND1' HD13 ' A' ' 10' ' ' LEU . 39.2 t60 -40.6 -59.15 1.43 Allowed 'General case' 0 N--CA 1.503 2.206 0 O-C-N 124.091 0.87 . . . . 0.0 108.768 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.3 mt -54.15 -59.58 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 123.782 0.676 . . . . 0.0 109.786 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.406 ' HE2' ' HG3' ' A' ' 19' ' ' LYS . 22.1 mtmt -44.46 -28.97 0.63 Allowed 'General case' 0 N--CA 1.503 2.2 0 N-CA-C 114.779 1.399 . . . . 0.0 114.779 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.1 m -101.92 -40.91 6.68 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 118.138 2.644 . . . . 0.0 118.138 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -89.95 -14.93 33.06 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.9 m-70 -127.37 -46.55 1.47 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.0 t -107.06 54.9 0.66 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.423 1.077 . . . . 0.0 108.434 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -31.05 170.22 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 117.508 2.411 . . . . 0.0 117.508 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -92.31 -42.67 9.69 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.551 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? . . . . . 0 N--CA 1.497 1.88 0 CA-C-O 122.339 1.066 . . . . 0.0 109.888 179.805 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 27.8 tptp . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.018 0.437 . . . . 0.0 109.848 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 28.2 m -121.45 169.64 10.44 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.592 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -117.81 136.75 53.21 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.418 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 69.4 tp60 -121.23 158.1 28.81 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.418 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 40.4 t -105.75 139.14 40.78 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 104.772 -2.307 . . . . 0.0 104.772 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -113.58 47.12 1.19 Allowed 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 122.701 1.238 . . . . 0.0 109.747 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 67.0 m-85 -136.08 -55.64 0.76 Allowed 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 112.263 -2.244 . . . . 0.0 108.548 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -121.3 -117.22 0.31 Allowed 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.337 1.023 . . . . 0.0 110.189 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.2 mp0 -122.16 -49.73 2.05 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 tt -23.49 129.93 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 117.04 2.237 . . . . 0.0 117.04 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -131.77 145.56 51.66 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.5 m -128.56 173.9 9.85 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 123.869 0.73 . . . . 0.0 110.212 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.17 35.14 3.73 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -132.4 -62.92 0.81 Allowed 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.353 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.4 t 125.61 -58.4 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 104.274 -2.491 . . . . 0.0 104.274 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.6 m -44.97 -58.07 3.4 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 124.149 0.906 . . . . 0.0 110.378 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -46.91 -60.56 2.36 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 114.182 -1.372 . . . . 0.0 110.255 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.419 HD13 ' C ' ' A' ' 18' ' ' LEU . 3.0 tm? -50.99 -52.95 37.56 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.209 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -47.69 -55.95 8.36 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 121.093 0.473 . . . . 0.0 110.038 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.1 m -56.45 -47.37 79.28 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.059 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 37.4 t60 -50.4 -58.08 6.52 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 123.765 0.665 . . . . 0.0 109.654 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.6 mt -54.07 -60.34 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.48 -23.02 5.44 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 23.9 m -96.08 -45.16 7.0 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 117.725 2.491 . . . . 0.0 117.725 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -97.36 -7.25 32.33 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 56.6 m-70 -122.79 -48.09 2.04 Favored 'General case' 0 N--CA 1.501 2.11 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.077 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.2 t -111.54 48.18 0.97 Allowed 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -52.65 160.6 0.86 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 113.56 -1.654 . . . . 0.0 112.268 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -131.69 58.0 1.75 Allowed 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.7 ttmp? . . . . . 0 N--CA 1.498 1.965 0 CA-C-N 114.576 -1.193 . . . . 0.0 108.573 -179.904 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 83.3 tttt . . . . . 0 N--CA 1.489 1.478 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.5 p -102.06 167.97 9.69 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -123.32 148.67 45.74 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 113.867 -1.515 . . . . 0.0 107.115 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.4 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 65.4 tp60 -123.6 164.06 19.78 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.4 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 51.0 t -93.79 155.24 17.32 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -114.37 32.08 6.17 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 124.003 0.814 . . . . 0.0 109.665 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -137.26 -53.91 0.69 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 114.746 -1.116 . . . . 0.0 111.141 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.7 p -114.62 -116.64 0.32 Allowed 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.44 52.37 0.53 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.558 0.694 . . . . 0.0 111.801 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.2 tt -105.65 140.42 38.74 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.6 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -122.97 152.18 41.13 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 124.412 1.07 . . . . 0.0 109.952 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.2 p -140.14 179.02 6.87 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.613 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -103.35 -43.92 5.3 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.021 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -109.68 -168.01 1.27 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 124.35 1.032 . . . . 0.0 110.339 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 p -97.51 -45.65 6.34 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.802 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.1 m -40.46 -52.07 2.81 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -80.23 1.92 26.51 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -107.29 -46.78 3.8 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.484 ' HG3' ' N ' ' A' ' 20' ' ' THR . 0.2 OUTLIER -55.84 -49.48 73.2 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.598 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.484 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 8.8 t -51.47 -40.98 60.55 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 123.645 0.591 . . . . 0.0 110.417 179.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.3 t60 -59.88 -66.24 0.55 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.8 mt -46.29 -53.55 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-O 121.256 0.551 . . . . 0.0 109.944 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -38.55 -48.28 1.4 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.936 -1.484 . . . . 0.0 114.058 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 44.9 p -110.07 -9.23 14.73 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -102.69 -22.54 13.93 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -127.82 -38.03 1.89 Allowed 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.424 ' O ' ' CB ' ' A' ' 28' ' ' LYS . 29.3 p -100.9 -70.37 0.74 Allowed 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 -179.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.43 ' HG2' ' N ' ' A' ' 29' ' ' GLU . 62.2 tttp 128.37 173.66 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.665 0 C-N-CA 127.675 2.39 . . . . 0.0 105.456 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.43 ' N ' ' HG2' ' A' ' 28' ' ' LYS . 35.5 tt0 -70.3 -49.76 46.28 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt . . . . . 0 N--CA 1.499 2.014 0 CA-C-O 122.312 1.054 . . . . 0.0 109.606 -179.97 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 49.7 mttm . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.4 m -116.81 171.45 7.89 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.4 m-30 -113.17 169.2 9.11 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.573 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 64.7 tp60 -125.7 170.35 11.62 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 114.646 -1.161 . . . . 0.0 108.816 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.573 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 32.5 t -104.52 -54.51 2.51 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.502 ' H ' HE21 ' A' ' 4' ' ' GLN . 5.6 tt0 80.63 16.3 0.64 Allowed 'General case' 0 N--CA 1.505 2.294 0 O-C-N 125.252 1.595 . . . . 0.0 109.793 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -126.78 -45.71 1.59 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 118.974 -0.536 . . . . 0.0 112.404 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 p -116.16 -117.59 0.32 Allowed 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -140.27 28.09 2.08 Favored 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.7 tt -109.25 155.13 21.48 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.62 157.06 39.91 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 105.553 -2.017 . . . . 0.0 105.553 179.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -126.34 168.2 14.47 Favored 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 120.661 -0.416 . . . . 0.0 109.968 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -108.58 -52.49 2.76 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 124.01 0.819 . . . . 0.0 110.387 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -109.36 155.04 21.7 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 122.049 0.928 . . . . 0.0 110.347 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.417 ' C ' ' HZ3' ' A' ' 19' ' ' LYS . 50.1 m -49.57 -56.42 10.0 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 113.141 -1.845 . . . . 0.0 110.802 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.4 t -45.95 -62.67 1.22 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 124.545 1.153 . . . . 0.0 110.025 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -43.2 -58.19 2.62 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 124.417 1.073 . . . . 0.0 111.701 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.403 ' C ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -52.88 -57.04 11.58 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.417 ' HZ3' ' C ' ' A' ' 15' ' ' SER . 38.3 mtmm -53.17 -49.3 66.93 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 119.819 -0.752 . . . . 0.0 109.829 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 67.1 m -53.39 -50.98 64.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 124.033 0.833 . . . . 0.0 109.029 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -51.02 -58.77 5.21 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.281 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.0 mt -57.39 -26.07 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.62 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.463 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.05 -48.23 25.02 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.749 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.9 p -85.33 -29.15 24.75 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -101.55 -22.29 14.53 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 123.762 0.664 . . . . 0.0 110.569 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -131.68 33.69 3.98 Favored 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 119.018 -1.073 . . . . 0.0 113.099 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.0 p -21.5 -61.66 0.03 OUTLIER 'General case' 0 N--CA 1.513 2.682 0 O-C-N 124.413 1.07 . . . . 0.0 113.634 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -117.21 175.88 5.4 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 26.63 56.19 0.06 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 124.278 0.986 . . . . 0.0 113.074 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 95.2 mttt . . . . . 0 N--CA 1.504 2.253 0 CA-C-N 112.227 -2.26 . . . . 0.0 116.56 -179.89 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 62.4 mttp . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 32.1 m -125.09 167.4 14.84 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 114.892 -1.049 . . . . 0.0 108.732 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -123.25 139.99 53.48 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.457 HE21 ' HE ' ' A' ' 11' ' ' ARG . 2.2 tt0 -125.58 177.06 6.44 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.428 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.429 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 51.0 t -106.46 161.87 14.21 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.201 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -118.9 29.72 7.56 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 124.132 0.895 . . . . 0.0 108.895 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -137.19 -49.84 0.62 Allowed 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.063 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 9' ' ' GLU . 30.0 p -114.75 -48.78 2.83 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 124.093 0.871 . . . . 0.0 110.991 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 31.2 mm-40 129.56 -2.51 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.918 0 C-N-CA 127.054 2.142 . . . . 0.0 113.389 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -44.83 135.36 5.16 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 124.082 0.864 . . . . 0.0 109.314 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.457 ' HE ' HE21 ' A' ' 4' ' ' GLN . 4.6 ptp180 -124.03 144.55 49.77 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 124.396 1.06 . . . . 0.0 112.737 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.3 t -126.98 -176.01 3.59 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-N 112.649 -2.069 . . . . 0.0 107.926 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.5 -9.2 12.1 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.303 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -135.74 -177.0 4.48 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 124.478 1.111 . . . . 0.0 111.782 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.5 m -113.61 38.87 2.8 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.031 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.7 t -117.71 -54.49 2.35 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 104.945 -2.243 . . . . 0.0 104.945 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -75.42 -43.03 52.1 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 113.514 -1.675 . . . . 0.0 109.385 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.54 -53.28 60.14 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.165 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.461 ' C ' ' HD3' ' A' ' 19' ' ' LYS . 13.1 tmtt? -50.31 -60.29 3.13 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 120.191 -0.603 . . . . 0.0 109.576 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.4 p -52.36 -42.27 63.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 123.804 0.69 . . . . 0.0 112.436 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -49.69 -62.65 1.44 Allowed 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.33 179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.54 HD12 ' H ' ' A' ' 22' ' ' ILE . 2.9 mp -50.07 -59.62 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 O-C-N 123.737 0.648 . . . . 0.0 110.473 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -36.58 -51.82 0.85 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 23.1 m -85.37 -42.6 14.4 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 119.358 3.095 . . . . 0.0 119.358 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.59 -8.34 56.38 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.16 0.913 . . . . 0.0 112.867 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -150.18 70.65 1.04 Allowed 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 102.506 -3.146 . . . . 0.0 102.506 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.7 p -163.66 43.71 0.11 Allowed 'General case' 0 N--CA 1.501 2.075 0 O-C-N 118.702 -2.498 . . . . 0.0 109.757 0.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm 94.78 158.96 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.515 0 C-N-CA 125.498 1.519 . . . . 0.0 108.681 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.9 mp0 -130.81 -56.9 1.05 Allowed 'General case' 0 N--CA 1.496 1.852 0 O-C-N 124.087 0.867 . . . . 0.0 110.5 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.3 pttp . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 122.216 1.008 . . . . 0.0 110.565 -179.884 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.446 ' HA ' ' HE2' ' A' ' 1' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.409 HG22 ' H ' ' A' ' 3' ' ' TYR . 26.8 m 89.82 170.4 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.603 0 O-C-N 125.385 1.678 . . . . 0.0 108.75 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.409 ' H ' HG22 ' A' ' 2' ' ' THR . 2.9 m-85 -103.96 145.64 29.85 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.528 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 31.6 tt0 -121.75 173.97 7.13 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 124.995 1.434 . . . . 0.0 107.63 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.528 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 48.0 t -100.7 163.36 12.37 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.66 25.96 9.42 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 124.219 0.949 . . . . 0.0 109.676 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.482 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 63.2 m-85 -123.35 -53.83 1.8 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 107.243 -1.392 . . . . 0.0 107.243 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -118.04 -121.23 0.3 Allowed 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 104.116 -2.55 . . . . 0.0 104.116 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -159.42 51.28 0.35 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.541 0.686 . . . . 0.0 109.824 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.3 tt -106.48 158.51 16.86 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.938 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -118.95 161.75 19.67 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.193 0.997 . . . . 0.0 113.539 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.8 m -125.23 -158.81 0.85 Allowed 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 112.537 -2.119 . . . . 0.0 110.225 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.79 -55.0 2.54 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.8 p-10 -122.15 -43.95 2.3 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 116.121 1.896 . . . . 0.0 116.121 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.6 p 156.02 -49.49 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.8 p -47.09 -42.7 19.37 Favored 'General case' 0 N--CA 1.507 2.398 0 CA-C-O 121.51 0.672 . . . . 0.0 109.305 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -67.78 -47.52 68.95 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -46.13 -45.53 16.58 Favored 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 179.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -51.59 -59.65 4.03 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 124.314 1.009 . . . . 0.0 108.837 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.6 p -51.4 -46.27 62.8 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 124.111 0.882 . . . . 0.0 110.916 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -48.47 -66.69 0.36 Allowed 'General case' 0 N--CA 1.502 2.141 0 C-N-CA 119.811 -0.755 . . . . 0.0 109.02 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.1 mt -48.94 -55.74 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 124.264 0.978 . . . . 0.0 111.499 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -33.25 -57.72 0.4 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 125.193 1.558 . . . . 0.0 113.996 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 50.2 m -115.07 48.11 1.2 Allowed 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 122.233 1.016 . . . . 0.0 113.406 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -145.31 -39.1 0.25 Allowed 'General case' 0 N--CA 1.5 2.073 0 CA-C-N 114.664 -1.153 . . . . 0.0 109.539 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -121.36 -40.33 2.59 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 114.152 -1.385 . . . . 0.0 111.575 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 73.2 p -111.31 65.27 0.62 Allowed 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt 126.85 69.89 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.753 0 C-N-CA 127.766 2.427 . . . . 0.0 106.802 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -118.41 -39.6 3.01 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 112.41 -2.177 . . . . 0.0 107.537 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.507 2.392 0 O-C-N 125.893 1.996 . . . . 0.0 116.145 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 121.106 0.479 . . . . 0.0 109.933 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.6 p -107.87 159.14 16.75 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-O 121.426 0.632 . . . . 0.0 112.406 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -127.22 159.08 35.4 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 113.624 -1.625 . . . . 0.0 108.488 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.438 ' HG3' ' H ' ' A' ' 6' ' ' GLN . 4.1 tp-100 -124.28 156.22 37.29 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 124.425 1.078 . . . . 0.0 111.017 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 14.7 t -107.09 -17.87 14.05 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 114.435 -1.257 . . . . 0.0 113.819 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.438 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 9.7 pt20 40.89 30.39 0.09 Allowed 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 116.374 1.991 . . . . 0.0 116.374 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -135.43 -59.93 0.76 Allowed 'General case' 0 N--CA 1.504 2.259 0 N-CA-C 106.055 -1.831 . . . . 0.0 106.055 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.448 ' SG ' ' HB2' ' A' ' 10' ' ' LEU . 17.8 p -118.45 29.57 7.69 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 105.396 -2.076 . . . . 0.0 105.396 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 24.72 55.03 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 112.646 -2.07 . . . . 0.0 112.373 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.448 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 4.3 tp -90.96 146.42 23.89 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 104.132 -2.544 . . . . 0.0 104.132 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -114.35 149.32 36.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 124.325 1.016 . . . . 0.0 109.151 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.6 t -138.9 170.97 15.02 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.116 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.62 -4.59 10.28 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 125.137 1.523 . . . . 0.0 108.817 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -127.47 169.8 13.27 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.5 p -104.99 -45.79 4.45 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 124.206 0.942 . . . . 0.0 112.744 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.425 ' HA ' ' NZ ' ' A' ' 19' ' ' LYS . 22.7 t -50.39 -53.35 29.9 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 122.071 0.939 . . . . 0.0 112.528 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.0 p-10 -60.33 -30.17 69.34 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.38 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -72.15 -53.41 12.78 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 118.862 -0.589 . . . . 0.0 110.19 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.443 ' HG3' ' N ' ' A' ' 20' ' ' THR . 17.6 pttm -52.15 -48.12 65.09 Favored 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.21 -1.396 . . . . 0.0 109.73 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.443 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 41.1 p -62.29 -51.06 69.2 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.743 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.477 ' CE1' ' HD2' ' A' ' 25' ' ' LYS . 68.1 t60 -38.11 -59.51 0.85 Allowed 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.031 0.443 . . . . 0.0 110.192 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 86.0 mt -54.64 -59.65 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.654 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -40.67 -42.78 1.8 Allowed 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.5 t -101.35 -19.86 15.44 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 120.107 3.373 . . . . 0.0 120.107 -179.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.477 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 47.0 mttp -106.51 -14.62 15.01 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.472 ' O ' ' HA ' ' A' ' 30' ' ' LYS . 70.8 m-70 -122.75 -46.22 2.13 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 120.318 -0.553 . . . . 0.0 112.296 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.3 p -93.93 30.53 1.83 Allowed 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 118.146 -1.422 . . . . 0.0 108.178 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 29' ' ' GLU . 53.3 tptt -155.5 60.69 0.62 Allowed 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 31.0 tt0 129.83 -64.19 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.575 0 C-N-CA 126.178 1.791 . . . . 0.0 109.498 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.472 ' HA ' ' O ' ' A' ' 26' ' ' HIS . 0.1 OUTLIER . . . . . 0 N--CA 1.513 2.703 0 O-C-N 125.751 1.907 . . . . 0.0 106.403 -179.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.425 ' HD3' ' H ' ' A' ' 2' ' ' THR . 8.5 tmtt? . . . . . 0 N--CA 1.495 1.786 0 N-CA-C 105.58 -2.008 . . . . 0.0 105.58 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.425 ' H ' ' HD3' ' A' ' 1' ' ' LYS . 9.7 t -113.87 178.13 4.39 Favored 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 122.433 1.111 . . . . 0.0 113.005 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.406 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 4.9 m-85 -108.5 179.23 4.25 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-N 112.147 -2.297 . . . . 0.0 106.89 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.563 HE22 ' N ' ' A' ' 6' ' ' GLN . 8.6 tm0? -141.24 167.54 21.93 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 41.8 t -105.33 -68.61 0.85 Allowed 'General case' 0 N--CA 1.504 2.257 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.945 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.563 ' N ' HE22 ' A' ' 4' ' ' GLN . 3.1 tp-100 107.42 -27.09 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.572 0 O-C-N 125.816 1.947 . . . . 0.0 109.955 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -83.38 -46.02 13.03 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.768 0.668 . . . . 0.0 110.511 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -115.53 -40.85 3.33 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 109.42 49.03 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.176 0 O-C-N 126.887 2.617 . . . . 0.0 110.643 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.556 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 44.2 tp -98.39 158.97 15.25 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.556 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 55.7 mtt-85 -121.54 -176.91 3.41 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.297 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.442 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 24.0 t -141.24 -70.83 0.36 Allowed 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.738 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.442 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 108.49 -20.09 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.546 0 O-C-N 125.909 2.006 . . . . 0.0 109.047 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.459 ' O ' ' CB ' ' A' ' 15' ' ' SER . 3.6 p-10 -119.29 -45.42 2.54 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.459 ' CB ' ' O ' ' A' ' 14' ' ' ASP . 37.5 t 121.85 -51.02 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.878 0 C-N-CA 126.016 1.727 . . . . 0.0 109.596 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.1 t -47.85 -52.46 19.04 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.846 0.831 . . . . 0.0 111.922 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.437 HD22 ' N ' ' A' ' 17' ' ' ASN . 1.9 m120 -64.71 2.71 0.63 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-N 112.714 -2.039 . . . . 0.0 114.379 -179.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -106.52 -52.03 2.85 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 103.533 -2.766 . . . . 0.0 103.533 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.4 mtmm -54.29 -54.45 40.09 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.294 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.5 t -62.99 -39.71 95.55 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 123.79 0.682 . . . . 0.0 109.259 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.429 ' CG ' HD23 ' A' ' 10' ' ' LEU . 13.8 t60 -51.01 -63.3 1.17 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 123.996 0.81 . . . . 0.0 109.219 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.6 mt -46.84 -59.83 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.452 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -49.48 -31.99 11.18 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -93.4 -41.1 10.01 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 118.067 2.617 . . . . 0.0 118.067 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -92.29 -15.24 27.68 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 -121.28 -43.48 2.42 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 123.444 0.465 . . . . 0.0 111.243 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.6 m -109.26 38.11 2.4 Favored 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 122.112 0.958 . . . . 0.0 109.116 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 23.1 ttpp -12.58 92.36 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 112.192 -2.276 . . . . 0.0 116.286 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.36 39.18 1.63 Allowed 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? . . . . . 0 N--CA 1.496 1.864 0 CA-C-N 114.43 -1.259 . . . . 0.0 109.647 -179.775 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 103.586 -2.746 . . . . 0.0 103.586 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.473 HG22 ' H ' ' A' ' 3' ' ' TYR . 1.4 m -128.28 -163.1 1.24 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 112.215 -2.266 . . . . 0.0 109.429 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.473 ' H ' HG22 ' A' ' 2' ' ' THR . 25.4 m-85 -109.81 82.12 1.54 Allowed 'General case' 0 N--CA 1.492 1.668 1 N-CA-C 99.966 -4.087 . . . . 0.0 99.966 179.577 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 24.2 tt0 -107.73 161.67 14.67 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.606 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.513 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 36.0 t -87.0 162.61 17.54 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 113.163 -1.835 . . . . 0.0 108.632 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -122.73 36.79 4.56 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 124.297 0.998 . . . . 0.0 110.582 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 52.1 m-85 -136.08 -49.48 0.68 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.708 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 9' ' ' GLU . 27.3 p -111.82 -63.62 1.4 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.765 1.291 . . . . 0.0 110.605 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.484 ' HB3' ' O ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER 135.55 41.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.532 0 O-C-N 126.004 2.065 . . . . 0.0 108.932 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.469 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 49.7 tp -83.4 157.03 22.65 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.523 HH11 ' H ' ' A' ' 13' ' ' ALA . 10.9 ttp85 -119.55 119.53 34.07 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 125.279 1.612 . . . . 0.0 107.696 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -132.88 77.1 1.72 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.523 ' H ' HH11 ' A' ' 11' ' ' ARG . . . -75.75 68.55 2.33 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 122.717 1.246 . . . . 0.0 112.658 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -139.19 -61.35 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.567 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p 127.3 -62.1 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.476 0 O-C-N 126.803 2.564 . . . . 0.0 109.865 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 m -57.59 -54.92 41.46 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 121.49 0.662 . . . . 0.0 109.364 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -42.52 -51.73 4.97 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.605 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -56.62 -54.69 43.07 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.034 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -43.47 -59.04 2.31 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 124.105 0.878 . . . . 0.0 111.718 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.8 t -60.56 -48.42 81.85 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 117.373 -1.299 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -40.31 -64.55 0.5 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.427 1.012 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.4 mt -43.66 -64.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 124.606 1.191 . . . . 0.0 113.956 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -58.72 -32.6 69.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.7 p -104.14 23.98 12.17 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.8 mmmm -142.02 -28.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.416 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 85.9 m-70 -119.29 -56.21 2.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 124.828 1.33 . . . . 0.0 108.651 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.7 m 81.58 -60.42 0.21 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 126.092 2.12 . . . . 0.0 107.948 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 30' ' ' LYS . 22.3 tptm -142.06 -41.57 0.35 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 113.711 -1.586 . . . . 0.0 111.39 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 26.43 -68.98 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.434 0 O-C-N 127.385 2.928 . . . . 0.0 115.123 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 28' ' ' LYS . 20.1 mtpp . . . . . 0 N--CA 1.499 2.013 0 CA-C-O 122.486 1.136 . . . . 0.0 108.595 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 103.586 -2.746 . . . . 0.0 103.586 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.473 HG22 ' H ' ' A' ' 3' ' ' TYR . 1.4 m -128.28 -163.1 1.24 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 112.215 -2.266 . . . . 0.0 109.429 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.473 ' H ' HG22 ' A' ' 2' ' ' THR . 25.4 m-85 -109.81 82.12 1.54 Allowed 'General case' 0 N--CA 1.492 1.668 1 N-CA-C 99.966 -4.087 . . . . 0.0 99.966 179.577 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 24.2 tt0 -107.73 161.67 14.67 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.606 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.513 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 36.0 t -87.0 162.61 17.54 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 113.163 -1.835 . . . . 0.0 108.632 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -122.73 36.79 4.56 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 124.297 0.998 . . . . 0.0 110.582 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 52.1 m-85 -136.08 -49.48 0.68 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.708 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 9' ' ' GLU . 27.3 p -111.82 -63.62 1.4 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.765 1.291 . . . . 0.0 110.605 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.484 ' HB3' ' O ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER 135.55 41.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.532 0 O-C-N 126.004 2.065 . . . . 0.0 108.932 -179.808 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.469 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 49.7 tp -83.4 157.03 22.65 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.523 HH11 ' H ' ' A' ' 13' ' ' ALA . 10.9 ttp85 -119.55 119.53 34.07 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 125.279 1.612 . . . . 0.0 107.696 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -132.88 77.1 1.72 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.523 ' H ' HH11 ' A' ' 11' ' ' ARG . . . -75.75 68.55 2.33 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 122.717 1.246 . . . . 0.0 112.658 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -139.19 -61.35 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.567 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p 127.3 -62.1 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.476 0 O-C-N 126.803 2.564 . . . . 0.0 109.865 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 m -57.59 -54.92 41.46 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 121.49 0.662 . . . . 0.0 109.364 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -42.52 -51.73 4.97 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.605 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -56.62 -54.69 43.07 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.034 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -43.47 -59.04 2.31 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 124.105 0.878 . . . . 0.0 111.718 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.8 t -60.56 -48.42 81.85 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 117.373 -1.299 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -40.31 -64.55 0.5 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.427 1.012 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.4 mt -43.66 -64.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 124.606 1.191 . . . . 0.0 113.956 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -58.72 -32.6 69.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -179.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.7 p -104.14 23.98 12.17 Favored 'General case' 0 N--CA 1.507 2.402 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.8 mmmm -142.02 -28.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.416 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 85.9 m-70 -119.29 -56.21 2.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 124.828 1.33 . . . . 0.0 108.651 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.7 m 81.58 -60.42 0.21 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 126.092 2.12 . . . . 0.0 107.948 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 30' ' ' LYS . 22.3 tptm -142.06 -41.57 0.35 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 113.711 -1.586 . . . . 0.0 111.39 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 26.43 -68.98 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.434 0 O-C-N 127.385 2.928 . . . . 0.0 115.123 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 28' ' ' LYS . 20.1 mtpp . . . . . 0 N--CA 1.499 2.013 0 CA-C-O 122.486 1.136 . . . . 0.0 108.595 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.5 pttt . . . . . 0 N--CA 1.496 1.87 0 N-CA-C 104.802 -2.295 . . . . 0.0 104.802 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.5 m -121.07 166.84 13.32 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 112.92 -1.945 . . . . 0.0 112.549 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -119.04 76.91 1.14 Allowed 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 104.207 -2.516 . . . . 0.0 104.207 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -124.96 144.56 50.3 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 125.591 1.807 . . . . 0.0 108.565 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.0 t -63.38 163.16 11.15 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 114.24 -1.346 . . . . 0.0 113.211 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -126.28 38.88 4.05 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.519 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 80.8 m-85 -139.47 -47.58 0.47 Allowed 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 114.331 -1.304 . . . . 0.0 112.325 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.8 p -109.69 -65.37 1.16 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 124.037 0.836 . . . . 0.0 112.465 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 140.14 41.73 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.596 0 C-N-CA 126.487 1.915 . . . . 0.0 110.264 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.442 HD23 ' C ' ' A' ' 10' ' ' LEU . 6.8 tt -101.18 131.05 47.34 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.7 ptt85 -123.6 150.18 44.43 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 123.891 0.744 . . . . 0.0 110.032 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.557 ' CB ' HD21 ' A' ' 17' ' ' ASN . 53.7 p -128.25 -55.93 1.25 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 124.182 0.926 . . . . 0.0 112.076 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 118.03 -18.54 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.781 0 O-C-N 125.725 1.891 . . . . 0.0 109.542 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -129.3 -178.86 4.84 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 115.263 -0.881 . . . . 0.0 111.09 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.7 t -111.44 176.65 4.94 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.361 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.3 m 99.73 -52.02 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.549 0 C-N-CA 126.07 1.748 . . . . 0.0 106.691 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.557 HD21 ' CB ' ' A' ' 12' ' ' SER . 8.7 p-10 -79.86 -51.47 9.1 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.106 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.9 tp -60.87 -42.83 98.68 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.177 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -52.55 -60.5 3.16 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 61.0 m -48.54 -57.46 6.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 124.984 1.427 . . . . 0.0 109.907 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -40.08 -71.23 0.08 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 124.828 1.33 . . . . 0.0 110.926 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -47.42 -63.04 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.399 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -39.03 -53.68 1.76 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.0 t -106.02 5.65 30.52 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 118.022 2.601 . . . . 0.0 118.022 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -113.6 -25.33 8.77 Favored 'General case' 0 N--CA 1.504 2.27 0 CA-C-N 118.241 0.473 . . . . 0.0 111.645 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.519 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 62.4 m-70 -115.72 -40.25 3.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 123.928 0.768 . . . . 0.0 112.793 -179.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.2 t -91.74 -57.37 2.77 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 124.087 0.867 . . . . 0.0 111.563 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.403 ' HB3' ' NZ ' ' A' ' 28' ' ' LYS . 5.6 ttpm? -110.38 71.56 0.76 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 123.8 0.687 . . . . 0.0 109.188 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -52.45 89.4 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.078 0 O-C-N 124.065 0.853 . . . . 0.0 110.988 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.3 mttp . . . . . 0 N--CA 1.506 2.33 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 -179.916 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.672 0.748 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.0 m -118.78 165.8 13.57 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 103.463 -2.791 . . . . 0.0 103.463 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -121.87 162.09 21.6 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.856 0.836 . . . . 0.0 112.148 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.417 ' HG3' ' H ' ' A' ' 5' ' ' CYS . 56.5 tp60 -120.52 179.18 4.4 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 112.374 -2.194 . . . . 0.0 106.204 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.417 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 44.5 t -106.01 169.13 8.67 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -116.6 25.43 10.59 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 123.981 0.801 . . . . 0.0 109.789 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -141.39 -52.46 0.45 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.439 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.5 p -117.67 -125.91 0.28 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.74 25.56 3.38 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.834 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.673 HD22 ' H ' ' A' ' 11' ' ' ARG . 1.3 tm? -69.19 164.41 22.7 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.099 -1.04 . . . . 0.0 108.323 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.673 ' H ' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -132.68 147.9 52.34 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 112.507 -2.133 . . . . 0.0 108.256 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.43 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 68.9 m -126.34 -32.27 2.71 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -179.435 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.43 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 112.02 -53.29 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.487 0 O-C-N 126.307 2.254 . . . . 0.0 105.122 -179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.405 ' CG ' ' H ' ' A' ' 15' ' ' SER . 35.1 t70 -137.02 -172.19 3.13 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 113.831 -1.531 . . . . 0.0 107.13 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.405 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 43.1 t -101.61 51.08 0.84 Allowed 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.6 t -122.98 -36.95 2.79 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 112.096 -2.32 . . . . 0.0 106.825 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.9 m-20 -106.36 -1.98 22.72 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.885 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 tp -85.39 -51.69 6.38 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -43.48 -47.74 7.2 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.164 0.915 . . . . 0.0 109.697 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.8 p -59.76 -59.43 5.44 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.233 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.405 ' CE1' ' HG ' ' A' ' 10' ' ' LEU . 51.7 t60 -41.98 -53.5 3.84 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 123.63 0.581 . . . . 0.0 109.555 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 67.2 mt -53.08 -58.95 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 123.995 0.809 . . . . 0.0 111.429 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -45.87 -39.38 8.53 Favored 'General case' 0 N--CA 1.504 2.267 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.9 m -92.35 -38.89 11.78 Favored 'General case' 0 N--CA 1.506 2.341 0 N-CA-C 119.08 2.992 . . . . 0.0 119.08 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -98.3 -6.72 30.39 Favored 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.9 m-70 -129.33 -47.93 1.19 Allowed 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.2 p -10.13 -65.33 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.536 0 O-C-N 125.867 1.979 . . . . 0.0 113.408 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.3 tptt -134.23 163.29 29.94 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-N 113.156 -1.838 . . . . 0.0 106.853 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -127.41 58.53 1.46 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 106.26 -1.755 . . . . 0.0 106.26 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp . . . . . 0 N--CA 1.494 1.769 0 CA-C-N 113.259 -1.791 . . . . 0.0 109.611 -179.747 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 53.7 pttt . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 122.415 1.102 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.6 t -143.11 -156.32 0.67 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 113.428 -1.714 . . . . 0.0 107.534 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.7 m-85 -82.47 115.07 21.32 Favored 'General case' 0 N--CA 1.502 2.162 0 N-CA-C 106.231 -1.766 . . . . 0.0 106.231 179.894 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -106.77 171.81 7.16 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 123.37 0.419 . . . . 0.0 110.294 -179.683 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 40.5 t -98.64 166.15 11.47 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 123.292 0.37 . . . . 0.0 111.638 -179.692 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -121.32 27.8 8.14 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 124.163 0.914 . . . . 0.0 110.996 -179.704 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -134.76 -51.89 0.79 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.132 -179.706 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 32.1 p -109.37 -46.24 3.59 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.243 0.965 . . . . 0.0 111.673 -179.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 135.9 -52.03 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.323 0 O-C-N 125.935 2.022 . . . . 0.0 108.386 -179.848 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.5 tt -22.06 130.7 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.461 0 O-C-N 125.377 1.673 . . . . 0.0 113.892 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -111.76 168.18 9.77 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.18 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.7 m -125.37 178.6 5.52 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-N 112.103 -2.317 . . . . 0.0 108.512 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.43 -31.39 10.94 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.281 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -117.36 -160.34 0.77 Allowed 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.682 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.9 p -99.87 -55.89 2.52 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 t -43.75 -50.03 7.82 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 124.085 0.866 . . . . 0.0 110.689 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -49.5 -61.2 2.23 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 114.295 -1.32 . . . . 0.0 110.615 179.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.08 -52.94 62.5 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.825 -179.911 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -40.61 -56.39 2.12 Favored 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 121.848 0.832 . . . . 0.0 109.341 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 87.4 m -55.61 -58.48 7.64 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 113.357 -1.747 . . . . 0.0 109.32 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -39.35 -60.78 0.87 Allowed 'General case' 0 N--CA 1.506 2.34 0 O-C-N 124.318 1.012 . . . . 0.0 109.915 179.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.1 mm -48.27 -66.51 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.127 179.743 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -38.67 -46.2 1.2 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.6 t -93.32 -31.92 14.49 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 119.475 3.139 . . . . 0.0 119.475 -179.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -93.83 -17.1 23.44 Favored 'General case' 0 N--CA 1.503 2.179 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.772 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -122.55 -45.62 2.18 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 123.525 0.516 . . . . 0.0 111.525 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.1 p 45.08 16.06 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -179.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -118.54 -179.09 3.69 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-O 121.586 0.708 . . . . 0.0 110.455 -179.863 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -91.85 -49.51 6.21 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.068 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? . . . . . 0 N--CA 1.496 1.831 0 O-C-N 124.488 1.118 . . . . 0.0 109.968 179.8 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? . . . . . 0 N--CA 1.484 1.258 0 N-CA-C 105.486 -2.042 . . . . 0.0 105.486 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.1 m -111.29 167.25 10.43 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.163 -1.586 . . . . 0.0 111.037 0.148 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.407 ' CE2' ' HB2' ' A' ' 15' ' ' SER . 19.3 m-85 -129.89 152.06 49.78 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.778 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.5 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 7.4 tt0 -126.68 169.71 12.86 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 179.69 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.511 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 51.5 t -100.84 154.54 18.56 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.758 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -127.04 42.99 3.21 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.511 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 63.9 m-85 -133.93 -51.17 0.84 Allowed 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 113.182 -1.827 . . . . 0.0 108.321 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 9' ' ' GLU . 22.1 p -112.94 -52.98 2.75 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.547 1.154 . . . . 0.0 109.972 179.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 4.1 tm-20 148.79 -46.93 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.568 0 O-C-N 125.609 1.818 . . . . 0.0 107.813 -179.685 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.429 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 0.9 OUTLIER -20.64 149.88 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.555 0 N-CA-C 116.693 2.108 . . . . 0.0 116.693 -179.845 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.429 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 2.3 ptm180 -106.1 155.54 19.32 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.226 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.2 t -134.63 159.37 41.43 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 114.165 -1.38 . . . . 0.0 107.839 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.14 -63.62 1.02 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 179.814 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -137.0 169.92 16.97 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 120.45 -0.5 . . . . 0.0 109.696 179.69 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.407 ' HB2' ' CE2' ' A' ' 3' ' ' TYR . 39.3 t -47.77 -51.73 21.3 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 179.567 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 87.0 p -35.09 -37.38 0.07 Allowed 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 111.62 -2.537 . . . . 0.0 113.983 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -97.83 -48.4 5.2 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 124.255 0.972 . . . . 0.0 109.529 -179.783 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.9 tp -39.2 -47.3 1.61 Allowed 'General case' 0 N--CA 1.503 2.217 0 CA-C-O 122.044 0.926 . . . . 0.0 111.147 179.548 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -42.64 -48.21 5.42 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.62 179.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.8 p -73.9 -41.94 61.38 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.851 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -43.98 -56.05 4.22 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 179.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.8 mt -49.6 -66.03 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-N 113.706 -1.588 . . . . 0.0 108.986 179.52 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -32.8 -43.46 0.09 Allowed 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 179.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 51.1 m -89.26 -45.56 9.43 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.148 2.647 . . . . 0.0 118.148 -179.539 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.41 ' HB3' ' NZ ' ' A' ' 25' ' ' LYS . 3.5 mmmp? -83.89 -18.08 38.63 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 -179.332 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -124.28 -105.14 0.36 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 123.611 0.569 . . . . 0.0 111.067 -179.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 54.6 m 19.93 71.93 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -179.868 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -106.58 56.76 0.65 Allowed 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 112.559 -2.109 . . . . 0.0 109.583 -179.936 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -125.28 -42.6 1.98 Allowed 'General case' 0 N--CA 1.499 2.009 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.426 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp . . . . . 0 N--CA 1.504 2.259 0 O-C-N 125.964 2.04 . . . . 0.0 116.275 -179.936 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.466 HG22 ' H ' ' A' ' 3' ' ' TYR . 2.4 m -121.47 -165.71 1.28 Allowed 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.466 ' H ' HG22 ' A' ' 2' ' ' THR . 6.4 m-85 -83.92 85.28 7.34 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 101.713 -3.44 . . . . 0.0 101.713 179.509 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -106.51 162.75 13.45 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -179.402 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 38.9 t -72.82 165.98 23.82 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 114.033 -1.44 . . . . 0.0 112.158 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -125.16 24.63 7.41 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.265 -179.918 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -127.5 -47.9 1.42 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.135 -179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.441 ' SG ' ' N ' ' A' ' 9' ' ' GLU . 30.5 p -116.02 -114.72 0.33 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.441 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 16.0 tp10 -136.81 -40.08 0.62 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 123.761 0.663 . . . . 0.0 112.442 -179.794 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -28.77 136.22 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -179.561 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.7 ptp180 -128.83 158.35 38.95 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.4 179.458 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -114.41 -163.13 0.85 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 105.308 -2.108 . . . . 0.0 105.308 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.47 -48.48 2.87 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -132.64 175.79 9.01 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 113.991 -1.459 . . . . 0.0 107.411 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.2 p -38.6 -36.97 0.28 Allowed 'General case' 0 N--CA 1.508 2.462 0 CA-C-O 122.789 1.28 . . . . 0.0 109.659 179.337 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 17' ' ' ASN . 27.8 m -108.27 134.22 51.4 Favored 'General case' 0 C--N 1.308 -1.207 1 N-CA-C 98.925 -4.472 . . . . 0.0 98.925 179.798 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.531 ' H ' HD22 ' A' ' 17' ' ' ASN . 0.0 OUTLIER -104.5 65.25 0.77 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 118.877 -2.389 . . . . 0.0 113.32 0.49 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.8 tp -99.82 -50.93 3.87 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-N 113.485 -1.689 . . . . 0.0 107.34 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -36.64 -61.13 0.55 Allowed 'General case' 0 N--CA 1.507 2.392 0 O-C-N 124.082 0.863 . . . . 0.0 110.649 179.454 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.8 t -47.93 -49.72 29.21 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 113.833 -1.53 . . . . 0.0 111.539 179.767 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.454 ' ND1' ' HD2' ' A' ' 25' ' ' LYS . 74.6 t60 -48.88 -71.66 0.06 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 124.033 0.833 . . . . 0.0 110.788 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 51.3 mt -43.46 -48.47 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 124.362 1.039 . . . . 0.0 112.339 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -56.96 -55.98 27.66 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 92.8 m -79.59 -32.59 41.96 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 119.642 3.201 . . . . 0.0 119.642 -179.256 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.454 ' HD2' ' ND1' ' A' ' 21' ' ' HIS . 53.4 mttp -96.84 -11.71 24.49 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -179.312 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -129.44 -59.86 1.07 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.2 m -45.93 -65.64 0.52 Allowed 'General case' 0 N--CA 1.505 2.323 0 O-C-N 123.903 0.752 . . . . 0.0 111.21 -179.845 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 37.8 pttt -120.31 109.73 15.72 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 179.601 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -113.08 50.62 0.87 Allowed 'General case' 0 N--CA 1.497 1.896 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.678 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.7 pttp . . . . . 0 N--CA 1.506 2.366 0 N-CA-C 117.12 2.267 . . . . 0.0 117.12 179.662 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 98.2 mttt . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 119.235 -0.412 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.7 m -118.53 164.68 14.94 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.059 -1.65 . . . . 0.0 108.399 -0.06 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -123.49 154.08 39.63 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 124.324 1.015 . . . . 0.0 109.432 179.954 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -129.41 166.92 18.61 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 39.8 t -83.85 161.18 20.99 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -122.95 32.98 5.53 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 123.771 0.669 . . . . 0.0 110.575 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -137.21 -42.24 0.57 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.997 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.8 p -110.77 -59.52 1.95 Allowed 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 160.74 -46.85 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.327 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -27.5 148.33 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 O-C-N 125.634 1.834 . . . . 0.0 115.123 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.6 ttm-85 -109.99 153.82 24.02 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.767 -179.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.7 p -124.55 -174.91 3.13 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 179.949 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.05 -61.81 1.69 Allowed 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 120.557 -0.457 . . . . 0.0 109.906 -179.973 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.719 ' H ' HD21 ' A' ' 17' ' ' ASN . 39.4 m-20 -125.48 177.12 6.37 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 124.368 1.042 . . . . 0.0 112.159 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.6 t -94.99 46.62 1.13 Allowed 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 122.93 1.348 . . . . 0.0 110.629 -179.689 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.407 ' H ' ' H ' ' A' ' 17' ' ' ASN . 92.0 p -128.53 -28.38 2.52 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 112.672 -2.058 . . . . 0.0 105.979 179.572 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.719 HD21 ' H ' ' A' ' 14' ' ' ASP . 1.1 p30 -107.09 -49.43 3.28 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 113.042 -1.89 . . . . 0.0 110.894 -179.869 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 62.1 tp -40.82 -45.11 2.4 Favored 'General case' 0 N--CA 1.509 2.485 0 CA-C-N 117.977 0.353 . . . . 0.0 111.25 179.778 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -49.71 -60.79 2.56 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.949 179.624 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.5 t -50.47 -43.14 55.28 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 124.219 0.949 . . . . 0.0 111.286 -179.723 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -55.45 -64.14 0.94 Allowed 'General case' 0 N--CA 1.5 2.073 0 O-C-N 124.25 0.969 . . . . 0.0 109.273 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -49.41 -63.43 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.002 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -38.91 -33.15 0.1 Allowed 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -179.932 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.1 m -97.1 -44.08 7.12 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 118.283 2.697 . . . . 0.0 118.283 -179.383 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -91.37 -12.97 33.33 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 115.286 1.588 . . . . 0.0 115.286 -179.366 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -127.2 -40.79 1.81 Allowed 'General case' 0 N--CA 1.496 1.87 0 O-C-N 123.733 0.645 . . . . 0.0 110.951 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 t 62.47 41.55 9.71 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-N 114.15 -1.386 . . . . 0.0 108.002 -179.75 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? 0.28 66.98 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.393 0 N-CA-C 117.093 2.257 . . . . 0.0 117.093 -179.928 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 26.92 53.02 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 CA-C-O 122.855 1.312 . . . . 0.0 112.63 -179.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 85.2 tttt . . . . . 0 N--CA 1.495 1.793 0 CA-C-N 112.017 -2.356 . . . . 0.0 108.651 -179.937 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp . . . . . 0 N--CA 1.494 1.775 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.444 HG22 ' H ' ' A' ' 3' ' ' TYR . 35.5 m 87.92 168.63 0.05 Allowed 'General case' 0 N--CA 1.508 2.428 0 O-C-N 125.52 1.763 . . . . 0.0 109.117 179.808 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.444 ' H ' HG22 ' A' ' 2' ' ' THR . 57.1 m-85 -107.69 75.31 1.0 Allowed 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 105.375 -2.083 . . . . 0.0 105.375 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.403 ' HG2' ' N ' ' A' ' 5' ' ' CYS . 51.3 tt0 -122.81 173.66 7.62 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-N 111.196 -2.729 . . . . 0.0 106.286 179.763 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.548 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 51.1 t -97.43 156.93 16.26 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.631 -179.868 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -121.46 37.08 4.43 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 124.268 0.98 . . . . 0.0 109.355 -179.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -133.12 -50.4 0.88 Allowed 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.093 -1.412 . . . . 0.0 109.043 179.867 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 27.5 p -113.25 -51.77 2.8 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 124.509 1.131 . . . . 0.0 108.431 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 33.7 tt0 112.97 61.08 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.599 0 O-C-N 126.305 2.253 . . . . 0.0 110.79 179.799 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.548 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 8.2 tt -107.37 135.66 48.48 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 104.642 -2.355 . . . . 0.0 104.642 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.401 ' HA ' ' HA ' ' A' ' 4' ' ' GLN . 19.1 ttt180 -115.16 147.72 39.91 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-O 121.838 0.828 . . . . 0.0 111.301 -179.906 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 62.2 m -118.64 -48.35 2.49 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-N 112.859 -1.973 . . . . 0.0 106.201 179.794 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.415 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 108.77 -38.22 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.431 0 O-C-N 126.633 2.458 . . . . 0.0 109.089 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -122.12 -176.67 3.4 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.978 -179.847 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.47 161.57 18.4 Favored 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 -179.985 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 71.0 m -112.2 41.07 2.05 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 123.014 2.643 . . . . 0.0 107.88 0.019 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -72.04 -41.7 67.16 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 103.085 -2.931 . . . . 0.0 103.085 179.743 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.4 tp -57.08 -51.89 67.48 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.434 179.527 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -45.38 -58.52 3.27 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 179.708 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.6 m -48.35 -56.86 7.01 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.213 179.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -45.31 -67.5 0.28 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.828 0.705 . . . . 0.0 109.701 179.642 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.8 mm -37.92 -57.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 124.622 1.201 . . . . 0.0 112.775 179.835 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -58.16 -40.27 80.97 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 63.9 p -88.41 -32.13 18.49 Favored 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -179.592 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -92.77 -24.74 18.46 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 123.73 0.644 . . . . 0.0 110.895 -179.943 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -127.55 29.77 5.45 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 123.892 0.745 . . . . 0.0 111.881 179.979 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.8 t -32.73 -36.49 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 179.372 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -95.09 163.04 13.47 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 123.899 0.749 . . . . 0.0 110.91 -179.43 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -116.7 141.17 48.55 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.909 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 87.3 tttt . . . . . 0 N--CA 1.504 2.232 0 CA-C-N 121.643 2.02 . . . . 0.0 108.24 -0.117 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 49.4 tttm . . . . . 0 N--CA 1.492 1.632 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.462 HG22 ' H ' ' A' ' 3' ' ' TYR . 62.9 m -127.54 177.71 6.58 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.811 -1.54 . . . . 0.0 107.568 -179.87 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.462 ' H ' HG22 ' A' ' 2' ' ' THR . 7.2 m-85 -89.24 101.7 14.37 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.497 ' HG2' ' H ' ' A' ' 5' ' ' CYS . 1.6 tt0 -113.61 -170.68 1.74 Allowed 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 103.853 -2.647 . . . . 0.0 103.853 179.579 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.497 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 50.1 t -107.04 158.35 17.12 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -122.9 36.09 4.73 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 179.807 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.422 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 86.3 m-85 -137.94 -54.78 0.66 Allowed 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 113.961 -1.472 . . . . 0.0 108.779 179.966 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.3 p -117.6 -129.38 0.29 Allowed 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 102.302 -3.222 . . . . 0.0 102.302 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -147.64 52.2 1.05 Allowed 'General case' 0 N--CA 1.501 2.089 0 O-C-N 123.692 0.62 . . . . 0.0 111.967 -179.696 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.9 tt -107.62 148.87 28.76 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.23 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -107.04 145.27 32.56 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 124.585 1.178 . . . . 0.0 108.005 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.407 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 58.3 m -114.9 -43.51 3.11 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.754 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.407 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 110.15 -60.76 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.291 0 O-C-N 126.55 2.406 . . . . 0.0 105.621 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -135.9 162.47 32.75 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.859 1.35 . . . . 0.0 110.283 179.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.426 ' HA ' ' CE2' ' A' ' 3' ' ' TYR . 1.9 t -37.01 -52.7 0.97 Allowed 'General case' 0 N--CA 1.505 2.32 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.049 179.588 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.7 t -27.86 -41.42 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 CA-C-N 112.91 -1.95 . . . . 0.0 116.187 179.813 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -105.04 -37.66 6.86 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 123.693 0.62 . . . . 0.0 111.077 -179.564 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 tp -48.5 -27.29 2.61 Favored 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.478 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 10.2 mtpm? -106.46 124.73 50.04 Favored 'General case' 0 C--N 1.308 -1.207 1 N-CA-C 96.08 -5.526 . . . . 0.0 96.08 178.814 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 19.2 p -97.38 26.83 4.58 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 119.256 -2.152 . . . . 0.0 114.605 0.678 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.412 ' ND1' ' HD2' ' A' ' 25' ' ' LYS . 80.0 t60 -44.07 -61.15 1.57 Allowed 'General case' 0 N--CA 1.507 2.377 0 CA-C-N 119.647 1.112 . . . . 0.0 109.963 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.4 mt -56.03 -69.75 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.258 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.458 ' HB3' ' HB ' ' A' ' 20' ' ' THR . 40.5 ttmt -31.99 -48.51 0.16 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 179.783 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.4 m -95.13 -26.44 16.01 Favored 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 118.312 2.708 . . . . 0.0 118.312 -179.257 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.412 ' HD2' ' ND1' ' A' ' 21' ' ' HIS . 55.5 mttp -101.71 -10.69 19.76 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 -179.459 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.4 m-70 -129.05 -35.47 1.83 Allowed 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 115.549 1.685 . . . . 0.0 115.549 -179.952 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.1 t -93.04 -55.19 3.43 Favored 'General case' 0 N--CA 1.501 2.083 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -179.453 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -89.32 -61.85 1.61 Allowed 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.662 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 85.36 -45.01 0.06 Allowed 'General case' 0 N--CA 1.506 2.341 0 O-C-N 125.431 1.707 . . . . 0.0 109.636 179.828 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp . . . . . 0 N--CA 1.495 1.82 0 CA-C-N 114.218 -1.356 . . . . 0.0 109.373 -179.968 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 11.2 pttp . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.762 0.791 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.7 m -107.43 169.2 8.73 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.882 -179.864 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -114.21 108.06 16.45 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 114.443 -1.253 . . . . 0.0 108.27 -179.879 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.7 tp60 -113.28 178.77 4.17 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.475 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 42.0 t -106.94 159.07 16.55 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 120.072 -0.651 . . . . 0.0 112.127 -179.912 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -123.21 33.52 5.36 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.02 -1.445 . . . . 0.0 110.292 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -134.74 -49.12 0.76 Allowed 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.682 -1.144 . . . . 0.0 108.278 179.894 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.6 p -115.66 -63.12 1.5 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 124.331 1.019 . . . . 0.0 109.568 179.794 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 132.79 49.25 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.575 0 C-N-CA 127.345 2.258 . . . . 0.0 109.592 -179.941 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.475 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 6.5 tt -98.22 153.27 18.61 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 179.856 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.9 ttm105 -107.73 137.25 46.09 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.973 -1.467 . . . . 0.0 109.432 -179.66 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.42 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 29.1 t -116.81 -51.54 2.57 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-N 113.854 -1.521 . . . . 0.0 107.669 179.874 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 12' ' ' SER . . . 92.09 -32.94 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.321 0 O-C-N 126.296 2.247 . . . . 0.0 110.385 179.982 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -136.58 136.23 39.08 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 124.253 0.971 . . . . 0.0 110.379 -179.872 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 53.4 p -39.75 -50.3 2.34 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 124.05 0.844 . . . . 0.0 109.555 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.9 t -29.82 -41.38 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 O-C-N 125.627 1.829 . . . . 0.0 115.39 179.593 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -102.29 -40.81 6.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 123.787 0.68 . . . . 0.0 109.696 -179.643 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -46.31 -42.92 15.37 Favored 'General case' 0 N--CA 1.505 2.31 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 179.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -45.85 -68.65 0.18 Allowed 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.905 179.347 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.5 p -53.94 -45.98 71.42 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 113.531 -1.668 . . . . 0.0 111.145 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.468 ' CE1' HD13 ' A' ' 10' ' ' LEU . 74.0 t60 -46.47 -65.38 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.671 1.232 . . . . 0.0 112.054 -179.954 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.7 mt -49.9 -56.65 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 124.292 0.995 . . . . 0.0 111.963 -179.645 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -51.12 -48.59 61.71 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -179.806 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 m -82.17 -37.09 26.64 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 118.609 2.818 . . . . 0.0 118.609 -179.218 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -96.31 -15.28 22.01 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -179.65 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -126.4 15.53 7.71 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.686 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.1 m -9.63 -58.33 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.571 0 N-CA-C 115.789 1.774 . . . . 0.0 115.789 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -114.53 62.04 0.67 Allowed 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 114.042 -1.436 . . . . 0.0 108.652 -179.945 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -9.14 -67.46 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 CA-C-N 112.982 -1.917 . . . . 0.0 115.504 -179.783 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.506 ' HB3' ' NZ ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 122.391 1.091 . . . . 0.0 111.661 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.9 pttm . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 120.366 0.127 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.7 p -114.85 171.79 7.44 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 122.397 1.094 . . . . 0.0 112.573 -179.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.433 ' CE1' ' HA ' ' A' ' 14' ' ' ASP . 6.6 m-85 -114.02 165.06 13.01 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.136 -2.302 . . . . 0.0 106.197 179.852 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -131.91 164.15 26.74 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 179.704 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.468 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 42.3 t -106.34 159.34 16.21 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 105.903 -1.888 . . . . 0.0 105.903 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.449 ' NE2' ' N ' ' A' ' 6' ' ' GLN . 0.0 OUTLIER -122.82 35.03 4.98 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.887 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -132.36 -50.76 0.93 Allowed 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.81 -1.541 . . . . 0.0 108.676 179.9 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.5 p -112.69 -42.13 3.68 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.215 0.947 . . . . 0.0 109.282 179.849 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 97.19 54.07 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.138 0 O-C-N 126.265 2.228 . . . . 0.0 109.956 179.809 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.468 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 5.5 tt -104.23 148.32 26.47 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 103.434 -2.802 . . . . 0.0 103.434 179.652 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.453 ' HD2' ' C ' ' A' ' 10' ' ' LEU . 5.4 mpt_? -108.69 141.89 39.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 124.362 1.039 . . . . 0.0 110.69 -179.501 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.5 m -124.13 -166.47 1.5 Allowed 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 113.305 -1.77 . . . . 0.0 108.75 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -104.89 -42.82 5.24 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.753 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.613 ' H ' HD21 ' A' ' 17' ' ' ASN . 34.5 t70 -129.92 -165.54 1.55 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 123.94 0.775 . . . . 0.0 109.698 -179.803 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.496 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 45.5 t -93.01 -42.55 9.37 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 179.735 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.8 m -47.3 -43.69 22.77 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-O 121.944 0.878 . . . . 0.0 110.802 179.861 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.613 HD21 ' H ' ' A' ' 14' ' ' ASP . 16.8 p30 -83.53 -24.48 31.63 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.623 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.401 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 27.4 tp -67.79 -46.55 71.64 Favored 'General case' 0 N--CA 1.506 2.37 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -51.28 -52.45 44.95 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 179.359 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.0 m -57.36 -53.21 60.75 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.882 179.549 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 26.7 t60 -40.44 -59.59 1.29 Allowed 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.348 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -51.69 -60.47 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.96 179.633 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -34.89 -50.13 0.47 Allowed 'General case' 0 N--CA 1.503 2.206 0 O-C-N 124.539 1.15 . . . . 0.0 113.038 179.555 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.47 ' HA ' ' HB2' ' A' ' 28' ' ' LYS . 24.3 m -114.64 45.89 1.49 Allowed 'General case' 0 N--CA 1.501 2.12 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -179.751 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -156.09 -37.15 0.08 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 121.389 0.614 . . . . 0.0 110.406 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -119.65 -38.58 2.97 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-N 114.203 -1.362 . . . . 0.0 113.28 -179.252 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 p -113.48 51.43 0.85 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.275 0.985 . . . . 0.0 112.618 -179.596 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.47 ' HB2' ' HA ' ' A' ' 24' ' ' THR . 1.1 tmmm? -127.26 -67.79 0.82 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 103.547 -2.761 . . . . 0.0 103.547 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.597 ' H ' ' CD ' ' A' ' 29' ' ' GLU . 12.3 mp0 -6.56 79.78 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.099 0 O-C-N 126.676 2.485 . . . . 0.0 113.854 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.4 ttmt . . . . . 0 N--CA 1.496 1.863 0 CA-C-O 122.513 1.149 . . . . 0.0 108.838 -179.879 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.8 pttp . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 69.0 p -107.55 165.95 11.03 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.835 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.467 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 1.0 OUTLIER -131.27 167.28 19.48 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 105.569 -2.011 . . . . 0.0 105.569 179.895 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -126.53 165.87 18.33 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 179.588 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.443 ' HB3' ' H ' ' A' ' 10' ' ' LEU . 44.8 t -94.49 -66.19 0.93 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.96 -179.945 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' A' ' 5' ' ' CYS . 28.2 tt0 90.92 -10.5 0.28 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 125.13 1.519 . . . . 0.0 111.53 179.885 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -91.7 -47.51 7.33 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.733 -179.769 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.2 p -111.45 -24.26 10.27 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.925 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 94.16 53.61 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 126.775 2.03 . . . . 0.0 111.084 179.446 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.449 ' HG ' ' N ' ' A' ' 11' ' ' ARG . 11.5 tp -107.64 162.34 14.06 Favored 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 114.122 -1.399 . . . . 0.0 107.482 179.79 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.449 ' N ' ' HG ' ' A' ' 10' ' ' LEU . 15.3 ttt85 -125.27 157.94 35.35 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 179.452 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.9 m -122.54 176.02 6.15 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.411 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.25 -47.59 2.93 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 124.676 1.235 . . . . 0.0 110.018 -179.903 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -123.45 162.59 22.53 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 123.761 0.663 . . . . 0.0 110.192 -179.974 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.6 p -50.42 -47.64 56.55 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-O 121.837 0.827 . . . . 0.0 108.92 179.584 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.5 m -56.63 -55.16 37.45 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.4 -1.727 . . . . 0.0 108.192 -179.989 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -40.69 -54.23 2.64 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.873 179.727 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -64.04 -57.17 10.45 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.831 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp -39.92 -54.7 2.14 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 124.201 0.938 . . . . 0.0 110.932 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.2 p -60.44 -54.43 45.64 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.065 -179.99 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 44.6 t60 -42.98 -59.17 2.11 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 119.611 -0.835 . . . . 0.0 109.536 179.802 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.38 -69.71 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 124.277 0.985 . . . . 0.0 109.756 179.522 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mmtm -41.51 -34.17 0.53 Allowed 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 -179.762 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.0 m -91.46 -41.46 10.83 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 118.658 2.836 . . . . 0.0 118.658 -179.549 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -103.56 -4.9 23.3 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -132.76 -40.92 0.95 Allowed 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -179.944 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 81.7 p 40.52 54.55 2.97 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 125.187 1.554 . . . . 0.0 107.191 -179.198 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 30' ' ' LYS . 22.5 ttmm 58.19 65.69 1.24 Allowed 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 112.067 -2.333 . . . . 0.0 104.847 -179.559 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 37.84 -77.58 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.049 0 CA-C-N 112.163 -2.29 . . . . 0.0 113.544 -179.487 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.016 0 CA-C-O 122.25 1.024 . . . . 0.0 108.722 179.758 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 99.0 mttt . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.67 0.748 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.476 HG22 ' H ' ' A' ' 3' ' ' TYR . 95.5 m -129.28 174.77 9.3 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 179.594 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.518 ' CE1' ' HB2' ' A' ' 15' ' ' SER . 82.9 m-85 -123.05 76.27 1.36 Allowed 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 179.876 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -111.94 163.77 13.87 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 104.284 -2.487 . . . . 0.0 104.284 -179.962 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.6 t -103.21 153.79 20.0 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.817 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -119.79 35.81 4.72 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 122.131 0.967 . . . . 0.0 109.278 -179.812 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -131.52 -52.25 1.01 Allowed 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 113.772 -1.558 . . . . 0.0 107.676 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.7 p -119.86 -116.82 0.32 Allowed 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 103.538 -2.764 . . . . 0.0 103.538 179.717 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -161.94 58.8 0.25 Allowed 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.395 0.617 . . . . 0.0 109.81 179.74 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.1 tt -107.28 115.25 29.84 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 179.816 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -116.31 137.04 52.48 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.587 -179.834 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.5 p -128.38 -174.84 3.33 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-N 112.486 -2.143 . . . . 0.0 109.0 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.07 -23.88 8.82 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.52 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -115.12 174.76 5.82 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.364 1.04 . . . . 0.0 110.687 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.518 ' HB2' ' CE1' ' A' ' 3' ' ' TYR . 22.2 t -115.23 52.45 0.87 Allowed 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 p -110.72 -45.17 3.53 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 112.999 -1.91 . . . . 0.0 110.432 -179.698 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -106.44 -14.65 15.02 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 125.383 1.677 . . . . 0.0 113.085 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 tp -74.13 -53.7 9.35 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.676 -179.875 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -47.85 -48.31 31.08 Favored 'General case' 0 N--CA 1.5 2.067 0 CA-C-O 121.196 0.522 . . . . 0.0 109.795 179.669 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.3 p -65.6 -52.4 52.37 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.263 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -36.3 -64.55 0.32 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 123.954 0.784 . . . . 0.0 110.354 179.58 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.6 mt -51.52 -61.01 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 123.751 0.657 . . . . 0.0 111.152 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -38.18 -43.31 0.75 Allowed 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.9 p -98.63 -38.7 9.02 Favored 'General case' 0 N--CA 1.508 2.455 0 N-CA-C 120.008 3.336 . . . . 0.0 120.008 -179.407 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -79.1 -26.27 42.96 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -179.235 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -116.04 -59.31 2.0 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.7 t 76.85 -56.54 0.55 Allowed 'General case' 0 N--CA 1.507 2.414 0 O-C-N 125.124 1.515 . . . . 0.0 111.7 179.797 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -123.72 -174.97 3.1 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 113.67 -1.604 . . . . 0.0 109.449 -179.949 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -122.0 82.84 2.01 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 179.893 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.506 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.886 0 O-C-N 119.721 -1.862 . . . . 0.0 111.105 -0.14 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_