data_1qk7_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 1qk7 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 109.454 -1.459 . . . . 0.0 109.454 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 67.1 m -98.73 -5.86 30.6 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.501 -0.999 . . . . 0.0 110.878 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.42 119.09 10.38 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.106 -0.997 . . . . 0.0 109.846 179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.39 -23.11 4.9 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.77 132.37 50.72 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.309 -1.112 . . . . 0.0 109.879 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -81.01 149.72 29.18 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.42 -0.8 . . . . 0.0 110.3 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.0 p -149.94 165.19 33.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.476 -0.765 . . . . 0.0 110.601 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -135.45 -57.85 0.79 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.584 -0.698 . . . . 0.0 110.34 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -139.27 -59.21 0.58 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.35 -0.844 . . . . 0.0 110.336 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -120.87 41.63 3.24 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.474 -0.766 . . . . 0.0 110.233 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -62.8 -53.85 47.92 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.355 -0.841 . . . . 0.0 110.008 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 107.9 75.85 0.93 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 98.8 m -79.25 169.93 17.38 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.439 -1.036 . . . . 0.0 109.389 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.0 m -67.68 161.95 24.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.251 -0.906 . . . . 0.0 110.017 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.5 p -58.8 120.41 8.93 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.404 -0.81 . . . . 0.0 109.907 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.99 -17.53 44.68 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.416 ' HB3' ' HB3' ' A' ' 26' ' ' CYS . 27.8 m-85 -95.05 147.41 23.44 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.24 -1.153 . . . . 0.0 110.283 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 t -128.59 162.44 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.507 -0.746 . . . . 0.0 110.081 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -88.63 110.7 21.15 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.353 -0.842 . . . . 0.0 110.217 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.417 ' CB ' ' CZ3' ' A' ' 25' ' ' TRP . 0.5 OUTLIER -84.08 153.13 23.95 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.494 -0.754 . . . . 0.0 110.396 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -90.57 -4.05 57.14 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.417 -0.802 . . . . 0.0 111.164 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.5 m -77.77 -66.74 0.8 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.97 -1.081 . . . . 0.0 110.224 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.594 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 11.8 m95 -104.36 6.8 35.43 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.467 -0.77 . . . . 0.0 110.152 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.2 mttt 52.32 65.22 1.57 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.482 -0.761 . . . . 0.0 110.725 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.594 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -151.35 172.03 16.56 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.319 -0.863 . . . . 0.0 110.842 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.416 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 72.5 m -79.67 118.61 21.65 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.496 -0.753 . . . . 0.0 109.863 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.558 ' HB ' ' CZ2' ' A' ' 25' ' ' TRP . 1.6 p -121.69 160.72 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.497 -0.752 . . . . 0.0 110.529 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.53 127.08 31.4 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.167 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.82 117.79 9.42 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.539 -0.726 . . . . 0.0 110.249 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.465 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.856 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.464 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.439 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 93.2 m -110.35 13.58 22.86 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.473 -1.016 . . . . 0.0 110.893 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 tt -65.95 115.06 5.63 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.068 -1.02 . . . . 0.0 110.382 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.88 -29.77 3.48 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.402 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 35.9 t70 -64.88 156.8 29.76 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.403 -1.057 . . . . 0.0 110.538 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.25 149.95 22.85 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.412 -0.805 . . . . 0.0 110.51 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.456 ' SG ' ' SG ' ' A' ' 13' ' ' CYS . 0.1 OUTLIER -105.28 23.46 13.67 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.412 -0.805 . . . . 0.0 110.669 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -116.99 -44.84 2.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.233 -0.917 . . . . 0.0 110.487 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.76 -57.86 6.23 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.439 -0.788 . . . . 0.0 110.499 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -108.82 -26.35 10.33 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.481 -0.762 . . . . 0.0 110.782 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.4 t30 53.26 50.14 18.29 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.497 -0.752 . . . . 0.0 110.298 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -141.02 85.08 0.21 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 81.8 m -83.83 -169.85 2.78 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.654 -0.909 . . . . 0.0 110.7 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.439 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 0.8 OUTLIER -77.82 175.45 9.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.457 -0.777 . . . . 0.0 110.183 179.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 55.6 p -69.01 114.89 7.7 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.334 -0.854 . . . . 0.0 110.111 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.6 4.39 55.97 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 110.229 -1.149 . . . . 0.0 110.229 -179.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.473 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 3.3 m-85 -100.27 144.12 29.66 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.048 -1.266 . . . . 0.0 109.904 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.6 m -123.44 161.47 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.467 -0.77 . . . . 0.0 110.71 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 m -82.6 114.05 20.72 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.592 -0.693 . . . . 0.0 109.891 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.477 ' CB ' ' CZ3' ' A' ' 25' ' ' TRP . 0.3 OUTLIER -70.89 153.13 42.97 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.401 -0.812 . . . . 0.0 110.604 -179.776 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.45 10.76 23.94 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.581 -0.699 . . . . 0.0 110.88 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.5 m -103.15 -78.71 0.54 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.126 -0.984 . . . . 0.0 110.044 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.631 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 23.9 m95 -89.74 6.62 40.77 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.252 -0.905 . . . . 0.0 110.607 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.9 mptt 53.31 54.85 9.57 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.42 -0.8 . . . . 0.0 110.296 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.631 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -136.32 173.53 11.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.292 -0.88 . . . . 0.0 110.723 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.402 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 85.8 m -73.68 131.19 41.37 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.476 -0.765 . . . . 0.0 111.1 -178.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.442 HG21 ' CE2' ' A' ' 25' ' ' TRP . 2.9 t -135.63 161.67 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.66 -0.65 . . . . 0.0 109.856 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.3 mt -74.52 134.25 42.24 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.441 -0.787 . . . . 0.0 110.23 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.93 128.05 32.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.515 -0.74 . . . . 0.0 110.21 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.603 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.788 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.429 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 13.0 m 59.66 38.04 22.12 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.64 -0.918 . . . . 0.0 110.686 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 tt -96.14 107.58 19.92 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.407 -0.808 . . . . 0.0 109.553 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 143.24 -25.16 2.2 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.04 128.23 35.14 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.364 -1.08 . . . . 0.0 110.151 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 25' ' ' TRP . 13.2 pttp -84.62 149.87 25.56 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.552 -0.717 . . . . 0.0 110.55 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.5 p -143.05 139.74 30.66 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.575 -0.703 . . . . 0.0 110.226 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -103.55 -33.58 8.97 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.565 -0.71 . . . . 0.0 110.879 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -154.88 -59.11 0.11 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.242 -0.911 . . . . 0.0 110.265 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -132.5 46.39 2.64 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.558 -0.714 . . . . 0.0 110.308 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -58.18 -49.75 75.94 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.479 -0.763 . . . . 0.0 110.281 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 107.79 80.94 1.31 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 87.8 m -79.91 171.67 14.8 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.403 -1.057 . . . . 0.0 109.55 179.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.0 OUTLIER -67.27 160.1 27.81 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.111 -0.993 . . . . 0.0 110.255 179.777 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 p -59.13 121.07 10.41 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.441 -0.787 . . . . 0.0 110.452 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 103.15 -8.92 53.99 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -103.98 148.34 26.31 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.075 -1.25 . . . . 0.0 110.706 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.7 171.11 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.599 -0.688 . . . . 0.0 110.277 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.3 m -94.43 122.56 37.12 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.257 -0.902 . . . . 0.0 110.487 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.429 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -88.92 165.64 14.47 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.391 -0.818 . . . . 0.0 110.935 179.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -91.31 -30.78 16.38 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.514 -0.741 . . . . 0.0 111.266 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.1 m -55.32 -73.67 0.05 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.476 -0.765 . . . . 0.0 111.142 -178.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.574 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 34.6 m95 -100.2 5.82 44.74 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.145 -0.972 . . . . 0.0 110.95 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 20' ' ' SER . 0.1 OUTLIER 52.6 59.82 4.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.302 -0.873 . . . . 0.0 110.146 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.574 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.1 p90 -141.18 175.21 9.83 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.377 -0.827 . . . . 0.0 110.72 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.1 m -76.07 127.15 32.36 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.544 -0.723 . . . . 0.0 110.583 -179.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.42 HG21 ' CE2' ' A' ' 25' ' ' TRP . 2.3 t -127.96 159.93 38.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.571 -0.706 . . . . 0.0 109.809 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.2 142.44 57.71 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.36 -0.837 . . . . 0.0 110.322 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.92 -27.46 68.87 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.57 -0.706 . . . . 0.0 110.924 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.557 0 N-CA-C 109.927 -1.269 . . . . 0.0 109.927 179.905 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.418 0 N-CA-C 109.958 -1.257 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 84.0 m -103.06 4.7 37.49 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.522 -0.987 . . . . 0.0 110.851 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.04 114.06 6.25 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.963 -1.085 . . . . 0.0 109.621 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 122.64 -18.35 8.15 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.49 116.39 3.07 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.364 -1.08 . . . . 0.0 110.04 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.53 138.7 57.69 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.411 -0.806 . . . . 0.0 110.641 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 p -128.62 116.81 20.18 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.724 -0.61 . . . . 0.0 110.24 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.36 -59.79 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.434 -0.791 . . . . 0.0 110.459 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -79.47 -44.13 21.89 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.427 -0.796 . . . . 0.0 110.182 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -96.09 -35.58 11.3 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.445 -0.784 . . . . 0.0 110.149 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 54.86 68.19 0.9 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.656 -0.653 . . . . 0.0 110.684 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.15 84.8 0.2 Allowed Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.2 m -80.52 169.88 17.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.544 -0.974 . . . . 0.0 110.502 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.5 m -78.45 177.26 8.65 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.403 -0.811 . . . . 0.0 110.099 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 37.8 m -64.34 129.43 39.9 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.325 -0.859 . . . . 0.0 109.957 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.32 17.79 75.46 Favored Glycine 0 N--CA 1.493 2.491 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.4 ' HB3' ' HB3' ' A' ' 26' ' ' CYS . 11.9 m-85 -125.48 132.21 52.7 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.292 -1.122 . . . . 0.0 109.666 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.9 m -117.64 146.85 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.327 -0.858 . . . . 0.0 110.648 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.5 t -67.11 119.13 11.53 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.603 -0.685 . . . . 0.0 110.05 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.55 ' HB2' HG22 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -75.11 132.69 41.41 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.438 -0.788 . . . . 0.0 110.732 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -81.31 -15.07 56.52 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.489 -0.757 . . . . 0.0 109.535 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.4 m -101.32 -44.58 5.6 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.475 -0.766 . . . . 0.0 110.401 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.752 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.4 m95 -91.81 -16.97 26.02 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.448 -0.782 . . . . 0.0 111.218 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.0 12.77 8.94 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.56 -0.713 . . . . 0.0 112.252 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.752 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -124.13 160.16 28.41 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.889 -1.132 . . . . 0.0 109.671 178.743 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.4 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 78.8 m -71.39 109.1 5.17 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.38 -0.825 . . . . 0.0 110.957 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.55 HG22 ' HB2' ' A' ' 20' ' ' SER . 0.8 OUTLIER -106.38 165.33 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.471 -0.768 . . . . 0.0 109.815 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.85 148.07 50.28 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.344 -0.848 . . . . 0.0 110.409 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.71 14.72 8.0 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.432 -0.793 . . . . 0.0 111.168 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 179.61 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.8 p -92.22 4.36 53.41 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.604 -0.939 . . . . 0.0 111.155 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.1 tp -74.72 123.7 25.42 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.097 -1.002 . . . . 0.0 109.942 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 108.56 -14.14 35.61 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.62 139.76 47.58 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.18 -1.188 . . . . 0.0 109.496 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.74 139.88 52.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.507 -0.746 . . . . 0.0 110.7 -179.456 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.5 t -132.1 144.54 50.79 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.526 -0.734 . . . . 0.0 110.369 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -123.28 -66.78 0.99 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.629 -0.669 . . . . 0.0 109.818 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -157.66 -58.93 0.08 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.496 -0.752 . . . . 0.0 110.254 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -105.81 45.53 0.97 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.564 -0.71 . . . . 0.0 110.396 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -76.97 -45.74 26.5 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.35 -0.844 . . . . 0.0 110.281 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.19 74.63 1.28 Allowed Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.9 m -89.57 -168.46 2.16 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.495 -1.003 . . . . 0.0 110.233 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.489 ' HB2' ' CD1' ' A' ' 17' ' ' TYR . 85.8 m -63.94 162.8 13.18 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.309 -0.869 . . . . 0.0 110.336 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.9 m -67.19 115.38 6.8 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.364 -0.835 . . . . 0.0 109.962 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 103.33 14.15 26.73 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.489 ' CD1' ' HB2' ' A' ' 14' ' ' CYS . 3.3 m-85 -106.56 121.41 44.25 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.157 -1.202 . . . . 0.0 109.993 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -91.0 163.55 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.504 -0.748 . . . . 0.0 110.142 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t -95.97 114.31 26.01 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.575 -0.703 . . . . 0.0 109.801 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.524 ' HB2' HG22 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -90.36 111.0 22.06 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.331 -0.855 . . . . 0.0 110.401 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -26.12 53.32 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.404 -0.81 . . . . 0.0 109.646 179.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.0 m -67.46 -44.51 78.44 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.61 -0.681 . . . . 0.0 110.076 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.667 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.5 m95 -98.01 -12.26 22.12 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.443 -0.785 . . . . 0.0 110.665 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.406 ' O ' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 64.95 34.39 9.04 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.576 -0.703 . . . . 0.0 111.547 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.667 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -147.06 154.88 41.71 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.076 -1.015 . . . . 0.0 109.915 178.793 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.31 115.54 15.06 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.362 -0.836 . . . . 0.0 110.886 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.524 HG22 ' HB2' ' A' ' 20' ' ' SER . 1.0 OUTLIER -106.83 170.21 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.719 -0.613 . . . . 0.0 109.99 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.85 148.34 31.39 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.348 -0.845 . . . . 0.0 110.039 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.15 90.71 6.59 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.413 -0.804 . . . . 0.0 110.421 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.526 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 179.865 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.415 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.1 p -101.59 60.98 0.9 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.474 -1.016 . . . . 0.0 110.542 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.9 tt -78.12 107.16 10.5 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.356 -0.84 . . . . 0.0 109.902 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.01 -16.84 3.66 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.7 122.69 17.84 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.246 -1.15 . . . . 0.0 109.996 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.59 142.39 22.89 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.651 -0.656 . . . . 0.0 111.263 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.7 t -137.03 144.01 43.01 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.595 -0.69 . . . . 0.0 110.079 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -125.59 -67.85 0.86 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.451 -0.781 . . . . 0.0 110.461 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -150.68 -58.43 0.17 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.261 -0.9 . . . . 0.0 110.332 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -104.79 42.44 1.21 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.491 -0.756 . . . . 0.0 110.106 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -89.07 -49.78 6.56 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.321 -0.862 . . . . 0.0 110.141 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.01 106.34 0.65 Allowed Glycine 0 N--CA 1.493 2.451 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.434 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 74.9 m -83.32 -168.35 2.06 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.56 -0.965 . . . . 0.0 110.262 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.0 m -80.51 179.67 7.62 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.262 -0.899 . . . . 0.0 110.729 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.0 p -68.49 122.25 18.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.474 -0.766 . . . . 0.0 109.859 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.09 14.38 69.41 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.434 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 5.1 m-85 -113.77 156.29 24.1 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.307 -1.114 . . . . 0.0 110.191 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.418 ' CG2' ' N ' ' A' ' 19' ' ' CYS . 1.5 p -128.6 163.43 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.418 -0.801 . . . . 0.0 110.623 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.418 ' N ' ' CG2' ' A' ' 18' ' ' VAL . 14.9 t -89.74 109.97 20.91 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.881 -0.512 . . . . 0.0 110.139 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.409 ' HB2' HG21 ' A' ' 27' ' ' VAL . 1.1 m -90.42 120.39 31.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.427 -0.796 . . . . 0.0 110.744 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -30.88 56.13 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.581 -0.699 . . . . 0.0 110.195 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.6 m -61.24 -48.19 82.63 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.497 -0.752 . . . . 0.0 110.235 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.671 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.5 m95 -100.37 -2.52 33.23 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.445 -0.784 . . . . 0.0 110.847 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 mtmm 54.87 35.19 23.77 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.406 -0.809 . . . . 0.0 111.981 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.671 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -144.55 157.36 44.26 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.057 -1.027 . . . . 0.0 109.882 178.731 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.418 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 56.8 m -71.89 104.8 3.6 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.337 -0.852 . . . . 0.0 110.888 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.528 HG23 ' CE2' ' A' ' 25' ' ' TRP . 12.2 t -95.13 163.41 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.55 -0.719 . . . . 0.0 109.461 179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.6 tt -78.17 129.96 35.76 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.339 -0.851 . . . . 0.0 110.189 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.92 107.22 10.29 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.596 -0.69 . . . . 0.0 110.125 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.51 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.88 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.367 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 72.2 m -119.98 35.05 4.98 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.506 -0.996 . . . . 0.0 110.58 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 tt -86.51 130.33 34.53 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.21 -0.932 . . . . 0.0 109.969 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.16 -22.34 36.88 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.892 -1.283 . . . . 0.0 109.892 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -64.26 125.28 24.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.333 -1.098 . . . . 0.0 110.184 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -59.13 151.93 21.48 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.631 -0.668 . . . . 0.0 110.667 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.0 m -69.87 145.99 51.6 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.482 -0.761 . . . . 0.0 110.222 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -82.11 -55.03 4.81 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.437 -0.79 . . . . 0.0 109.889 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -162.24 -58.4 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.69 -0.631 . . . . 0.0 109.481 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -97.21 -33.36 11.51 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.667 -0.645 . . . . 0.0 109.523 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.527 ' HA ' ' HB2' ' A' ' 19' ' ' CYS . 0.9 OUTLIER -163.58 -62.13 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.63 -0.669 . . . . 0.0 109.849 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 58.49 40.42 94.38 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 109.954 -1.258 . . . . 0.0 109.954 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.4 m -125.98 156.65 39.49 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.519 -0.989 . . . . 0.0 110.489 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.9 m -83.03 175.9 9.66 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.521 -0.737 . . . . 0.0 110.134 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.6 m -60.36 124.49 20.47 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.429 -0.794 . . . . 0.0 110.172 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.58 15.42 37.51 Favored Glycine 0 N--CA 1.494 2.556 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -132.23 143.07 49.67 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.298 -1.119 . . . . 0.0 110.21 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 19.7 m -120.27 147.44 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.483 -0.76 . . . . 0.0 110.26 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.527 ' HB2' ' HA ' ' A' ' 11' ' ' ASN . 42.5 t -78.98 103.07 8.67 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.468 -0.77 . . . . 0.0 109.987 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.497 ' HB2' HG22 ' A' ' 27' ' ' VAL . 26.1 t -72.11 128.57 36.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.476 -0.765 . . . . 0.0 110.217 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.4 ' HA ' ' HE2' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -80.35 -16.06 55.42 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.419 -0.801 . . . . 0.0 110.132 179.292 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 m -84.67 -46.95 10.97 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.339 -0.85 . . . . 0.0 110.263 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.666 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.9 m95 -99.98 -15.73 18.19 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.384 -0.823 . . . . 0.0 110.926 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 11.5 mmtt 62.92 35.67 13.26 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.72 -0.613 . . . . 0.0 111.844 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.666 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -136.36 158.48 44.32 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.098 -1.001 . . . . 0.0 109.378 178.121 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.4 m -70.56 104.36 2.77 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.334 -0.854 . . . . 0.0 110.744 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.497 HG22 ' HB2' ' A' ' 20' ' ' SER . 2.0 t -99.09 156.55 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 109.567 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -65.74 128.55 36.41 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.465 -0.772 . . . . 0.0 110.197 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.79 101.39 1.33 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.587 -0.696 . . . . 0.0 110.338 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.488 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.944 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.368 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.43 ' HB3' ' HB2' ' A' ' 14' ' ' CYS . 14.1 m -90.48 -9.16 48.4 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.503 -0.998 . . . . 0.0 111.167 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 tp -58.81 120.75 9.57 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.19 -0.944 . . . . 0.0 110.01 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.1 -23.23 6.95 Favored Glycine 0 N--CA 1.493 2.498 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -65.3 156.14 33.0 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.264 -1.139 . . . . 0.0 110.069 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -90.3 147.94 23.19 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.404 -0.81 . . . . 0.0 111.102 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.8 p -140.98 155.2 46.27 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.498 -0.751 . . . . 0.0 109.811 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -122.64 -69.37 0.83 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.336 -0.853 . . . . 0.0 110.443 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -160.62 -55.86 0.05 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.407 -0.808 . . . . 0.0 109.903 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -106.62 15.13 26.13 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.656 -0.653 . . . . 0.0 110.414 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -72.34 -48.87 38.55 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.221 -0.925 . . . . 0.0 109.958 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.43 109.69 2.74 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.8 m -79.79 -166.53 1.02 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.549 -0.971 . . . . 0.0 110.033 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 2' ' ' CYS . 0.5 OUTLIER -71.92 170.81 12.96 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.273 -0.892 . . . . 0.0 110.754 -179.883 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.8 m -66.16 115.3 6.02 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.551 -0.718 . . . . 0.0 109.806 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.36 -17.22 59.4 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.836 -1.306 . . . . 0.0 109.836 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -89.58 140.24 29.74 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.281 -1.129 . . . . 0.0 110.159 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 4.2 t -103.53 160.73 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.524 -0.735 . . . . 0.0 109.741 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.9 t -92.56 115.95 28.56 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.482 -0.761 . . . . 0.0 109.903 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.587 ' HB2' HG22 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -77.29 115.9 17.45 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.525 -0.734 . . . . 0.0 110.118 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -78.29 -13.82 59.69 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.512 -0.742 . . . . 0.0 109.855 179.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 49.8 m -91.09 -44.78 9.07 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.458 -0.776 . . . . 0.0 110.187 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.668 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.2 m95 -96.18 -13.62 23.38 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.411 -0.805 . . . . 0.0 110.897 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 3.2 mmmm 66.03 31.34 9.09 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.62 -0.675 . . . . 0.0 111.905 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.668 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -139.02 156.06 47.5 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.062 -1.024 . . . . 0.0 109.673 178.429 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.4 m -73.16 109.97 7.09 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.183 -0.948 . . . . 0.0 110.869 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.587 HG22 ' HB2' ' A' ' 20' ' ' SER . 1.6 t -104.6 156.38 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.513 -0.742 . . . . 0.0 109.808 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.8 tp -79.09 147.13 32.88 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.407 -0.808 . . . . 0.0 109.949 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.34 88.55 2.58 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.465 -0.772 . . . . 0.0 110.191 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.627 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.856 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.443 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.5 p -109.73 58.52 0.61 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.489 -1.006 . . . . 0.0 110.557 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.4 tt -81.79 132.3 35.28 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.316 -0.865 . . . . 0.0 109.988 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.26 -30.19 6.63 Favored Glycine 0 N--CA 1.496 2.679 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.67 140.55 57.43 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.369 -1.077 . . . . 0.0 110.144 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -82.08 136.84 35.14 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.337 -0.852 . . . . 0.0 110.519 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.7 p -115.45 106.84 14.43 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.61 -0.681 . . . . 0.0 110.13 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -149.55 -48.84 0.14 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.672 -0.643 . . . . 0.0 110.514 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -70.06 -50.11 44.41 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.489 -0.757 . . . . 0.0 109.978 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -101.7 -30.33 11.39 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.599 -0.688 . . . . 0.0 110.605 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 t30 54.76 50.66 15.28 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.574 -0.704 . . . . 0.0 110.282 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -152.4 90.43 0.13 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.114 -1.594 . . . . 0.0 109.114 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 63.3 m -79.86 -160.6 0.28 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.669 -0.9 . . . . 0.0 110.448 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.6 m -75.74 173.41 11.15 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.429 -0.794 . . . . 0.0 110.358 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 p -64.02 123.94 20.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.36 -0.838 . . . . 0.0 109.918 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.61 -21.86 43.85 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -92.89 120.24 33.02 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.199 -1.177 . . . . 0.0 110.138 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 29' ' ' ALA . 12.0 t -100.59 163.77 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.61 -0.681 . . . . 0.0 109.872 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t -91.21 108.76 20.09 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.551 -0.718 . . . . 0.0 110.144 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.441 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -66.32 146.2 54.86 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.52 -0.738 . . . . 0.0 110.174 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.44 -29.54 17.91 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.481 -0.762 . . . . 0.0 110.918 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.3 m -78.15 -49.43 13.87 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.287 -0.883 . . . . 0.0 110.927 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CB ' ' CE3' ' A' ' 25' ' ' TRP . 6.9 m95 -96.08 -18.1 20.42 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.337 -0.852 . . . . 0.0 110.83 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 15.0 mttt 63.76 31.36 14.27 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.645 -0.66 . . . . 0.0 111.837 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.602 ' CE3' ' CB ' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -121.65 162.13 21.25 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 120.987 -1.071 . . . . 0.0 109.666 178.339 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.421 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 84.7 m -71.62 104.74 3.42 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.364 -0.835 . . . . 0.0 110.892 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.535 HG21 ' CD1' ' A' ' 25' ' ' TRP . 0.9 OUTLIER -106.53 161.08 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.541 -0.724 . . . . 0.0 109.69 179.808 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.33 149.05 50.96 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.367 -0.833 . . . . 0.0 110.285 179.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.445 ' HB2' HG22 ' A' ' 18' ' ' VAL . . . -84.58 66.72 9.67 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.442 -0.786 . . . . 0.0 110.539 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.482 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 179.676 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.404 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.7 p -101.26 57.1 0.85 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.387 -1.066 . . . . 0.0 110.369 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.59 113.64 10.94 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.406 -0.809 . . . . 0.0 110.297 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.51 -21.64 4.25 Favored Glycine 0 N--CA 1.495 2.621 0 N-CA-C 110.319 -1.113 . . . . 0.0 110.319 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.82 123.75 17.51 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.277 -1.131 . . . . 0.0 110.277 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -69.27 135.07 49.95 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.479 -0.763 . . . . 0.0 110.794 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -121.13 146.06 47.16 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.645 -0.659 . . . . 0.0 109.826 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -133.86 -45.57 0.8 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.446 -0.784 . . . . 0.0 110.847 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -169.91 -55.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.327 -0.858 . . . . 0.0 109.826 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -104.63 22.11 15.62 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.675 -0.641 . . . . 0.0 110.584 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.0 t30 -74.49 -59.71 2.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.189 -0.944 . . . . 0.0 110.045 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.25 105.98 0.67 Allowed Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 69.1 m -81.05 179.02 8.05 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.525 -0.985 . . . . 0.0 110.324 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 76.7 m -75.0 174.07 9.84 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.434 -0.791 . . . . 0.0 110.409 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.7 m -66.34 119.32 11.37 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.443 -0.786 . . . . 0.0 109.831 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.97 -22.67 39.19 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -89.59 147.98 23.62 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.284 -1.127 . . . . 0.0 109.942 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.6 m -130.15 151.46 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.607 -0.683 . . . . 0.0 110.425 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 13' ' ' CYS . 73.8 m -73.45 103.28 4.04 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.464 -0.772 . . . . 0.0 109.985 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.519 ' HB2' HG22 ' A' ' 27' ' ' VAL . 30.2 t -73.86 137.63 43.88 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.412 -0.805 . . . . 0.0 110.24 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.67 -26.68 27.61 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.52 -0.738 . . . . 0.0 110.341 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.9 m -73.39 -45.61 53.75 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.416 -0.802 . . . . 0.0 110.28 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.76 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 5.8 m95 -100.12 -13.43 18.98 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.385 -0.822 . . . . 0.0 111.222 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.6 OUTLIER 62.76 31.66 16.43 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.529 -0.732 . . . . 0.0 111.938 179.78 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.76 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -141.97 160.82 39.44 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.022 -1.049 . . . . 0.0 109.853 178.344 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.41 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 71.0 m -66.49 107.39 2.05 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.349 -0.844 . . . . 0.0 111.473 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.585 HG21 ' CD1' ' A' ' 25' ' ' TRP . 0.9 OUTLIER -117.38 172.5 5.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.51 -0.744 . . . . 0.0 109.467 179.268 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.1 131.27 41.87 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.165 -0.959 . . . . 0.0 110.154 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.91 124.4 22.88 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.48 -0.762 . . . . 0.0 110.49 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.521 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.891 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.409 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 89.7 m -103.58 9.66 37.33 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.473 -1.016 . . . . 0.0 111.077 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.8 97.73 0.85 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.093 -1.004 . . . . 0.0 109.918 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.22 -22.47 3.57 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.56 128.18 34.79 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.256 -1.144 . . . . 0.0 110.084 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.81 159.27 32.16 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.479 -0.763 . . . . 0.0 110.238 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.43 156.05 38.68 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.538 -0.726 . . . . 0.0 110.101 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -130.98 -65.91 0.77 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.475 -0.766 . . . . 0.0 110.393 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -164.46 -51.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.401 -0.812 . . . . 0.0 110.767 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -94.3 9.84 36.53 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.402 -0.812 . . . . 0.0 111.19 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 58.09 70.32 0.66 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.359 -0.838 . . . . 0.0 110.29 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -87.93 59.36 4.25 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.447 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 87.2 m -89.61 178.6 6.24 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.496 -1.003 . . . . 0.0 109.897 179.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.1 m -75.52 179.81 5.07 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.177 -0.952 . . . . 0.0 110.62 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.5 m -68.56 112.58 5.44 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.549 -0.72 . . . . 0.0 109.996 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.77 -7.07 67.71 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.106 -1.197 . . . . 0.0 110.106 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.447 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 3.6 m-85 -91.21 137.49 32.32 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.192 -1.181 . . . . 0.0 110.1 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.2 t -123.82 164.04 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.43 -0.794 . . . . 0.0 110.412 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 11.7 t -85.23 119.45 25.62 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.454 -0.779 . . . . 0.0 110.299 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.47 ' CB ' ' CZ3' ' A' ' 25' ' ' TRP . 0.6 OUTLIER -83.39 166.81 18.1 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.493 -0.754 . . . . 0.0 110.599 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.64 -24.4 20.51 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.533 -0.73 . . . . 0.0 111.194 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.5 m -62.48 -81.6 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.274 -0.891 . . . . 0.0 110.851 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.591 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 37.9 m95 -89.52 4.08 50.39 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.201 -0.937 . . . . 0.0 110.738 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 20' ' ' SER . 18.0 mtpt 52.53 62.69 2.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.333 -0.855 . . . . 0.0 110.114 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.591 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.4 p90 -144.32 175.4 10.12 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.466 -0.771 . . . . 0.0 110.66 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.8 m -81.53 122.51 27.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.465 -0.772 . . . . 0.0 110.281 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.443 ' CG2' ' N ' ' A' ' 28' ' ' LEU . 2.0 p -134.39 166.83 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.573 -0.704 . . . . 0.0 110.079 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.443 ' N ' ' CG2' ' A' ' 27' ' ' VAL . 0.4 OUTLIER -73.24 139.02 45.91 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.883 -0.511 . . . . 0.0 110.51 -179.853 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.36 166.98 19.97 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.482 -0.761 . . . . 0.0 110.499 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.614 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 -179.945 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.593 0 N-CA-C 110.036 -1.225 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 65.2 m -124.83 51.23 1.66 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.399 -1.059 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.64 103.96 16.41 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.272 -0.892 . . . . 0.0 109.829 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.41 -18.33 3.93 Favored Glycine 0 N--CA 1.495 2.584 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.28 121.57 8.52 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.475 -1.014 . . . . 0.0 110.274 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.86 141.54 47.95 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.312 -0.867 . . . . 0.0 110.715 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.62 141.75 58.35 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.608 -0.682 . . . . 0.0 110.129 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -106.84 -66.47 1.01 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.373 -0.829 . . . . 0.0 110.694 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -141.1 -60.45 0.49 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.231 -0.918 . . . . 0.0 110.309 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -98.01 -35.13 10.54 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.523 -0.736 . . . . 0.0 109.947 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -167.35 -65.16 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.644 -0.66 . . . . 0.0 109.916 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 67.88 36.02 85.88 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 109.852 -1.299 . . . . 0.0 109.852 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 48.4 m -120.55 -179.56 4.02 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.527 -0.984 . . . . 0.0 110.162 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 62.1 m -99.5 177.21 5.24 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.427 -0.796 . . . . 0.0 110.047 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.3 m -62.79 124.62 21.5 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.393 -0.817 . . . . 0.0 110.288 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.07 14.32 60.79 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -128.17 125.15 38.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.138 -1.213 . . . . 0.0 110.409 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.1 t -103.04 159.68 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.521 -0.737 . . . . 0.0 109.549 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.69 116.51 24.01 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.371 -0.83 . . . . 0.0 109.969 179.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.509 ' HB2' HG22 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -75.51 127.46 33.14 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.55 -0.719 . . . . 0.0 110.475 -179.804 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -80.94 -12.7 59.35 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.476 -0.765 . . . . 0.0 110.192 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.8 m -89.99 -45.98 8.82 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.377 -0.827 . . . . 0.0 109.988 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.687 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.2 m95 -97.58 -11.53 23.55 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.528 -0.732 . . . . 0.0 110.926 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.88 22.86 11.37 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.446 -0.784 . . . . 0.0 112.032 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.687 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -131.97 155.13 48.51 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.866 -1.146 . . . . 0.0 109.912 178.6 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 68.4 m -72.81 109.36 6.35 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.468 -0.77 . . . . 0.0 110.841 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.509 HG22 ' HB2' ' A' ' 20' ' ' SER . 2.8 t -99.23 167.58 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.523 -0.736 . . . . 0.0 109.692 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.97 132.44 47.3 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.286 -0.884 . . . . 0.0 110.622 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.57 170.43 10.86 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.655 -0.653 . . . . 0.0 110.717 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.663 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.729 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.472 0 N-CA-C 109.731 -1.347 . . . . 0.0 109.731 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.7 m -107.76 38.16 2.24 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.481 -1.011 . . . . 0.0 110.379 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.508 HD11 ' HA ' ' A' ' 27' ' ' VAL . 11.3 tp -72.5 109.43 6.17 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.306 -0.871 . . . . 0.0 110.193 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.87 -22.48 6.82 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 110.108 -1.197 . . . . 0.0 110.108 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.8 118.33 7.57 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.284 -1.127 . . . . 0.0 109.963 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -64.58 146.6 54.39 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.223 -0.923 . . . . 0.0 109.849 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 98.0 m -63.89 161.93 14.67 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.383 -0.823 . . . . 0.0 110.032 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.5 -82.64 0.39 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.207 -0.933 . . . . 0.0 109.941 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -115.74 -55.54 2.42 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.454 -0.779 . . . . 0.0 109.502 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -121.38 -27.21 4.87 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.636 -0.665 . . . . 0.0 110.485 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -176.82 84.19 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.36 -0.837 . . . . 0.0 109.82 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -97.58 64.08 0.92 Allowed Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 67.0 m -126.15 144.84 50.6 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.633 -0.922 . . . . 0.0 110.294 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 28.6 p -69.61 166.17 19.6 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.489 -0.757 . . . . 0.0 110.336 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.87 129.15 38.4 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.466 -0.771 . . . . 0.0 110.524 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.5 -27.65 17.29 Favored Glycine 0 N--CA 1.494 2.538 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -108.28 134.67 50.78 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.275 -1.132 . . . . 0.0 110.361 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.3 m -103.98 149.36 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.487 -0.758 . . . . 0.0 110.701 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.3 t -75.37 113.83 13.2 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.524 -0.735 . . . . 0.0 110.329 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.584 ' HB2' HG22 ' A' ' 27' ' ' VAL . 0.3 OUTLIER -82.4 126.12 31.82 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.416 -0.802 . . . . 0.0 110.044 179.634 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.7 mtt-85 -80.86 -23.4 39.09 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.343 -0.848 . . . . 0.0 110.411 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.436 HG21 ' CZ3' ' A' ' 23' ' ' TRP . 25.4 m -77.02 -46.84 22.41 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.441 -0.787 . . . . 0.0 110.165 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.713 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.7 m95 -97.26 -6.18 35.09 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.487 -0.758 . . . . 0.0 110.741 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 4.1 mmmm 58.37 26.06 13.6 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.583 -0.698 . . . . 0.0 111.582 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.713 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -134.12 152.96 52.08 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.1 -1.0 . . . . 0.0 109.855 178.841 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.7 m -71.15 109.62 5.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.366 -0.834 . . . . 0.0 110.729 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.584 HG22 ' HB2' ' A' ' 20' ' ' SER . 2.1 t -99.97 159.45 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 121.469 -0.77 . . . . 0.0 109.939 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 pp -74.11 146.82 43.26 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.382 -0.824 . . . . 0.0 110.563 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -105.87 120.55 42.03 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.594 -0.691 . . . . 0.0 109.852 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.552 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.732 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.462 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 86.4 m -103.18 20.67 17.25 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.44 -1.036 . . . . 0.0 110.915 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.97 111.02 12.07 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.031 -1.043 . . . . 0.0 109.892 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.16 -25.78 3.3 Favored Glycine 0 N--CA 1.494 2.567 0 N-CA-C 109.826 -1.31 . . . . 0.0 109.826 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -66.99 118.2 10.12 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.411 -1.052 . . . . 0.0 110.287 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 25' ' ' TRP . 8.7 mptt -70.27 150.3 46.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.448 -0.783 . . . . 0.0 110.584 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.0 m -75.72 179.3 5.5 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.533 -0.729 . . . . 0.0 110.208 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -137.62 -58.32 0.68 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.381 -0.824 . . . . 0.0 110.675 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -154.74 -53.21 0.09 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.402 -0.811 . . . . 0.0 110.731 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -94.29 10.05 35.66 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.445 -0.784 . . . . 0.0 111.417 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 52.46 67.17 1.02 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.344 -0.847 . . . . 0.0 109.938 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -93.5 62.15 2.04 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 16.7 m -79.42 163.62 24.65 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.502 -0.999 . . . . 0.0 109.681 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 40.0 m -61.9 166.59 4.4 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.309 -0.869 . . . . 0.0 110.783 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.8 p -64.71 128.23 34.91 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.359 -0.838 . . . . 0.0 109.98 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.5 6.82 62.31 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -120.42 153.73 36.15 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.196 -1.179 . . . . 0.0 110.01 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.22 147.02 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.39 -0.819 . . . . 0.0 110.328 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.8 t -81.13 119.43 23.56 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.445 -0.784 . . . . 0.0 110.154 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.463 ' HB3' ' CZ3' ' A' ' 25' ' ' TRP . 0.4 OUTLIER -89.42 154.44 20.05 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.487 -0.758 . . . . 0.0 110.333 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -11.7 39.25 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.428 -0.795 . . . . 0.0 111.199 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.2 m -69.29 -65.17 0.74 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.259 -0.901 . . . . 0.0 110.267 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.584 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 9.0 m95 -106.93 5.33 28.17 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.414 -0.804 . . . . 0.0 110.423 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.2 mttm 54.37 62.83 2.39 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.436 -0.79 . . . . 0.0 110.801 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.584 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -148.83 171.31 16.49 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.331 -0.856 . . . . 0.0 110.579 179.664 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.9 m -77.51 129.98 36.38 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.51 -0.744 . . . . 0.0 110.716 -179.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.468 HG21 ' CE2' ' A' ' 25' ' ' TRP . 1.8 t -126.44 167.93 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.557 -0.714 . . . . 0.0 109.829 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -66.85 141.95 57.5 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.301 -0.874 . . . . 0.0 110.102 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.79 97.86 6.81 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.508 -0.745 . . . . 0.0 110.254 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.939 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.354 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 56.4 m -92.82 -17.35 24.23 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.398 -1.06 . . . . 0.0 110.896 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.496 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 0.5 OUTLIER -61.79 112.56 2.33 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.17 -0.956 . . . . 0.0 110.119 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.14 -27.43 4.81 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.15 113.08 3.31 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.446 -1.032 . . . . 0.0 110.105 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -66.39 130.73 44.2 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.514 -0.741 . . . . 0.0 110.598 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 t -110.47 140.47 44.7 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.529 -0.732 . . . . 0.0 109.988 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -151.04 -58.76 0.17 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.553 -0.717 . . . . 0.0 110.979 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -104.99 -75.05 0.63 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.359 -0.838 . . . . 0.0 110.685 -179.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -137.38 56.65 1.77 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.279 -0.888 . . . . 0.0 110.247 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.44 -51.62 49.32 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.447 -0.783 . . . . 0.0 110.196 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 74.78 92.47 0.16 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 179.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.7 m -83.63 164.43 19.71 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.515 -0.991 . . . . 0.0 109.941 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 26.3 p -77.3 177.02 8.25 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.371 -0.831 . . . . 0.0 110.701 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 73.3 p -58.38 140.3 53.87 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.378 -0.826 . . . . 0.0 110.697 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.3 1.98 89.29 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 -179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -133.09 137.75 46.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.162 -1.199 . . . . 0.0 110.23 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 30.2 m -139.78 160.08 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.475 -0.765 . . . . 0.0 110.544 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -72.26 112.17 8.1 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.46 -0.775 . . . . 0.0 109.924 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.558 ' HB2' HG22 ' A' ' 27' ' ' VAL . 8.7 t -89.56 158.1 17.79 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.347 -0.846 . . . . 0.0 110.819 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -88.73 -47.84 7.95 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.54 -0.725 . . . . 0.0 109.686 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 50.9 m -65.72 -38.68 89.84 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.642 -0.661 . . . . 0.0 110.005 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.552 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 6.8 m95 -90.47 -32.03 16.54 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.614 -0.679 . . . . 0.0 110.593 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 66.44 27.87 9.74 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.525 -0.734 . . . . 0.0 111.384 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.61 ' CD1' HG21 ' A' ' 27' ' ' VAL . 1.2 p90 -150.5 175.21 12.1 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.188 -0.945 . . . . 0.0 109.738 178.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 3' ' ' LEU . 77.8 m -71.63 100.32 2.27 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.094 -1.004 . . . . 0.0 109.525 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.61 HG21 ' CD1' ' A' ' 25' ' ' TRP . 0.6 OUTLIER -106.53 157.04 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.479 -0.763 . . . . 0.0 110.186 -179.287 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.27 135.94 57.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.658 -0.651 . . . . 0.0 110.166 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -93.63 59.59 2.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.458 -0.776 . . . . 0.0 110.411 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.53 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.945 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.361 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 59.2 m -105.44 29.11 6.76 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.471 -1.017 . . . . 0.0 110.606 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.76 109.64 18.21 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.345 -0.847 . . . . 0.0 109.77 179.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 136.09 -21.43 3.51 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.871 -1.292 . . . . 0.0 109.871 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -66.66 110.68 3.31 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.236 -1.155 . . . . 0.0 109.753 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -65.35 149.36 50.11 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.439 -0.788 . . . . 0.0 110.642 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.49 ' HB2' ' HB3' ' A' ' 11' ' ' ASN . 29.7 p -149.06 157.62 43.55 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.537 -0.727 . . . . 0.0 110.325 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -118.55 -60.06 1.81 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.424 -0.797 . . . . 0.0 110.638 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -146.5 -57.51 0.28 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.33 -0.856 . . . . 0.0 110.687 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -106.33 38.78 1.96 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.42 -0.8 . . . . 0.0 110.592 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.49 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 28.4 t-20 -73.26 -57.7 3.83 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.232 -0.918 . . . . 0.0 109.965 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 92.66 95.77 1.42 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 71.4 m -90.9 -176.99 4.83 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.494 -1.004 . . . . 0.0 110.262 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.0 m -73.58 158.21 35.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.387 -0.821 . . . . 0.0 109.765 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 71.1 p -56.65 121.98 11.0 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.388 -0.82 . . . . 0.0 110.166 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.62 -23.19 30.45 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -93.63 143.7 26.06 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.271 -1.135 . . . . 0.0 110.358 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 32.8 m -130.89 160.3 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.452 -0.78 . . . . 0.0 110.304 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -77.48 119.19 20.73 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.391 -0.818 . . . . 0.0 110.226 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.58 ' HB3' ' HB2' ' A' ' 23' ' ' TRP . 28.7 t -90.79 153.43 20.25 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.529 -0.732 . . . . 0.0 110.404 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.79 -49.66 9.49 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.348 -0.845 . . . . 0.0 109.57 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.2 m -66.61 -44.46 82.06 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.505 -0.747 . . . . 0.0 109.912 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.615 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 5.8 m95 -81.7 -31.02 32.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.67 -0.644 . . . . 0.0 110.73 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.3 OUTLIER 62.06 25.21 15.09 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.344 -0.847 . . . . 0.0 111.226 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.636 ' CD1' HG21 ' A' ' 27' ' ' VAL . 1.3 p90 -144.45 176.65 9.22 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.105 -0.997 . . . . 0.0 109.913 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.2 m -70.84 101.0 2.03 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.246 -0.909 . . . . 0.0 110.338 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.636 HG21 ' CD1' ' A' ' 25' ' ' TRP . 0.8 OUTLIER -113.11 158.28 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.621 -0.674 . . . . 0.0 109.517 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.2 128.01 34.79 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.07 139.96 57.6 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.462 -0.774 . . . . 0.0 110.429 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.608 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 -179.996 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.57 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 95.5 m -99.62 0.53 42.29 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.275 -1.132 . . . . 0.0 110.966 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 tt -72.98 101.17 3.15 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.138 -0.976 . . . . 0.0 110.043 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 134.13 -16.75 4.39 Favored Glycine 0 N--CA 1.494 2.505 0 N-CA-C 110.021 -1.231 . . . . 0.0 110.021 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -61.51 123.66 18.47 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.367 -1.078 . . . . 0.0 110.441 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -66.97 149.22 50.93 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.54 -0.725 . . . . 0.0 111.097 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.53 154.92 31.0 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.541 -0.724 . . . . 0.0 110.137 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.3 -65.27 1.19 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.441 -0.787 . . . . 0.0 110.257 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -129.7 -67.76 0.74 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.506 -0.746 . . . . 0.0 109.821 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -118.76 -17.16 9.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.548 -0.72 . . . . 0.0 110.644 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -149.45 -66.58 0.22 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.157 -0.964 . . . . 0.0 110.173 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 55.58 37.68 68.49 Favored Glycine 0 N--CA 1.495 2.585 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 95.5 m -128.48 170.58 12.99 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.475 -1.015 . . . . 0.0 110.669 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 86.4 m -87.06 176.02 7.82 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.532 -0.73 . . . . 0.0 109.862 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.05 116.29 6.31 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.329 -0.857 . . . . 0.0 109.917 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 102.51 7.52 45.37 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -125.08 137.84 54.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.228 -1.16 . . . . 0.0 110.096 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.4 t -118.27 162.64 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.364 -0.835 . . . . 0.0 110.22 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 11.2 t -77.11 117.31 18.54 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.452 -0.78 . . . . 0.0 109.967 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.554 ' HB2' HG23 ' A' ' 27' ' ' VAL . 1.5 t -71.6 133.57 45.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.605 -0.685 . . . . 0.0 110.453 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -15.06 53.63 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.367 -0.833 . . . . 0.0 110.178 179.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.1 m -94.81 -46.02 7.07 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.402 -0.811 . . . . 0.0 110.491 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CB ' ' CE3' ' A' ' 25' ' ' TRP . 6.8 m95 -101.03 -13.11 18.37 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.411 -0.806 . . . . 0.0 111.093 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt 66.5 15.48 10.12 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.582 -0.698 . . . . 0.0 111.916 -179.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.615 ' CE3' ' CB ' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -117.54 157.66 25.95 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.893 -1.13 . . . . 0.0 109.633 178.773 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.5 m -62.59 101.41 0.25 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.467 -0.771 . . . . 0.0 111.076 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.554 HG23 ' HB2' ' A' ' 20' ' ' SER . 11.4 m -102.53 153.85 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.581 -0.699 . . . . 0.0 109.829 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 tp -68.0 138.87 56.22 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.519 -0.738 . . . . 0.0 110.582 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.21 121.87 13.64 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.64 -0.662 . . . . 0.0 110.519 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.736 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 179.844 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.484 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.457 ' HB2' ' CG ' ' A' ' 17' ' ' TYR . 61.5 m -109.21 8.04 25.65 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.557 -0.967 . . . . 0.0 110.986 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.532 HD13 ' HA ' ' A' ' 27' ' ' VAL . 0.9 OUTLIER -69.36 131.74 45.29 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.037 -1.04 . . . . 0.0 110.116 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 112.24 -24.58 13.92 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -61.49 118.82 7.49 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.404 -1.056 . . . . 0.0 110.158 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -70.58 139.48 51.46 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.433 -0.792 . . . . 0.0 110.754 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.451 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 69.8 m -121.06 177.32 5.17 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.628 -0.67 . . . . 0.0 110.226 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -131.18 -57.81 1.01 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.466 -0.771 . . . . 0.0 110.172 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -148.64 -60.66 0.24 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.533 -0.73 . . . . 0.0 109.976 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -129.93 38.15 3.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 0.0 110.098 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -54.18 -51.27 64.9 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.554 -0.716 . . . . 0.0 110.107 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.45 94.74 0.54 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.53 -175.2 5.07 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.447 -1.031 . . . . 0.0 109.884 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.0 p -60.72 157.41 14.8 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.262 -0.899 . . . . 0.0 110.297 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 m -55.77 125.34 20.84 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.486 -0.759 . . . . 0.0 110.301 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 113.33 -20.52 18.66 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.457 ' CG ' ' HB2' ' A' ' 2' ' ' CYS . 6.6 m-85 -113.37 152.72 29.62 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.286 -1.126 . . . . 0.0 110.58 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.15 138.59 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.606 -0.684 . . . . 0.0 110.405 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.1 m -74.92 119.6 19.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.446 -0.784 . . . . 0.0 109.889 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.549 ' HB3' HG22 ' A' ' 27' ' ' VAL . 89.9 p -81.36 132.59 35.34 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.461 -0.775 . . . . 0.0 110.772 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -80.32 -13.66 59.0 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.507 -0.746 . . . . 0.0 110.304 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.1 m -90.82 -49.21 6.57 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.338 -0.851 . . . . 0.0 110.181 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.715 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 6.7 m95 -92.27 -15.99 26.71 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.408 -0.808 . . . . 0.0 110.81 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 6.3 mtmm 65.6 31.16 10.13 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.695 -0.628 . . . . 0.0 111.681 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.715 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -139.05 155.12 48.18 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.13 -0.981 . . . . 0.0 109.348 178.164 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.51 ' O ' ' HA ' ' A' ' 3' ' ' LEU . 58.5 m -70.12 112.38 6.44 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.34 -0.85 . . . . 0.0 110.933 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.549 HG22 ' HB3' ' A' ' 20' ' ' SER . 1.3 t -108.94 167.48 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.37 -0.831 . . . . 0.0 109.764 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 tp -70.62 141.38 51.73 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.39 -0.818 . . . . 0.0 110.176 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.97 130.94 44.99 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.506 -0.746 . . . . 0.0 110.358 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.537 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.881 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 87.3 m -100.65 28.77 4.88 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.341 -1.093 . . . . 0.0 110.632 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.7 tt -80.42 113.86 18.91 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.186 -0.946 . . . . 0.0 109.928 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.66 -31.33 2.67 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -56.47 124.69 19.04 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.514 -0.992 . . . . 0.0 110.253 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.61 149.51 49.99 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.342 -0.849 . . . . 0.0 110.702 -179.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.9 m -67.71 157.38 34.76 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.579 -0.701 . . . . 0.0 109.713 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -114.83 -75.42 0.59 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.373 -0.83 . . . . 0.0 110.331 -179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -140.3 -59.48 0.53 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.261 -0.899 . . . . 0.0 110.053 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.91 -33.22 12.27 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.511 -0.743 . . . . 0.0 109.983 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -165.14 -67.26 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.605 -0.685 . . . . 0.0 109.914 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 65.98 35.9 91.31 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.2 m -131.78 172.37 12.37 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.523 -0.986 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.2 m -79.41 176.59 9.55 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.467 -0.77 . . . . 0.0 110.24 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.0 m -67.23 117.13 8.82 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.415 -0.803 . . . . 0.0 110.217 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 102.42 -14.63 56.61 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.279 -1.129 . . . . 0.0 110.279 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -91.6 129.8 37.51 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.078 -1.248 . . . . 0.0 110.484 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.4 t -97.37 168.47 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.609 -0.682 . . . . 0.0 110.178 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.25 118.54 37.04 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.254 -0.904 . . . . 0.0 110.46 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.508 ' HB2' ' CZ3' ' A' ' 25' ' ' TRP . 4.4 m -91.05 151.39 21.05 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.551 -0.718 . . . . 0.0 110.343 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.28 -19.19 24.38 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.313 -0.867 . . . . 0.0 111.527 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 66.4 m -57.11 -73.16 0.07 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.163 -0.96 . . . . 0.0 110.209 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.553 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 40.4 m95 -96.44 0.21 50.09 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 179.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.82 68.77 0.79 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.383 -0.823 . . . . 0.0 110.569 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.553 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -155.25 178.23 10.45 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.296 -0.878 . . . . 0.0 110.786 179.666 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.9 m -85.39 138.07 32.51 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.438 -0.789 . . . . 0.0 111.392 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.467 ' CG1' ' CZ2' ' A' ' 25' ' ' TRP . 2.7 m -127.02 140.3 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.74 -0.6 . . . . 0.0 110.015 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.2 tp -67.67 124.59 23.7 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.314 -0.866 . . . . 0.0 109.856 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.87 101.85 0.13 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.637 -0.665 . . . . 0.0 110.3 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.394 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.852 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.46 ' HB2' ' CG ' ' A' ' 17' ' ' TYR . 85.7 m -95.09 3.71 54.49 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.516 -0.991 . . . . 0.0 110.933 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.6 tp -64.57 114.02 4.1 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.133 -0.979 . . . . 0.0 109.97 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.95 -28.62 5.35 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -57.81 140.73 51.04 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.387 -1.067 . . . . 0.0 109.968 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.9 mmmt -85.75 141.05 29.98 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.432 -0.793 . . . . 0.0 110.838 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.2 t -133.96 142.96 47.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.733 -0.605 . . . . 0.0 109.467 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.65 -51.8 9.35 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.424 -0.798 . . . . 0.0 110.341 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -157.27 -57.05 0.08 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.502 -0.749 . . . . 0.0 110.229 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -146.81 43.35 1.16 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.448 -0.783 . . . . 0.0 110.074 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -54.51 -53.54 52.95 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.467 -0.771 . . . . 0.0 110.272 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.66 84.11 0.54 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.4 t -79.6 173.38 12.64 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.513 -0.992 . . . . 0.0 109.682 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.7 p -59.24 162.15 4.81 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.276 -0.89 . . . . 0.0 110.634 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -55.12 129.87 39.78 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.56 -0.712 . . . . 0.0 110.774 -179.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.98 7.17 56.61 Favored Glycine 0 N--CA 1.494 2.564 0 N-CA-C 110.699 -0.96 . . . . 0.0 110.699 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.46 ' CG ' ' HB2' ' A' ' 2' ' ' CYS . 26.9 m-85 -136.31 138.16 41.41 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.05 -1.265 . . . . 0.0 110.808 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.5 t -125.18 166.77 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.641 -0.662 . . . . 0.0 109.913 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 72.7 m -90.44 114.42 26.57 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.306 -0.871 . . . . 0.0 110.126 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.474 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 10.8 t -75.17 159.12 31.98 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.452 -0.78 . . . . 0.0 110.616 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.1 ttp85 -90.89 -22.71 20.78 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.471 -0.768 . . . . 0.0 110.954 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.7 m -69.48 -82.65 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.201 -0.937 . . . . 0.0 110.928 -179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.679 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 14.3 m95 -85.08 -0.13 53.49 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.07 -1.019 . . . . 0.0 110.812 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER 56.67 63.95 1.81 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.323 -0.86 . . . . 0.0 110.811 179.772 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.679 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.5 p90 -145.95 176.88 9.36 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.273 -0.892 . . . . 0.0 110.395 179.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.7 m -78.59 122.79 26.36 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.261 -0.899 . . . . 0.0 111.117 -178.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.558 HG11 ' CZ2' ' A' ' 25' ' ' TRP . 24.2 m -115.13 151.34 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.686 -0.634 . . . . 0.0 110.06 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.7 mt -68.11 118.47 11.31 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.336 -0.852 . . . . 0.0 110.04 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.32 132.27 47.38 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.498 -0.751 . . . . 0.0 110.375 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.498 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.961 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 109.454 -1.459 . . . . 0.0 109.454 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 67.1 m -98.73 -5.86 30.6 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.501 -0.999 . . . . 0.0 110.878 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.42 119.09 10.38 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.106 -0.997 . . . . 0.0 109.846 179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.39 -23.11 4.9 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.77 132.37 50.72 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.309 -1.112 . . . . 0.0 109.879 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -81.01 149.72 29.18 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.42 -0.8 . . . . 0.0 110.3 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.0 p -149.94 165.19 33.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.476 -0.765 . . . . 0.0 110.601 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -135.45 -57.85 0.79 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.584 -0.698 . . . . 0.0 110.34 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -139.27 -59.21 0.58 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.35 -0.844 . . . . 0.0 110.336 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -120.87 41.63 3.24 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.474 -0.766 . . . . 0.0 110.233 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -62.8 -53.85 47.92 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.355 -0.841 . . . . 0.0 110.008 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 107.9 75.85 0.93 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 98.8 m -79.25 169.93 17.38 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.439 -1.036 . . . . 0.0 109.389 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.0 m -67.68 161.95 24.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.251 -0.906 . . . . 0.0 110.017 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.5 p -58.8 120.41 8.93 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.404 -0.81 . . . . 0.0 109.907 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.99 -17.53 44.68 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.416 ' HB3' ' HB3' ' A' ' 26' ' ' CYS . 27.8 m-85 -95.05 147.41 23.44 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.24 -1.153 . . . . 0.0 110.283 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 t -128.59 162.44 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.507 -0.746 . . . . 0.0 110.081 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -88.63 110.7 21.15 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.353 -0.842 . . . . 0.0 110.217 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.417 ' CB ' ' CZ3' ' A' ' 25' ' ' TRP . 0.5 OUTLIER -84.08 153.13 23.95 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.494 -0.754 . . . . 0.0 110.396 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -90.57 -4.05 57.14 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.417 -0.802 . . . . 0.0 111.164 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.5 m -77.77 -66.74 0.8 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.97 -1.081 . . . . 0.0 110.224 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.594 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 11.8 m95 -104.36 6.8 35.43 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.467 -0.77 . . . . 0.0 110.152 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.2 mttt 52.32 65.22 1.57 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.482 -0.761 . . . . 0.0 110.725 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.594 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -151.35 172.03 16.56 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.319 -0.863 . . . . 0.0 110.842 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.416 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 72.5 m -79.67 118.61 21.65 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.496 -0.753 . . . . 0.0 109.863 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.558 ' HB ' ' CZ2' ' A' ' 25' ' ' TRP . 1.6 p -121.69 160.72 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.497 -0.752 . . . . 0.0 110.529 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.53 127.08 31.4 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.167 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.82 117.79 9.42 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.539 -0.726 . . . . 0.0 110.249 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -113.21 96.08 0.79 Allowed Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -74.38 80.58 2.22 Favored 'Trans proline' 0 C--N 1.314 -1.268 0 O-C-N 123.906 1.477 . . . . 0.0 110.218 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 3.7 m-90 . . . . . 0 N--CA 1.501 2.089 0 CA-C-O 118.474 -0.774 . . . . 0.0 110.642 -179.821 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.464 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.439 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 93.2 m -110.35 13.58 22.86 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.473 -1.016 . . . . 0.0 110.893 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 tt -65.95 115.06 5.63 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.068 -1.02 . . . . 0.0 110.382 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.88 -29.77 3.48 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.402 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 35.9 t70 -64.88 156.8 29.76 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.403 -1.057 . . . . 0.0 110.538 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.25 149.95 22.85 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.412 -0.805 . . . . 0.0 110.51 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.456 ' SG ' ' SG ' ' A' ' 13' ' ' CYS . 0.1 OUTLIER -105.28 23.46 13.67 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.412 -0.805 . . . . 0.0 110.669 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -116.99 -44.84 2.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.233 -0.917 . . . . 0.0 110.487 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.76 -57.86 6.23 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.439 -0.788 . . . . 0.0 110.499 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -108.82 -26.35 10.33 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.481 -0.762 . . . . 0.0 110.782 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.4 t30 53.26 50.14 18.29 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.497 -0.752 . . . . 0.0 110.298 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -141.02 85.08 0.21 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 81.8 m -83.83 -169.85 2.78 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.654 -0.909 . . . . 0.0 110.7 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.439 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 0.8 OUTLIER -77.82 175.45 9.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.457 -0.777 . . . . 0.0 110.183 179.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 55.6 p -69.01 114.89 7.7 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.334 -0.854 . . . . 0.0 110.111 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.6 4.39 55.97 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 110.229 -1.149 . . . . 0.0 110.229 -179.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.473 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 3.3 m-85 -100.27 144.12 29.66 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.048 -1.266 . . . . 0.0 109.904 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.6 m -123.44 161.47 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.467 -0.77 . . . . 0.0 110.71 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 m -82.6 114.05 20.72 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.592 -0.693 . . . . 0.0 109.891 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.477 ' CB ' ' CZ3' ' A' ' 25' ' ' TRP . 0.3 OUTLIER -70.89 153.13 42.97 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.401 -0.812 . . . . 0.0 110.604 -179.776 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.45 10.76 23.94 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.581 -0.699 . . . . 0.0 110.88 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.5 m -103.15 -78.71 0.54 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.126 -0.984 . . . . 0.0 110.044 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.631 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 23.9 m95 -89.74 6.62 40.77 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.252 -0.905 . . . . 0.0 110.607 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.9 mptt 53.31 54.85 9.57 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.42 -0.8 . . . . 0.0 110.296 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.631 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -136.32 173.53 11.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.292 -0.88 . . . . 0.0 110.723 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.402 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 85.8 m -73.68 131.19 41.37 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.476 -0.765 . . . . 0.0 111.1 -178.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.442 HG21 ' CE2' ' A' ' 25' ' ' TRP . 2.9 t -135.63 161.67 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.66 -0.65 . . . . 0.0 109.856 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.3 mt -74.52 134.25 42.24 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.441 -0.787 . . . . 0.0 110.23 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.93 128.05 32.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.515 -0.74 . . . . 0.0 110.21 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.43 161.26 37.32 Favored Glycine 0 N--CA 1.495 2.603 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -71.82 131.03 17.71 Favored 'Trans proline' 0 C--N 1.312 -1.351 0 O-C-N 123.905 1.477 . . . . 0.0 110.551 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 43.7 m95 . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 117.836 -1.078 . . . . 0.0 110.104 179.966 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.429 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 13.0 m 59.66 38.04 22.12 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.64 -0.918 . . . . 0.0 110.686 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 tt -96.14 107.58 19.92 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.407 -0.808 . . . . 0.0 109.553 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 143.24 -25.16 2.2 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.04 128.23 35.14 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.364 -1.08 . . . . 0.0 110.151 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 25' ' ' TRP . 13.2 pttp -84.62 149.87 25.56 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.552 -0.717 . . . . 0.0 110.55 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.5 p -143.05 139.74 30.66 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.575 -0.703 . . . . 0.0 110.226 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -103.55 -33.58 8.97 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.565 -0.71 . . . . 0.0 110.879 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -154.88 -59.11 0.11 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.242 -0.911 . . . . 0.0 110.265 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -132.5 46.39 2.64 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.558 -0.714 . . . . 0.0 110.308 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -58.18 -49.75 75.94 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.479 -0.763 . . . . 0.0 110.281 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 107.79 80.94 1.31 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 87.8 m -79.91 171.67 14.8 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.403 -1.057 . . . . 0.0 109.55 179.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.0 OUTLIER -67.27 160.1 27.81 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.111 -0.993 . . . . 0.0 110.255 179.777 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 p -59.13 121.07 10.41 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.441 -0.787 . . . . 0.0 110.452 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 103.15 -8.92 53.99 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -103.98 148.34 26.31 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.075 -1.25 . . . . 0.0 110.706 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.7 171.11 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.599 -0.688 . . . . 0.0 110.277 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.3 m -94.43 122.56 37.12 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.257 -0.902 . . . . 0.0 110.487 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.429 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -88.92 165.64 14.47 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.391 -0.818 . . . . 0.0 110.935 179.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -91.31 -30.78 16.38 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.514 -0.741 . . . . 0.0 111.266 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.1 m -55.32 -73.67 0.05 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.476 -0.765 . . . . 0.0 111.142 -178.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.574 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 34.6 m95 -100.2 5.82 44.74 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.145 -0.972 . . . . 0.0 110.95 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 20' ' ' SER . 0.1 OUTLIER 52.6 59.82 4.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.302 -0.873 . . . . 0.0 110.146 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.574 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.1 p90 -141.18 175.21 9.83 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.377 -0.827 . . . . 0.0 110.72 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.1 m -76.07 127.15 32.36 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.544 -0.723 . . . . 0.0 110.583 -179.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.42 HG21 ' CE2' ' A' ' 25' ' ' TRP . 2.3 t -127.96 159.93 38.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.571 -0.706 . . . . 0.0 109.809 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.2 142.44 57.71 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.36 -0.837 . . . . 0.0 110.322 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.92 -27.46 68.87 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.57 -0.706 . . . . 0.0 110.924 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.7 168.09 32.47 Favored Glycine 0 N--CA 1.494 2.557 0 N-CA-C 109.927 -1.269 . . . . 0.0 109.927 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.73 136.65 28.39 Favored 'Trans proline' 0 C--N 1.313 -1.306 0 O-C-N 123.829 1.436 . . . . 0.0 110.783 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 117.855 -1.069 . . . . 0.0 110.457 -179.888 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.418 0 N-CA-C 109.958 -1.257 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 84.0 m -103.06 4.7 37.49 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.522 -0.987 . . . . 0.0 110.851 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.04 114.06 6.25 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.963 -1.085 . . . . 0.0 109.621 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 122.64 -18.35 8.15 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.49 116.39 3.07 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.364 -1.08 . . . . 0.0 110.04 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.53 138.7 57.69 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.411 -0.806 . . . . 0.0 110.641 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 p -128.62 116.81 20.18 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.724 -0.61 . . . . 0.0 110.24 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.36 -59.79 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.434 -0.791 . . . . 0.0 110.459 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -79.47 -44.13 21.89 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.427 -0.796 . . . . 0.0 110.182 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -96.09 -35.58 11.3 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.445 -0.784 . . . . 0.0 110.149 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 54.86 68.19 0.9 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.656 -0.653 . . . . 0.0 110.684 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.15 84.8 0.2 Allowed Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.2 m -80.52 169.88 17.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.544 -0.974 . . . . 0.0 110.502 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.5 m -78.45 177.26 8.65 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.403 -0.811 . . . . 0.0 110.099 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 37.8 m -64.34 129.43 39.9 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.325 -0.859 . . . . 0.0 109.957 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.32 17.79 75.46 Favored Glycine 0 N--CA 1.493 2.491 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.4 ' HB3' ' HB3' ' A' ' 26' ' ' CYS . 11.9 m-85 -125.48 132.21 52.7 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.292 -1.122 . . . . 0.0 109.666 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.9 m -117.64 146.85 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.327 -0.858 . . . . 0.0 110.648 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.5 t -67.11 119.13 11.53 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.603 -0.685 . . . . 0.0 110.05 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.55 ' HB2' HG22 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -75.11 132.69 41.41 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.438 -0.788 . . . . 0.0 110.732 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -81.31 -15.07 56.52 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.489 -0.757 . . . . 0.0 109.535 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.4 m -101.32 -44.58 5.6 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.475 -0.766 . . . . 0.0 110.401 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.752 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.4 m95 -91.81 -16.97 26.02 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.448 -0.782 . . . . 0.0 111.218 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.0 12.77 8.94 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.56 -0.713 . . . . 0.0 112.252 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.752 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -124.13 160.16 28.41 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.889 -1.132 . . . . 0.0 109.671 178.743 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.4 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 78.8 m -71.39 109.1 5.17 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.38 -0.825 . . . . 0.0 110.957 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.55 HG22 ' HB2' ' A' ' 20' ' ' SER . 0.8 OUTLIER -106.38 165.33 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.471 -0.768 . . . . 0.0 109.815 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.85 148.07 50.28 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.344 -0.848 . . . . 0.0 110.409 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.71 14.72 8.0 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.432 -0.793 . . . . 0.0 111.168 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.06 178.61 49.6 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.86 162.95 40.4 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.77 1.405 . . . . 0.0 110.382 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.07 0 CA-C-O 117.847 -1.073 . . . . 0.0 111.041 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.8 p -92.22 4.36 53.41 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.604 -0.939 . . . . 0.0 111.155 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.1 tp -74.72 123.7 25.42 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.097 -1.002 . . . . 0.0 109.942 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 108.56 -14.14 35.61 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.62 139.76 47.58 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.18 -1.188 . . . . 0.0 109.496 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.74 139.88 52.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.507 -0.746 . . . . 0.0 110.7 -179.456 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.5 t -132.1 144.54 50.79 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.526 -0.734 . . . . 0.0 110.369 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -123.28 -66.78 0.99 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.629 -0.669 . . . . 0.0 109.818 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -157.66 -58.93 0.08 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.496 -0.752 . . . . 0.0 110.254 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -105.81 45.53 0.97 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.564 -0.71 . . . . 0.0 110.396 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -76.97 -45.74 26.5 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.35 -0.844 . . . . 0.0 110.281 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.19 74.63 1.28 Allowed Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.9 m -89.57 -168.46 2.16 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.495 -1.003 . . . . 0.0 110.233 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.489 ' HB2' ' CD1' ' A' ' 17' ' ' TYR . 85.8 m -63.94 162.8 13.18 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.309 -0.869 . . . . 0.0 110.336 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.9 m -67.19 115.38 6.8 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.364 -0.835 . . . . 0.0 109.962 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 103.33 14.15 26.73 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.489 ' CD1' ' HB2' ' A' ' 14' ' ' CYS . 3.3 m-85 -106.56 121.41 44.25 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.157 -1.202 . . . . 0.0 109.993 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -91.0 163.55 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.504 -0.748 . . . . 0.0 110.142 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t -95.97 114.31 26.01 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.575 -0.703 . . . . 0.0 109.801 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.524 ' HB2' HG22 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -90.36 111.0 22.06 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.331 -0.855 . . . . 0.0 110.401 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -26.12 53.32 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.404 -0.81 . . . . 0.0 109.646 179.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.0 m -67.46 -44.51 78.44 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.61 -0.681 . . . . 0.0 110.076 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.667 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.5 m95 -98.01 -12.26 22.12 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.443 -0.785 . . . . 0.0 110.665 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.406 ' O ' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 64.95 34.39 9.04 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.576 -0.703 . . . . 0.0 111.547 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.667 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -147.06 154.88 41.71 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.076 -1.015 . . . . 0.0 109.915 178.793 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.31 115.54 15.06 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.362 -0.836 . . . . 0.0 110.886 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.524 HG22 ' HB2' ' A' ' 20' ' ' SER . 1.0 OUTLIER -106.83 170.21 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.719 -0.613 . . . . 0.0 109.99 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.85 148.34 31.39 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.348 -0.845 . . . . 0.0 110.039 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.15 90.71 6.59 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.413 -0.804 . . . . 0.0 110.421 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.29 -92.36 1.73 Allowed Glycine 0 N--CA 1.494 2.526 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.46 109.11 2.78 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 O-C-N 124.002 1.527 . . . . 0.0 110.391 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 47.6 t-105 . . . . . 0 N--CA 1.495 1.81 0 CA-C-O 117.927 -1.035 . . . . 0.0 110.5 -179.882 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.415 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.1 p -101.59 60.98 0.9 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.474 -1.016 . . . . 0.0 110.542 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.9 tt -78.12 107.16 10.5 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.356 -0.84 . . . . 0.0 109.902 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.01 -16.84 3.66 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.7 122.69 17.84 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.246 -1.15 . . . . 0.0 109.996 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.59 142.39 22.89 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.651 -0.656 . . . . 0.0 111.263 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.7 t -137.03 144.01 43.01 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.595 -0.69 . . . . 0.0 110.079 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -125.59 -67.85 0.86 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.451 -0.781 . . . . 0.0 110.461 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -150.68 -58.43 0.17 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.261 -0.9 . . . . 0.0 110.332 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -104.79 42.44 1.21 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.491 -0.756 . . . . 0.0 110.106 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -89.07 -49.78 6.56 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.321 -0.862 . . . . 0.0 110.141 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.01 106.34 0.65 Allowed Glycine 0 N--CA 1.493 2.451 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.434 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 74.9 m -83.32 -168.35 2.06 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.56 -0.965 . . . . 0.0 110.262 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.0 m -80.51 179.67 7.62 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.262 -0.899 . . . . 0.0 110.729 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.0 p -68.49 122.25 18.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.474 -0.766 . . . . 0.0 109.859 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.09 14.38 69.41 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.434 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 5.1 m-85 -113.77 156.29 24.1 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.307 -1.114 . . . . 0.0 110.191 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.418 ' CG2' ' N ' ' A' ' 19' ' ' CYS . 1.5 p -128.6 163.43 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.418 -0.801 . . . . 0.0 110.623 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.418 ' N ' ' CG2' ' A' ' 18' ' ' VAL . 14.9 t -89.74 109.97 20.91 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.881 -0.512 . . . . 0.0 110.139 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.409 ' HB2' HG21 ' A' ' 27' ' ' VAL . 1.1 m -90.42 120.39 31.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.427 -0.796 . . . . 0.0 110.744 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -30.88 56.13 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.581 -0.699 . . . . 0.0 110.195 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.6 m -61.24 -48.19 82.63 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.497 -0.752 . . . . 0.0 110.235 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.671 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.5 m95 -100.37 -2.52 33.23 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.445 -0.784 . . . . 0.0 110.847 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 mtmm 54.87 35.19 23.77 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.406 -0.809 . . . . 0.0 111.981 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.671 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -144.55 157.36 44.26 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.057 -1.027 . . . . 0.0 109.882 178.731 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.418 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 56.8 m -71.89 104.8 3.6 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.337 -0.852 . . . . 0.0 110.888 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.528 HG23 ' CE2' ' A' ' 25' ' ' TRP . 12.2 t -95.13 163.41 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.55 -0.719 . . . . 0.0 109.461 179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.6 tt -78.17 129.96 35.76 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.339 -0.851 . . . . 0.0 110.189 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.92 107.22 10.29 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.596 -0.69 . . . . 0.0 110.125 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.22 131.75 12.64 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.07 110.87 3.04 Favored 'Trans proline' 0 C--N 1.314 -1.261 0 O-C-N 123.895 1.471 . . . . 0.0 110.482 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 4.4 t90 . . . . . 0 N--CA 1.495 1.798 0 CA-C-O 117.856 -1.069 . . . . 0.0 110.453 -179.88 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.367 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 72.2 m -119.98 35.05 4.98 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.506 -0.996 . . . . 0.0 110.58 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 tt -86.51 130.33 34.53 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.21 -0.932 . . . . 0.0 109.969 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.16 -22.34 36.88 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.892 -1.283 . . . . 0.0 109.892 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -64.26 125.28 24.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.333 -1.098 . . . . 0.0 110.184 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -59.13 151.93 21.48 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.631 -0.668 . . . . 0.0 110.667 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.0 m -69.87 145.99 51.6 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.482 -0.761 . . . . 0.0 110.222 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -82.11 -55.03 4.81 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.437 -0.79 . . . . 0.0 109.889 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -162.24 -58.4 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.69 -0.631 . . . . 0.0 109.481 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -97.21 -33.36 11.51 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.667 -0.645 . . . . 0.0 109.523 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.527 ' HA ' ' HB2' ' A' ' 19' ' ' CYS . 0.9 OUTLIER -163.58 -62.13 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.63 -0.669 . . . . 0.0 109.849 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 58.49 40.42 94.38 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 109.954 -1.258 . . . . 0.0 109.954 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.4 m -125.98 156.65 39.49 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.519 -0.989 . . . . 0.0 110.489 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.9 m -83.03 175.9 9.66 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.521 -0.737 . . . . 0.0 110.134 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.6 m -60.36 124.49 20.47 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.429 -0.794 . . . . 0.0 110.172 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.58 15.42 37.51 Favored Glycine 0 N--CA 1.494 2.556 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -132.23 143.07 49.67 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.298 -1.119 . . . . 0.0 110.21 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 19.7 m -120.27 147.44 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.483 -0.76 . . . . 0.0 110.26 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.527 ' HB2' ' HA ' ' A' ' 11' ' ' ASN . 42.5 t -78.98 103.07 8.67 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.468 -0.77 . . . . 0.0 109.987 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.497 ' HB2' HG22 ' A' ' 27' ' ' VAL . 26.1 t -72.11 128.57 36.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.476 -0.765 . . . . 0.0 110.217 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.4 ' HA ' ' HE2' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -80.35 -16.06 55.42 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.419 -0.801 . . . . 0.0 110.132 179.292 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 m -84.67 -46.95 10.97 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.339 -0.85 . . . . 0.0 110.263 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.666 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.9 m95 -99.98 -15.73 18.19 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.384 -0.823 . . . . 0.0 110.926 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 11.5 mmtt 62.92 35.67 13.26 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.72 -0.613 . . . . 0.0 111.844 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.666 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -136.36 158.48 44.32 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.098 -1.001 . . . . 0.0 109.378 178.121 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.4 m -70.56 104.36 2.77 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.334 -0.854 . . . . 0.0 110.744 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.497 HG22 ' HB2' ' A' ' 20' ' ' SER . 2.0 t -99.09 156.55 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 109.567 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -65.74 128.55 36.41 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.465 -0.772 . . . . 0.0 110.197 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.79 101.39 1.33 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.587 -0.696 . . . . 0.0 110.338 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -106.51 -152.7 19.61 Favored Glycine 0 N--CA 1.493 2.488 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -72.16 -28.91 15.08 Favored 'Trans proline' 0 C--N 1.313 -1.297 0 O-C-N 123.96 1.505 . . . . 0.0 111.034 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.6 m0 . . . . . 0 N--CA 1.497 1.894 0 CA-C-O 117.887 -1.054 . . . . 0.0 110.274 -179.879 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.368 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.43 ' HB3' ' HB2' ' A' ' 14' ' ' CYS . 14.1 m -90.48 -9.16 48.4 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.503 -0.998 . . . . 0.0 111.167 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 tp -58.81 120.75 9.57 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.19 -0.944 . . . . 0.0 110.01 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.1 -23.23 6.95 Favored Glycine 0 N--CA 1.493 2.498 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -65.3 156.14 33.0 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.264 -1.139 . . . . 0.0 110.069 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -90.3 147.94 23.19 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.404 -0.81 . . . . 0.0 111.102 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.8 p -140.98 155.2 46.27 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.498 -0.751 . . . . 0.0 109.811 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -122.64 -69.37 0.83 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.336 -0.853 . . . . 0.0 110.443 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -160.62 -55.86 0.05 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.407 -0.808 . . . . 0.0 109.903 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -106.62 15.13 26.13 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.656 -0.653 . . . . 0.0 110.414 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -72.34 -48.87 38.55 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.221 -0.925 . . . . 0.0 109.958 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.43 109.69 2.74 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.8 m -79.79 -166.53 1.02 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.549 -0.971 . . . . 0.0 110.033 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 2' ' ' CYS . 0.5 OUTLIER -71.92 170.81 12.96 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.273 -0.892 . . . . 0.0 110.754 -179.883 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.8 m -66.16 115.3 6.02 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.551 -0.718 . . . . 0.0 109.806 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.36 -17.22 59.4 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.836 -1.306 . . . . 0.0 109.836 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -89.58 140.24 29.74 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.281 -1.129 . . . . 0.0 110.159 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 4.2 t -103.53 160.73 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.524 -0.735 . . . . 0.0 109.741 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.9 t -92.56 115.95 28.56 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.482 -0.761 . . . . 0.0 109.903 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.587 ' HB2' HG22 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -77.29 115.9 17.45 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.525 -0.734 . . . . 0.0 110.118 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -78.29 -13.82 59.69 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.512 -0.742 . . . . 0.0 109.855 179.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 49.8 m -91.09 -44.78 9.07 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.458 -0.776 . . . . 0.0 110.187 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.668 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.2 m95 -96.18 -13.62 23.38 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.411 -0.805 . . . . 0.0 110.897 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 3.2 mmmm 66.03 31.34 9.09 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.62 -0.675 . . . . 0.0 111.905 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.668 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -139.02 156.06 47.5 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.062 -1.024 . . . . 0.0 109.673 178.429 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.4 m -73.16 109.97 7.09 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.183 -0.948 . . . . 0.0 110.869 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.587 HG22 ' HB2' ' A' ' 20' ' ' SER . 1.6 t -104.6 156.38 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.513 -0.742 . . . . 0.0 109.808 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.8 tp -79.09 147.13 32.88 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.407 -0.808 . . . . 0.0 109.949 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.34 88.55 2.58 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.465 -0.772 . . . . 0.0 110.191 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -154.8 -176.11 26.67 Favored Glycine 0 N--CA 1.495 2.627 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.58 -14.49 24.78 Favored 'Trans proline' 0 C--N 1.314 -1.24 0 O-C-N 123.874 1.46 . . . . 0.0 111.541 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 3.6 m0 . . . . . 0 N--CA 1.5 2.059 0 CA-C-O 117.872 -1.061 . . . . 0.0 110.533 -179.996 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.443 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.5 p -109.73 58.52 0.61 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.489 -1.006 . . . . 0.0 110.557 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.4 tt -81.79 132.3 35.28 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.316 -0.865 . . . . 0.0 109.988 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.26 -30.19 6.63 Favored Glycine 0 N--CA 1.496 2.679 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.67 140.55 57.43 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.369 -1.077 . . . . 0.0 110.144 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -82.08 136.84 35.14 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.337 -0.852 . . . . 0.0 110.519 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.7 p -115.45 106.84 14.43 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.61 -0.681 . . . . 0.0 110.13 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -149.55 -48.84 0.14 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.672 -0.643 . . . . 0.0 110.514 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -70.06 -50.11 44.41 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.489 -0.757 . . . . 0.0 109.978 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -101.7 -30.33 11.39 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.599 -0.688 . . . . 0.0 110.605 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 t30 54.76 50.66 15.28 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.574 -0.704 . . . . 0.0 110.282 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -152.4 90.43 0.13 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.114 -1.594 . . . . 0.0 109.114 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 63.3 m -79.86 -160.6 0.28 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.669 -0.9 . . . . 0.0 110.448 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.6 m -75.74 173.41 11.15 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.429 -0.794 . . . . 0.0 110.358 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 p -64.02 123.94 20.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.36 -0.838 . . . . 0.0 109.918 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.61 -21.86 43.85 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -92.89 120.24 33.02 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.199 -1.177 . . . . 0.0 110.138 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 29' ' ' ALA . 12.0 t -100.59 163.77 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.61 -0.681 . . . . 0.0 109.872 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t -91.21 108.76 20.09 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.551 -0.718 . . . . 0.0 110.144 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.441 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -66.32 146.2 54.86 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.52 -0.738 . . . . 0.0 110.174 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.44 -29.54 17.91 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.481 -0.762 . . . . 0.0 110.918 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.3 m -78.15 -49.43 13.87 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.287 -0.883 . . . . 0.0 110.927 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CB ' ' CE3' ' A' ' 25' ' ' TRP . 6.9 m95 -96.08 -18.1 20.42 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.337 -0.852 . . . . 0.0 110.83 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 15.0 mttt 63.76 31.36 14.27 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.645 -0.66 . . . . 0.0 111.837 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.602 ' CE3' ' CB ' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -121.65 162.13 21.25 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 120.987 -1.071 . . . . 0.0 109.666 178.339 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.421 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 84.7 m -71.62 104.74 3.42 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.364 -0.835 . . . . 0.0 110.892 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.535 HG21 ' CD1' ' A' ' 25' ' ' TRP . 0.9 OUTLIER -106.53 161.08 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.541 -0.724 . . . . 0.0 109.69 179.808 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.33 149.05 50.96 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.367 -0.833 . . . . 0.0 110.285 179.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.445 ' HB2' HG22 ' A' ' 18' ' ' VAL . . . -84.58 66.72 9.67 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.442 -0.786 . . . . 0.0 110.539 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.94 -78.68 1.23 Allowed Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -75.15 -170.58 0.81 Allowed 'Trans proline' 0 C--N 1.314 -1.279 0 O-C-N 124.022 1.538 . . . . 0.0 110.528 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 . . . . . 0 N--CA 1.498 1.955 0 O-C-N 121.237 -0.915 . . . . 0.0 110.31 179.969 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.404 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.7 p -101.26 57.1 0.85 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.387 -1.066 . . . . 0.0 110.369 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.59 113.64 10.94 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.406 -0.809 . . . . 0.0 110.297 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.51 -21.64 4.25 Favored Glycine 0 N--CA 1.495 2.621 0 N-CA-C 110.319 -1.113 . . . . 0.0 110.319 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.82 123.75 17.51 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.277 -1.131 . . . . 0.0 110.277 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -69.27 135.07 49.95 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.479 -0.763 . . . . 0.0 110.794 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -121.13 146.06 47.16 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.645 -0.659 . . . . 0.0 109.826 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -133.86 -45.57 0.8 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.446 -0.784 . . . . 0.0 110.847 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -169.91 -55.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.327 -0.858 . . . . 0.0 109.826 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -104.63 22.11 15.62 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.675 -0.641 . . . . 0.0 110.584 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.0 t30 -74.49 -59.71 2.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.189 -0.944 . . . . 0.0 110.045 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.25 105.98 0.67 Allowed Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 69.1 m -81.05 179.02 8.05 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.525 -0.985 . . . . 0.0 110.324 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 76.7 m -75.0 174.07 9.84 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.434 -0.791 . . . . 0.0 110.409 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.7 m -66.34 119.32 11.37 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.443 -0.786 . . . . 0.0 109.831 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.97 -22.67 39.19 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -89.59 147.98 23.62 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.284 -1.127 . . . . 0.0 109.942 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.6 m -130.15 151.46 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.607 -0.683 . . . . 0.0 110.425 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 13' ' ' CYS . 73.8 m -73.45 103.28 4.04 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.464 -0.772 . . . . 0.0 109.985 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.519 ' HB2' HG22 ' A' ' 27' ' ' VAL . 30.2 t -73.86 137.63 43.88 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.412 -0.805 . . . . 0.0 110.24 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.67 -26.68 27.61 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.52 -0.738 . . . . 0.0 110.341 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.9 m -73.39 -45.61 53.75 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.416 -0.802 . . . . 0.0 110.28 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.76 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 5.8 m95 -100.12 -13.43 18.98 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.385 -0.822 . . . . 0.0 111.222 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.6 OUTLIER 62.76 31.66 16.43 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.529 -0.732 . . . . 0.0 111.938 179.78 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.76 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -141.97 160.82 39.44 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.022 -1.049 . . . . 0.0 109.853 178.344 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.41 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 71.0 m -66.49 107.39 2.05 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.349 -0.844 . . . . 0.0 111.473 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.585 HG21 ' CD1' ' A' ' 25' ' ' TRP . 0.9 OUTLIER -117.38 172.5 5.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.51 -0.744 . . . . 0.0 109.467 179.268 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.1 131.27 41.87 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.165 -0.959 . . . . 0.0 110.154 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.91 124.4 22.88 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.48 -0.762 . . . . 0.0 110.49 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -149.72 159.28 28.02 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -72.92 158.75 49.41 Favored 'Trans proline' 0 C--N 1.313 -1.304 0 O-C-N 123.976 1.514 . . . . 0.0 110.782 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 43.0 m0 . . . . . 0 N--CA 1.502 2.144 0 CA-C-O 118.626 -0.702 . . . . 0.0 110.471 -179.908 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.409 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 89.7 m -103.58 9.66 37.33 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.473 -1.016 . . . . 0.0 111.077 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.8 97.73 0.85 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.093 -1.004 . . . . 0.0 109.918 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.22 -22.47 3.57 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.56 128.18 34.79 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.256 -1.144 . . . . 0.0 110.084 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.81 159.27 32.16 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.479 -0.763 . . . . 0.0 110.238 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.43 156.05 38.68 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.538 -0.726 . . . . 0.0 110.101 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -130.98 -65.91 0.77 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.475 -0.766 . . . . 0.0 110.393 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -164.46 -51.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.401 -0.812 . . . . 0.0 110.767 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -94.3 9.84 36.53 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.402 -0.812 . . . . 0.0 111.19 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 58.09 70.32 0.66 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.359 -0.838 . . . . 0.0 110.29 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -87.93 59.36 4.25 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.447 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 87.2 m -89.61 178.6 6.24 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.496 -1.003 . . . . 0.0 109.897 179.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.1 m -75.52 179.81 5.07 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.177 -0.952 . . . . 0.0 110.62 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.5 m -68.56 112.58 5.44 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.549 -0.72 . . . . 0.0 109.996 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.77 -7.07 67.71 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.106 -1.197 . . . . 0.0 110.106 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.447 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 3.6 m-85 -91.21 137.49 32.32 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.192 -1.181 . . . . 0.0 110.1 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.2 t -123.82 164.04 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.43 -0.794 . . . . 0.0 110.412 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 11.7 t -85.23 119.45 25.62 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.454 -0.779 . . . . 0.0 110.299 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.47 ' CB ' ' CZ3' ' A' ' 25' ' ' TRP . 0.6 OUTLIER -83.39 166.81 18.1 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.493 -0.754 . . . . 0.0 110.599 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.64 -24.4 20.51 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.533 -0.73 . . . . 0.0 111.194 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.5 m -62.48 -81.6 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.274 -0.891 . . . . 0.0 110.851 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.591 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 37.9 m95 -89.52 4.08 50.39 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.201 -0.937 . . . . 0.0 110.738 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 20' ' ' SER . 18.0 mtpt 52.53 62.69 2.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.333 -0.855 . . . . 0.0 110.114 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.591 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.4 p90 -144.32 175.4 10.12 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.466 -0.771 . . . . 0.0 110.66 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.8 m -81.53 122.51 27.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.465 -0.772 . . . . 0.0 110.281 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.443 ' CG2' ' N ' ' A' ' 28' ' ' LEU . 2.0 p -134.39 166.83 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.573 -0.704 . . . . 0.0 110.079 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.443 ' N ' ' CG2' ' A' ' 27' ' ' VAL . 0.4 OUTLIER -73.24 139.02 45.91 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.883 -0.511 . . . . 0.0 110.51 -179.853 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.36 166.98 19.97 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.482 -0.761 . . . . 0.0 110.499 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 140.82 171.44 12.53 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -78.14 171.99 63.87 Favored 'Cis proline' 0 C--N 1.317 -1.13 0 C-N-CA 121.713 -2.203 . . . . 0.0 110.591 -0.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 . . . . . 0 N--CA 1.496 1.85 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.43 179.802 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.593 0 N-CA-C 110.036 -1.225 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 65.2 m -124.83 51.23 1.66 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.399 -1.059 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.64 103.96 16.41 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.272 -0.892 . . . . 0.0 109.829 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.41 -18.33 3.93 Favored Glycine 0 N--CA 1.495 2.584 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.28 121.57 8.52 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.475 -1.014 . . . . 0.0 110.274 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.86 141.54 47.95 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.312 -0.867 . . . . 0.0 110.715 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.62 141.75 58.35 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.608 -0.682 . . . . 0.0 110.129 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -106.84 -66.47 1.01 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.373 -0.829 . . . . 0.0 110.694 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -141.1 -60.45 0.49 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.231 -0.918 . . . . 0.0 110.309 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -98.01 -35.13 10.54 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.523 -0.736 . . . . 0.0 109.947 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -167.35 -65.16 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.644 -0.66 . . . . 0.0 109.916 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 67.88 36.02 85.88 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 109.852 -1.299 . . . . 0.0 109.852 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 48.4 m -120.55 -179.56 4.02 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.527 -0.984 . . . . 0.0 110.162 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 62.1 m -99.5 177.21 5.24 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.427 -0.796 . . . . 0.0 110.047 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.3 m -62.79 124.62 21.5 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.393 -0.817 . . . . 0.0 110.288 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.07 14.32 60.79 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -128.17 125.15 38.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.138 -1.213 . . . . 0.0 110.409 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.1 t -103.04 159.68 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.521 -0.737 . . . . 0.0 109.549 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.69 116.51 24.01 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.371 -0.83 . . . . 0.0 109.969 179.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.509 ' HB2' HG22 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -75.51 127.46 33.14 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.55 -0.719 . . . . 0.0 110.475 -179.804 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -80.94 -12.7 59.35 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.476 -0.765 . . . . 0.0 110.192 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.8 m -89.99 -45.98 8.82 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.377 -0.827 . . . . 0.0 109.988 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.687 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.2 m95 -97.58 -11.53 23.55 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.528 -0.732 . . . . 0.0 110.926 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.88 22.86 11.37 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.446 -0.784 . . . . 0.0 112.032 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.687 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -131.97 155.13 48.51 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.866 -1.146 . . . . 0.0 109.912 178.6 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 68.4 m -72.81 109.36 6.35 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.468 -0.77 . . . . 0.0 110.841 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.509 HG22 ' HB2' ' A' ' 20' ' ' SER . 2.8 t -99.23 167.58 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.523 -0.736 . . . . 0.0 109.692 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.97 132.44 47.3 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.286 -0.884 . . . . 0.0 110.622 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.57 170.43 10.86 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.655 -0.653 . . . . 0.0 110.717 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -156.49 -178.44 30.61 Favored Glycine 0 N--CA 1.496 2.663 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -76.4 145.78 82.94 Favored 'Cis proline' 0 C--N 1.315 -1.203 0 C-N-CA 121.759 -2.184 . . . . 0.0 110.613 -0.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 48.2 t-105 . . . . . 0 N--CA 1.494 1.754 0 CA-C-O 117.85 -1.072 . . . . 0.0 110.534 179.86 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.472 0 N-CA-C 109.731 -1.347 . . . . 0.0 109.731 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.7 m -107.76 38.16 2.24 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.481 -1.011 . . . . 0.0 110.379 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.508 HD11 ' HA ' ' A' ' 27' ' ' VAL . 11.3 tp -72.5 109.43 6.17 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.306 -0.871 . . . . 0.0 110.193 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.87 -22.48 6.82 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 110.108 -1.197 . . . . 0.0 110.108 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.8 118.33 7.57 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.284 -1.127 . . . . 0.0 109.963 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -64.58 146.6 54.39 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.223 -0.923 . . . . 0.0 109.849 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 98.0 m -63.89 161.93 14.67 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.383 -0.823 . . . . 0.0 110.032 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.5 -82.64 0.39 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.207 -0.933 . . . . 0.0 109.941 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -115.74 -55.54 2.42 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.454 -0.779 . . . . 0.0 109.502 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -121.38 -27.21 4.87 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.636 -0.665 . . . . 0.0 110.485 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -176.82 84.19 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.36 -0.837 . . . . 0.0 109.82 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -97.58 64.08 0.92 Allowed Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 67.0 m -126.15 144.84 50.6 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.633 -0.922 . . . . 0.0 110.294 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 28.6 p -69.61 166.17 19.6 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.489 -0.757 . . . . 0.0 110.336 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.87 129.15 38.4 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.466 -0.771 . . . . 0.0 110.524 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.5 -27.65 17.29 Favored Glycine 0 N--CA 1.494 2.538 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -108.28 134.67 50.78 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.275 -1.132 . . . . 0.0 110.361 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.3 m -103.98 149.36 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.487 -0.758 . . . . 0.0 110.701 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.3 t -75.37 113.83 13.2 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.524 -0.735 . . . . 0.0 110.329 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.584 ' HB2' HG22 ' A' ' 27' ' ' VAL . 0.3 OUTLIER -82.4 126.12 31.82 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.416 -0.802 . . . . 0.0 110.044 179.634 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.7 mtt-85 -80.86 -23.4 39.09 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.343 -0.848 . . . . 0.0 110.411 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.436 HG21 ' CZ3' ' A' ' 23' ' ' TRP . 25.4 m -77.02 -46.84 22.41 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.441 -0.787 . . . . 0.0 110.165 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.713 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.7 m95 -97.26 -6.18 35.09 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.487 -0.758 . . . . 0.0 110.741 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 4.1 mmmm 58.37 26.06 13.6 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.583 -0.698 . . . . 0.0 111.582 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.713 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -134.12 152.96 52.08 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.1 -1.0 . . . . 0.0 109.855 178.841 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.7 m -71.15 109.62 5.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.366 -0.834 . . . . 0.0 110.729 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.584 HG22 ' HB2' ' A' ' 20' ' ' SER . 2.1 t -99.97 159.45 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 121.469 -0.77 . . . . 0.0 109.939 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 pp -74.11 146.82 43.26 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.382 -0.824 . . . . 0.0 110.563 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -105.87 120.55 42.03 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.594 -0.691 . . . . 0.0 109.852 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.454 ' HA2' ' HA ' ' A' ' 31' ' ' PRO . . . -170.9 -128.36 1.02 Allowed Glycine 0 N--CA 1.494 2.552 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.454 ' HA ' ' HA2' ' A' ' 30' ' ' GLY . 46.9 Cg_endo -72.96 161.87 92.81 Favored 'Cis proline' 0 N--CA 1.49 1.274 0 C-N-CA 121.866 -2.139 . . . . 0.0 110.875 0.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.901 0 CA-C-O 117.861 -1.066 . . . . 0.0 110.61 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.462 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 86.4 m -103.18 20.67 17.25 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.44 -1.036 . . . . 0.0 110.915 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.97 111.02 12.07 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.031 -1.043 . . . . 0.0 109.892 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.16 -25.78 3.3 Favored Glycine 0 N--CA 1.494 2.567 0 N-CA-C 109.826 -1.31 . . . . 0.0 109.826 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -66.99 118.2 10.12 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.411 -1.052 . . . . 0.0 110.287 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 25' ' ' TRP . 8.7 mptt -70.27 150.3 46.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.448 -0.783 . . . . 0.0 110.584 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.0 m -75.72 179.3 5.5 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.533 -0.729 . . . . 0.0 110.208 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -137.62 -58.32 0.68 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.381 -0.824 . . . . 0.0 110.675 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -154.74 -53.21 0.09 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.402 -0.811 . . . . 0.0 110.731 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -94.29 10.05 35.66 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.445 -0.784 . . . . 0.0 111.417 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 52.46 67.17 1.02 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.344 -0.847 . . . . 0.0 109.938 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -93.5 62.15 2.04 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 16.7 m -79.42 163.62 24.65 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.502 -0.999 . . . . 0.0 109.681 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 40.0 m -61.9 166.59 4.4 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.309 -0.869 . . . . 0.0 110.783 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.8 p -64.71 128.23 34.91 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.359 -0.838 . . . . 0.0 109.98 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.5 6.82 62.31 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -120.42 153.73 36.15 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.196 -1.179 . . . . 0.0 110.01 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.22 147.02 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.39 -0.819 . . . . 0.0 110.328 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.8 t -81.13 119.43 23.56 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.445 -0.784 . . . . 0.0 110.154 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.463 ' HB3' ' CZ3' ' A' ' 25' ' ' TRP . 0.4 OUTLIER -89.42 154.44 20.05 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.487 -0.758 . . . . 0.0 110.333 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -11.7 39.25 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.428 -0.795 . . . . 0.0 111.199 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.2 m -69.29 -65.17 0.74 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.259 -0.901 . . . . 0.0 110.267 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.584 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 9.0 m95 -106.93 5.33 28.17 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.414 -0.804 . . . . 0.0 110.423 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.2 mttm 54.37 62.83 2.39 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.436 -0.79 . . . . 0.0 110.801 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.584 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -148.83 171.31 16.49 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.331 -0.856 . . . . 0.0 110.579 179.664 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.9 m -77.51 129.98 36.38 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.51 -0.744 . . . . 0.0 110.716 -179.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.468 HG21 ' CE2' ' A' ' 25' ' ' TRP . 1.8 t -126.44 167.93 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.557 -0.714 . . . . 0.0 109.829 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -66.85 141.95 57.5 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.301 -0.874 . . . . 0.0 110.102 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.79 97.86 6.81 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.508 -0.745 . . . . 0.0 110.254 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -133.66 -92.61 0.48 Allowed Glycine 0 N--CA 1.493 2.485 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -77.51 158.76 95.15 Favored 'Cis proline' 0 N--CA 1.487 1.099 0 C-N-CA 121.778 -2.176 . . . . 0.0 110.563 -0.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.797 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.569 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.354 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 56.4 m -92.82 -17.35 24.23 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.398 -1.06 . . . . 0.0 110.896 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.496 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 0.5 OUTLIER -61.79 112.56 2.33 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.17 -0.956 . . . . 0.0 110.119 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.14 -27.43 4.81 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.15 113.08 3.31 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.446 -1.032 . . . . 0.0 110.105 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -66.39 130.73 44.2 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.514 -0.741 . . . . 0.0 110.598 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 t -110.47 140.47 44.7 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.529 -0.732 . . . . 0.0 109.988 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -151.04 -58.76 0.17 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.553 -0.717 . . . . 0.0 110.979 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -104.99 -75.05 0.63 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.359 -0.838 . . . . 0.0 110.685 -179.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -137.38 56.65 1.77 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.279 -0.888 . . . . 0.0 110.247 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.44 -51.62 49.32 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.447 -0.783 . . . . 0.0 110.196 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 74.78 92.47 0.16 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 179.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.7 m -83.63 164.43 19.71 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.515 -0.991 . . . . 0.0 109.941 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 26.3 p -77.3 177.02 8.25 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.371 -0.831 . . . . 0.0 110.701 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 73.3 p -58.38 140.3 53.87 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.378 -0.826 . . . . 0.0 110.697 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.3 1.98 89.29 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 -179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -133.09 137.75 46.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.162 -1.199 . . . . 0.0 110.23 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 30.2 m -139.78 160.08 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.475 -0.765 . . . . 0.0 110.544 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -72.26 112.17 8.1 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.46 -0.775 . . . . 0.0 109.924 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.558 ' HB2' HG22 ' A' ' 27' ' ' VAL . 8.7 t -89.56 158.1 17.79 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.347 -0.846 . . . . 0.0 110.819 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -88.73 -47.84 7.95 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.54 -0.725 . . . . 0.0 109.686 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 50.9 m -65.72 -38.68 89.84 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.642 -0.661 . . . . 0.0 110.005 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.552 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 6.8 m95 -90.47 -32.03 16.54 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.614 -0.679 . . . . 0.0 110.593 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 66.44 27.87 9.74 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.525 -0.734 . . . . 0.0 111.384 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.61 ' CD1' HG21 ' A' ' 27' ' ' VAL . 1.2 p90 -150.5 175.21 12.1 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.188 -0.945 . . . . 0.0 109.738 178.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 3' ' ' LEU . 77.8 m -71.63 100.32 2.27 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.094 -1.004 . . . . 0.0 109.525 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.61 HG21 ' CD1' ' A' ' 25' ' ' TRP . 0.6 OUTLIER -106.53 157.04 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.479 -0.763 . . . . 0.0 110.186 -179.287 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.27 135.94 57.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.658 -0.651 . . . . 0.0 110.166 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -93.63 59.59 2.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.458 -0.776 . . . . 0.0 110.411 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -92.18 178.94 40.6 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.427 ' O ' ' CB ' ' A' ' 32' ' ' TRP . 46.9 Cg_endo -73.72 162.51 91.93 Favored 'Cis proline' 0 N--CA 1.488 1.204 0 C-N-CA 121.616 -2.243 . . . . 0.0 110.57 0.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.427 ' CB ' ' O ' ' A' ' 31' ' ' PRO . 1.0 OUTLIER . . . . . 0 N--CA 1.503 2.211 0 CA-C-O 117.726 -1.13 . . . . 0.0 110.695 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.361 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 59.2 m -105.44 29.11 6.76 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.471 -1.017 . . . . 0.0 110.606 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.76 109.64 18.21 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.345 -0.847 . . . . 0.0 109.77 179.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 136.09 -21.43 3.51 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.871 -1.292 . . . . 0.0 109.871 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -66.66 110.68 3.31 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.236 -1.155 . . . . 0.0 109.753 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -65.35 149.36 50.11 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.439 -0.788 . . . . 0.0 110.642 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.49 ' HB2' ' HB3' ' A' ' 11' ' ' ASN . 29.7 p -149.06 157.62 43.55 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.537 -0.727 . . . . 0.0 110.325 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -118.55 -60.06 1.81 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.424 -0.797 . . . . 0.0 110.638 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -146.5 -57.51 0.28 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.33 -0.856 . . . . 0.0 110.687 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -106.33 38.78 1.96 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.42 -0.8 . . . . 0.0 110.592 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.49 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 28.4 t-20 -73.26 -57.7 3.83 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.232 -0.918 . . . . 0.0 109.965 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 92.66 95.77 1.42 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 71.4 m -90.9 -176.99 4.83 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.494 -1.004 . . . . 0.0 110.262 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.0 m -73.58 158.21 35.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.387 -0.821 . . . . 0.0 109.765 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 71.1 p -56.65 121.98 11.0 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.388 -0.82 . . . . 0.0 110.166 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.62 -23.19 30.45 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -93.63 143.7 26.06 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.271 -1.135 . . . . 0.0 110.358 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 32.8 m -130.89 160.3 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.452 -0.78 . . . . 0.0 110.304 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -77.48 119.19 20.73 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.391 -0.818 . . . . 0.0 110.226 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.58 ' HB3' ' HB2' ' A' ' 23' ' ' TRP . 28.7 t -90.79 153.43 20.25 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.529 -0.732 . . . . 0.0 110.404 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.79 -49.66 9.49 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.348 -0.845 . . . . 0.0 109.57 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.2 m -66.61 -44.46 82.06 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.505 -0.747 . . . . 0.0 109.912 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.615 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 5.8 m95 -81.7 -31.02 32.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.67 -0.644 . . . . 0.0 110.73 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.3 OUTLIER 62.06 25.21 15.09 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.344 -0.847 . . . . 0.0 111.226 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.636 ' CD1' HG21 ' A' ' 27' ' ' VAL . 1.3 p90 -144.45 176.65 9.22 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.105 -0.997 . . . . 0.0 109.913 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.2 m -70.84 101.0 2.03 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.246 -0.909 . . . . 0.0 110.338 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.636 HG21 ' CD1' ' A' ' 25' ' ' TRP . 0.8 OUTLIER -113.11 158.28 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.621 -0.674 . . . . 0.0 109.517 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.2 128.01 34.79 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.07 139.96 57.6 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.462 -0.774 . . . . 0.0 110.429 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -145.78 -167.05 12.28 Favored Glycine 0 N--CA 1.495 2.608 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -75.68 174.9 50.42 Favored 'Cis proline' 0 N--CA 1.489 1.246 0 C-N-CA 121.645 -2.231 . . . . 0.0 110.833 -0.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 2.9 m95 . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.427 179.979 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.57 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 95.5 m -99.62 0.53 42.29 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.275 -1.132 . . . . 0.0 110.966 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 tt -72.98 101.17 3.15 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.138 -0.976 . . . . 0.0 110.043 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 134.13 -16.75 4.39 Favored Glycine 0 N--CA 1.494 2.505 0 N-CA-C 110.021 -1.231 . . . . 0.0 110.021 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -61.51 123.66 18.47 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.367 -1.078 . . . . 0.0 110.441 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -66.97 149.22 50.93 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.54 -0.725 . . . . 0.0 111.097 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.53 154.92 31.0 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.541 -0.724 . . . . 0.0 110.137 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.3 -65.27 1.19 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.441 -0.787 . . . . 0.0 110.257 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -129.7 -67.76 0.74 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.506 -0.746 . . . . 0.0 109.821 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -118.76 -17.16 9.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.548 -0.72 . . . . 0.0 110.644 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -149.45 -66.58 0.22 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.157 -0.964 . . . . 0.0 110.173 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 55.58 37.68 68.49 Favored Glycine 0 N--CA 1.495 2.585 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 95.5 m -128.48 170.58 12.99 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.475 -1.015 . . . . 0.0 110.669 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 86.4 m -87.06 176.02 7.82 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.532 -0.73 . . . . 0.0 109.862 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.05 116.29 6.31 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.329 -0.857 . . . . 0.0 109.917 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 102.51 7.52 45.37 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -125.08 137.84 54.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.228 -1.16 . . . . 0.0 110.096 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.4 t -118.27 162.64 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.364 -0.835 . . . . 0.0 110.22 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 11.2 t -77.11 117.31 18.54 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.452 -0.78 . . . . 0.0 109.967 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.554 ' HB2' HG23 ' A' ' 27' ' ' VAL . 1.5 t -71.6 133.57 45.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.605 -0.685 . . . . 0.0 110.453 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -15.06 53.63 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.367 -0.833 . . . . 0.0 110.178 179.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.1 m -94.81 -46.02 7.07 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.402 -0.811 . . . . 0.0 110.491 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CB ' ' CE3' ' A' ' 25' ' ' TRP . 6.8 m95 -101.03 -13.11 18.37 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.411 -0.806 . . . . 0.0 111.093 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt 66.5 15.48 10.12 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.582 -0.698 . . . . 0.0 111.916 -179.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.615 ' CE3' ' CB ' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -117.54 157.66 25.95 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.893 -1.13 . . . . 0.0 109.633 178.773 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.5 m -62.59 101.41 0.25 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.467 -0.771 . . . . 0.0 111.076 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.554 HG23 ' HB2' ' A' ' 20' ' ' SER . 11.4 m -102.53 153.85 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.581 -0.699 . . . . 0.0 109.829 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 tp -68.0 138.87 56.22 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.519 -0.738 . . . . 0.0 110.582 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.21 121.87 13.64 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.64 -0.662 . . . . 0.0 110.519 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 31' ' ' PRO . . . -134.53 -155.81 7.61 Favored Glycine 0 N--CA 1.497 2.736 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.423 ' HA ' ' HA2' ' A' ' 30' ' ' GLY . 51.8 Cg_endo -78.42 -165.3 4.5 Favored 'Cis proline' 0 N--CA 1.489 1.237 0 C-N-CA 122.073 -2.053 . . . . 0.0 110.798 -0.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 . . . . . 0 N--CA 1.5 2.027 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.694 -179.938 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.484 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.457 ' HB2' ' CG ' ' A' ' 17' ' ' TYR . 61.5 m -109.21 8.04 25.65 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.557 -0.967 . . . . 0.0 110.986 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.532 HD13 ' HA ' ' A' ' 27' ' ' VAL . 0.9 OUTLIER -69.36 131.74 45.29 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.037 -1.04 . . . . 0.0 110.116 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 112.24 -24.58 13.92 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -61.49 118.82 7.49 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.404 -1.056 . . . . 0.0 110.158 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -70.58 139.48 51.46 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.433 -0.792 . . . . 0.0 110.754 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.451 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 69.8 m -121.06 177.32 5.17 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.628 -0.67 . . . . 0.0 110.226 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -131.18 -57.81 1.01 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.466 -0.771 . . . . 0.0 110.172 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -148.64 -60.66 0.24 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.533 -0.73 . . . . 0.0 109.976 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -129.93 38.15 3.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 0.0 110.098 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -54.18 -51.27 64.9 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.554 -0.716 . . . . 0.0 110.107 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.45 94.74 0.54 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.53 -175.2 5.07 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.447 -1.031 . . . . 0.0 109.884 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.0 p -60.72 157.41 14.8 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.262 -0.899 . . . . 0.0 110.297 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 m -55.77 125.34 20.84 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.486 -0.759 . . . . 0.0 110.301 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 113.33 -20.52 18.66 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.457 ' CG ' ' HB2' ' A' ' 2' ' ' CYS . 6.6 m-85 -113.37 152.72 29.62 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.286 -1.126 . . . . 0.0 110.58 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.15 138.59 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.606 -0.684 . . . . 0.0 110.405 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.1 m -74.92 119.6 19.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.446 -0.784 . . . . 0.0 109.889 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.549 ' HB3' HG22 ' A' ' 27' ' ' VAL . 89.9 p -81.36 132.59 35.34 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.461 -0.775 . . . . 0.0 110.772 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -80.32 -13.66 59.0 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.507 -0.746 . . . . 0.0 110.304 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.1 m -90.82 -49.21 6.57 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.338 -0.851 . . . . 0.0 110.181 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.715 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 6.7 m95 -92.27 -15.99 26.71 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.408 -0.808 . . . . 0.0 110.81 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 6.3 mtmm 65.6 31.16 10.13 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.695 -0.628 . . . . 0.0 111.681 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.715 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -139.05 155.12 48.18 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.13 -0.981 . . . . 0.0 109.348 178.164 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.51 ' O ' ' HA ' ' A' ' 3' ' ' LEU . 58.5 m -70.12 112.38 6.44 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.34 -0.85 . . . . 0.0 110.933 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.549 HG22 ' HB3' ' A' ' 20' ' ' SER . 1.3 t -108.94 167.48 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.37 -0.831 . . . . 0.0 109.764 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 tp -70.62 141.38 51.73 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.39 -0.818 . . . . 0.0 110.176 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.97 130.94 44.99 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.506 -0.746 . . . . 0.0 110.358 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.05 -173.05 35.87 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -75.61 154.03 98.59 Favored 'Cis proline' 0 C--N 1.315 -1.192 0 C-N-CA 121.549 -2.271 . . . . 0.0 110.721 -0.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.801 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.174 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 87.3 m -100.65 28.77 4.88 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.341 -1.093 . . . . 0.0 110.632 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.7 tt -80.42 113.86 18.91 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.186 -0.946 . . . . 0.0 109.928 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.66 -31.33 2.67 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -56.47 124.69 19.04 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.514 -0.992 . . . . 0.0 110.253 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.61 149.51 49.99 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.342 -0.849 . . . . 0.0 110.702 -179.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.9 m -67.71 157.38 34.76 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.579 -0.701 . . . . 0.0 109.713 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -114.83 -75.42 0.59 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.373 -0.83 . . . . 0.0 110.331 -179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -140.3 -59.48 0.53 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.261 -0.899 . . . . 0.0 110.053 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.91 -33.22 12.27 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.511 -0.743 . . . . 0.0 109.983 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -165.14 -67.26 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.605 -0.685 . . . . 0.0 109.914 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 65.98 35.9 91.31 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.2 m -131.78 172.37 12.37 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.523 -0.986 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.2 m -79.41 176.59 9.55 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.467 -0.77 . . . . 0.0 110.24 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.0 m -67.23 117.13 8.82 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.415 -0.803 . . . . 0.0 110.217 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 102.42 -14.63 56.61 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.279 -1.129 . . . . 0.0 110.279 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -91.6 129.8 37.51 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.078 -1.248 . . . . 0.0 110.484 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.4 t -97.37 168.47 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.609 -0.682 . . . . 0.0 110.178 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.25 118.54 37.04 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.254 -0.904 . . . . 0.0 110.46 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.508 ' HB2' ' CZ3' ' A' ' 25' ' ' TRP . 4.4 m -91.05 151.39 21.05 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.551 -0.718 . . . . 0.0 110.343 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.28 -19.19 24.38 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.313 -0.867 . . . . 0.0 111.527 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 66.4 m -57.11 -73.16 0.07 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.163 -0.96 . . . . 0.0 110.209 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.553 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 40.4 m95 -96.44 0.21 50.09 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 179.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.82 68.77 0.79 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.383 -0.823 . . . . 0.0 110.569 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.553 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -155.25 178.23 10.45 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.296 -0.878 . . . . 0.0 110.786 179.666 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.9 m -85.39 138.07 32.51 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.438 -0.789 . . . . 0.0 111.392 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.467 ' CG1' ' CZ2' ' A' ' 25' ' ' TRP . 2.7 m -127.02 140.3 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.74 -0.6 . . . . 0.0 110.015 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.2 tp -67.67 124.59 23.7 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.314 -0.866 . . . . 0.0 109.856 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.87 101.85 0.13 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.637 -0.665 . . . . 0.0 110.3 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.458 ' HA3' ' C ' ' A' ' 31' ' ' PRO . . . -127.73 161.28 21.74 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.458 ' C ' ' HA3' ' A' ' 30' ' ' GLY . 47.8 Cg_endo -73.36 157.47 99.13 Favored 'Cis proline' 0 N--CA 1.49 1.314 0 C-N-CA 121.774 -2.177 . . . . 0.0 110.794 -0.13 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.498 1.947 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.477 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.46 ' HB2' ' CG ' ' A' ' 17' ' ' TYR . 85.7 m -95.09 3.71 54.49 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.516 -0.991 . . . . 0.0 110.933 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.6 tp -64.57 114.02 4.1 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.133 -0.979 . . . . 0.0 109.97 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.95 -28.62 5.35 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -57.81 140.73 51.04 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.387 -1.067 . . . . 0.0 109.968 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.9 mmmt -85.75 141.05 29.98 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.432 -0.793 . . . . 0.0 110.838 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.2 t -133.96 142.96 47.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.733 -0.605 . . . . 0.0 109.467 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.65 -51.8 9.35 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.424 -0.798 . . . . 0.0 110.341 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -157.27 -57.05 0.08 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.502 -0.749 . . . . 0.0 110.229 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -146.81 43.35 1.16 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.448 -0.783 . . . . 0.0 110.074 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -54.51 -53.54 52.95 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.467 -0.771 . . . . 0.0 110.272 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.66 84.11 0.54 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.4 t -79.6 173.38 12.64 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.513 -0.992 . . . . 0.0 109.682 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.7 p -59.24 162.15 4.81 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.276 -0.89 . . . . 0.0 110.634 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -55.12 129.87 39.78 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.56 -0.712 . . . . 0.0 110.774 -179.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.98 7.17 56.61 Favored Glycine 0 N--CA 1.494 2.564 0 N-CA-C 110.699 -0.96 . . . . 0.0 110.699 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.46 ' CG ' ' HB2' ' A' ' 2' ' ' CYS . 26.9 m-85 -136.31 138.16 41.41 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.05 -1.265 . . . . 0.0 110.808 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.5 t -125.18 166.77 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.641 -0.662 . . . . 0.0 109.913 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 72.7 m -90.44 114.42 26.57 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.306 -0.871 . . . . 0.0 110.126 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.474 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 10.8 t -75.17 159.12 31.98 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.452 -0.78 . . . . 0.0 110.616 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.1 ttp85 -90.89 -22.71 20.78 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.471 -0.768 . . . . 0.0 110.954 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.7 m -69.48 -82.65 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.201 -0.937 . . . . 0.0 110.928 -179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.679 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 14.3 m95 -85.08 -0.13 53.49 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.07 -1.019 . . . . 0.0 110.812 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER 56.67 63.95 1.81 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.323 -0.86 . . . . 0.0 110.811 179.772 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.679 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.5 p90 -145.95 176.88 9.36 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.273 -0.892 . . . . 0.0 110.395 179.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.7 m -78.59 122.79 26.36 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.261 -0.899 . . . . 0.0 111.117 -178.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.558 HG11 ' CZ2' ' A' ' 25' ' ' TRP . 24.2 m -115.13 151.34 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.686 -0.634 . . . . 0.0 110.06 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.7 mt -68.11 118.47 11.31 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.336 -0.852 . . . . 0.0 110.04 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.32 132.27 47.38 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.498 -0.751 . . . . 0.0 110.375 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 139.59 -150.84 21.63 Favored Glycine 0 N--CA 1.493 2.498 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -74.53 149.89 94.64 Favored 'Cis proline' 0 N--CA 1.49 1.274 0 C-N-CA 121.912 -2.12 . . . . 0.0 110.73 -0.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 29.9 t-105 . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.339 179.871 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 109.454 -1.459 . . . . 0.0 109.454 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 67.1 m -98.73 -5.86 30.6 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.501 -0.999 . . . . 0.0 110.878 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.42 119.09 10.38 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.106 -0.997 . . . . 0.0 109.846 179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.39 -23.11 4.9 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.77 132.37 50.72 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.309 -1.112 . . . . 0.0 109.879 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -81.01 149.72 29.18 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.42 -0.8 . . . . 0.0 110.3 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.0 p -149.94 165.19 33.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.476 -0.765 . . . . 0.0 110.601 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -135.45 -57.85 0.79 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.584 -0.698 . . . . 0.0 110.34 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -139.27 -59.21 0.58 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.35 -0.844 . . . . 0.0 110.336 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -120.87 41.63 3.24 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.474 -0.766 . . . . 0.0 110.233 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -62.8 -53.85 47.92 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.355 -0.841 . . . . 0.0 110.008 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 107.9 75.85 0.93 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 98.8 m -79.25 169.93 17.38 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.439 -1.036 . . . . 0.0 109.389 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.0 m -67.68 161.95 24.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.251 -0.906 . . . . 0.0 110.017 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.5 p -58.8 120.41 8.93 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.404 -0.81 . . . . 0.0 109.907 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.99 -17.53 44.68 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.442 ' HA ' ' O ' ' A' ' 27' ' ' VAL . 27.8 m-85 -95.05 147.41 23.44 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.24 -1.153 . . . . 0.0 110.283 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 t -128.59 162.44 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.507 -0.746 . . . . 0.0 110.081 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -88.63 110.7 21.15 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.353 -0.842 . . . . 0.0 110.217 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.438 ' HB3' ' CZ3' ' A' ' 25' ' ' TRP . 0.5 OUTLIER -84.08 153.13 23.95 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.494 -0.754 . . . . 0.0 110.396 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -90.57 -4.05 57.14 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.417 -0.802 . . . . 0.0 111.164 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.482 HG22 ' CE2' ' A' ' 23' ' ' TRP . 9.5 m -77.77 -66.74 0.8 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.97 -1.081 . . . . 0.0 110.224 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.592 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 11.8 m95 -104.36 6.8 35.43 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.467 -0.77 . . . . 0.0 110.152 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.2 mttt 52.32 65.22 1.57 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.482 -0.761 . . . . 0.0 110.725 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.592 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -151.35 172.03 16.56 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.319 -0.863 . . . . 0.0 110.842 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.435 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 72.5 m -79.67 118.61 21.65 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.496 -0.753 . . . . 0.0 109.863 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.568 ' HB ' ' CZ2' ' A' ' 25' ' ' TRP . 1.6 p -121.69 160.72 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.497 -0.752 . . . . 0.0 110.529 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -67.53 127.08 31.4 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.167 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.82 117.79 9.42 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.539 -0.726 . . . . 0.0 110.249 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.465 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.856 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.464 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 93.2 m -110.35 13.58 22.86 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.473 -1.016 . . . . 0.0 110.893 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 tt -65.95 115.06 5.63 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.068 -1.02 . . . . 0.0 110.382 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.88 -29.77 3.48 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.403 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 35.9 t70 -64.88 156.8 29.76 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.403 -1.057 . . . . 0.0 110.538 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.4 ' HG3' ' HB2' ' A' ' 9' ' ' TYR . 0.0 OUTLIER -89.25 149.95 22.85 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.412 -0.805 . . . . 0.0 110.51 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.456 ' SG ' ' SG ' ' A' ' 13' ' ' CYS . 0.1 OUTLIER -105.28 23.46 13.67 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.412 -0.805 . . . . 0.0 110.669 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -116.99 -44.84 2.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.233 -0.917 . . . . 0.0 110.487 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.4 ' HB2' ' HG3' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -66.76 -57.86 6.23 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.439 -0.788 . . . . 0.0 110.499 -179.588 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -108.82 -26.35 10.33 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.481 -0.762 . . . . 0.0 110.782 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.4 t30 53.26 50.14 18.29 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.497 -0.752 . . . . 0.0 110.298 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -141.02 85.08 0.21 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 81.8 m -83.83 -169.85 2.78 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.654 -0.909 . . . . 0.0 110.7 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 0.8 OUTLIER -77.82 175.45 9.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.457 -0.777 . . . . 0.0 110.183 179.981 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 55.6 p -69.01 114.89 7.7 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.334 -0.854 . . . . 0.0 110.111 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.6 4.39 55.97 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 110.229 -1.149 . . . . 0.0 110.229 -179.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.524 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 3.3 m-85 -100.27 144.12 29.66 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.048 -1.266 . . . . 0.0 109.904 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.6 m -123.44 161.47 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.467 -0.77 . . . . 0.0 110.71 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 m -82.6 114.05 20.72 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.592 -0.693 . . . . 0.0 109.891 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.489 ' OG ' HG21 ' A' ' 27' ' ' VAL . 0.3 OUTLIER -70.89 153.13 42.97 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.401 -0.812 . . . . 0.0 110.604 -179.776 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.45 10.76 23.94 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.581 -0.699 . . . . 0.0 110.88 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.5 m -103.15 -78.71 0.54 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.126 -0.984 . . . . 0.0 110.044 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.63 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 23.9 m95 -89.74 6.62 40.77 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.252 -0.905 . . . . 0.0 110.607 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.9 mptt 53.31 54.85 9.57 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.42 -0.8 . . . . 0.0 110.296 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.7 ' CE2' HG22 ' A' ' 27' ' ' VAL . 0.9 OUTLIER -136.32 173.53 11.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.292 -0.88 . . . . 0.0 110.723 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.403 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 85.8 m -73.68 131.19 41.37 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.476 -0.765 . . . . 0.0 111.1 -178.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.7 HG22 ' CE2' ' A' ' 25' ' ' TRP . 2.9 t -135.63 161.67 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.66 -0.65 . . . . 0.0 109.856 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.3 mt -74.52 134.25 42.24 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.441 -0.787 . . . . 0.0 110.23 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.93 128.05 32.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.515 -0.74 . . . . 0.0 110.21 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.603 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.788 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.429 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 13.0 m 59.66 38.04 22.12 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.64 -0.918 . . . . 0.0 110.686 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 tt -96.14 107.58 19.92 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.407 -0.808 . . . . 0.0 109.553 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 143.24 -25.16 2.2 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.04 128.23 35.14 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.364 -1.08 . . . . 0.0 110.151 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 25' ' ' TRP . 13.2 pttp -84.62 149.87 25.56 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.552 -0.717 . . . . 0.0 110.55 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 11' ' ' ASN . 28.5 p -143.05 139.74 30.66 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.575 -0.703 . . . . 0.0 110.226 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -103.55 -33.58 8.97 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.565 -0.71 . . . . 0.0 110.879 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -154.88 -59.11 0.11 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.242 -0.911 . . . . 0.0 110.265 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -132.5 46.39 2.64 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.558 -0.714 . . . . 0.0 110.308 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.405 ' HB2' ' HA ' ' A' ' 7' ' ' CYS . 22.7 t-20 -58.18 -49.75 75.94 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.479 -0.763 . . . . 0.0 110.281 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 107.79 80.94 1.31 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 87.8 m -79.91 171.67 14.8 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.403 -1.057 . . . . 0.0 109.55 179.099 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.0 OUTLIER -67.27 160.1 27.81 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.111 -0.993 . . . . 0.0 110.255 179.777 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 p -59.13 121.07 10.41 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.441 -0.787 . . . . 0.0 110.452 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 103.15 -8.92 53.99 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.401 ' CE1' ' HG ' ' A' ' 28' ' ' LEU . 2.2 m-85 -103.98 148.34 26.31 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.075 -1.25 . . . . 0.0 110.706 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.7 171.11 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.599 -0.688 . . . . 0.0 110.277 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.3 m -94.43 122.56 37.12 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.257 -0.902 . . . . 0.0 110.487 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.534 ' OG ' HG21 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -88.92 165.64 14.47 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.391 -0.818 . . . . 0.0 110.935 179.956 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -91.31 -30.78 16.38 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.514 -0.741 . . . . 0.0 111.266 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.1 m -55.32 -73.67 0.05 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.476 -0.765 . . . . 0.0 111.142 -178.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.575 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 34.6 m95 -100.2 5.82 44.74 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.145 -0.972 . . . . 0.0 110.95 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 20' ' ' SER . 0.1 OUTLIER 52.6 59.82 4.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.302 -0.873 . . . . 0.0 110.146 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.727 ' CE2' HG22 ' A' ' 27' ' ' VAL . 1.1 p90 -141.18 175.21 9.83 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.377 -0.827 . . . . 0.0 110.72 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.1 m -76.07 127.15 32.36 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.544 -0.723 . . . . 0.0 110.583 -179.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.727 HG22 ' CE2' ' A' ' 25' ' ' TRP . 2.3 t -127.96 159.93 38.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.571 -0.706 . . . . 0.0 109.809 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.401 ' HG ' ' CE1' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -66.2 142.44 57.71 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.36 -0.837 . . . . 0.0 110.322 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.92 -27.46 68.87 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.57 -0.706 . . . . 0.0 110.924 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.557 0 N-CA-C 109.927 -1.269 . . . . 0.0 109.927 179.905 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.418 0 N-CA-C 109.958 -1.257 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 84.0 m -103.06 4.7 37.49 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.522 -0.987 . . . . 0.0 110.851 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.04 114.06 6.25 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.963 -1.085 . . . . 0.0 109.621 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 122.64 -18.35 8.15 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.49 116.39 3.07 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.364 -1.08 . . . . 0.0 110.04 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.53 138.7 57.69 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.411 -0.806 . . . . 0.0 110.641 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 p -128.62 116.81 20.18 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.724 -0.61 . . . . 0.0 110.24 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.36 -59.79 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.434 -0.791 . . . . 0.0 110.459 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -79.47 -44.13 21.89 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.427 -0.796 . . . . 0.0 110.182 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -96.09 -35.58 11.3 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.445 -0.784 . . . . 0.0 110.149 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 54.86 68.19 0.9 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.656 -0.653 . . . . 0.0 110.684 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.15 84.8 0.2 Allowed Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.2 m -80.52 169.88 17.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.544 -0.974 . . . . 0.0 110.502 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.5 m -78.45 177.26 8.65 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.403 -0.811 . . . . 0.0 110.099 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 37.8 m -64.34 129.43 39.9 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.325 -0.859 . . . . 0.0 109.957 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.32 17.79 75.46 Favored Glycine 0 N--CA 1.493 2.491 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.417 ' HB3' ' HB3' ' A' ' 26' ' ' CYS . 11.9 m-85 -125.48 132.21 52.7 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.292 -1.122 . . . . 0.0 109.666 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.9 m -117.64 146.85 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.327 -0.858 . . . . 0.0 110.648 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.5 t -67.11 119.13 11.53 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.603 -0.685 . . . . 0.0 110.05 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.447 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -75.11 132.69 41.41 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.438 -0.788 . . . . 0.0 110.732 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -81.31 -15.07 56.52 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.489 -0.757 . . . . 0.0 109.535 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.458 HG22 ' CE3' ' A' ' 23' ' ' TRP . 98.4 m -101.32 -44.58 5.6 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.475 -0.766 . . . . 0.0 110.401 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.776 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.4 m95 -91.81 -16.97 26.02 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.448 -0.782 . . . . 0.0 111.218 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.0 12.77 8.94 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.56 -0.713 . . . . 0.0 112.252 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.776 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -124.13 160.16 28.41 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.889 -1.132 . . . . 0.0 109.671 178.743 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 78.8 m -71.39 109.1 5.17 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.38 -0.825 . . . . 0.0 110.957 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.522 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.8 OUTLIER -106.38 165.33 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.471 -0.768 . . . . 0.0 109.815 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.85 148.07 50.28 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.344 -0.848 . . . . 0.0 110.409 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.71 14.72 8.0 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.432 -0.793 . . . . 0.0 111.168 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 179.61 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.8 p -92.22 4.36 53.41 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.604 -0.939 . . . . 0.0 111.155 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.1 tp -74.72 123.7 25.42 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.097 -1.002 . . . . 0.0 109.942 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 108.56 -14.14 35.61 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.62 139.76 47.58 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.18 -1.188 . . . . 0.0 109.496 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.74 139.88 52.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.507 -0.746 . . . . 0.0 110.7 -179.456 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.5 t -132.1 144.54 50.79 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.526 -0.734 . . . . 0.0 110.369 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -123.28 -66.78 0.99 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.629 -0.669 . . . . 0.0 109.818 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -157.66 -58.93 0.08 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.496 -0.752 . . . . 0.0 110.254 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -105.81 45.53 0.97 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.564 -0.71 . . . . 0.0 110.396 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -76.97 -45.74 26.5 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.35 -0.844 . . . . 0.0 110.281 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.19 74.63 1.28 Allowed Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.9 m -89.57 -168.46 2.16 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.495 -1.003 . . . . 0.0 110.233 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.507 ' HB2' ' CD1' ' A' ' 17' ' ' TYR . 85.8 m -63.94 162.8 13.18 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.309 -0.869 . . . . 0.0 110.336 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.9 m -67.19 115.38 6.8 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.364 -0.835 . . . . 0.0 109.962 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 103.33 14.15 26.73 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.507 ' CD1' ' HB2' ' A' ' 14' ' ' CYS . 3.3 m-85 -106.56 121.41 44.25 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.157 -1.202 . . . . 0.0 109.993 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -91.0 163.55 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.504 -0.748 . . . . 0.0 110.142 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t -95.97 114.31 26.01 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.575 -0.703 . . . . 0.0 109.801 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.462 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -90.36 111.0 22.06 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.331 -0.855 . . . . 0.0 110.401 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -26.12 53.32 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.404 -0.81 . . . . 0.0 109.646 179.081 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.437 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 53.0 m -67.46 -44.51 78.44 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.61 -0.681 . . . . 0.0 110.076 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.697 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.5 m95 -98.01 -12.26 22.12 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.443 -0.785 . . . . 0.0 110.665 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 64.95 34.39 9.04 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.576 -0.703 . . . . 0.0 111.547 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.697 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -147.06 154.88 41.71 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.076 -1.015 . . . . 0.0 109.915 178.793 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.31 115.54 15.06 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.362 -0.836 . . . . 0.0 110.886 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.603 HG22 ' NE1' ' A' ' 25' ' ' TRP . 1.0 OUTLIER -106.83 170.21 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.719 -0.613 . . . . 0.0 109.99 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.85 148.34 31.39 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.348 -0.845 . . . . 0.0 110.039 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.15 90.71 6.59 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.413 -0.804 . . . . 0.0 110.421 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.526 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 179.865 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.415 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.1 p -101.59 60.98 0.9 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.474 -1.016 . . . . 0.0 110.542 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.9 tt -78.12 107.16 10.5 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.356 -0.84 . . . . 0.0 109.902 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.01 -16.84 3.66 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.7 122.69 17.84 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.246 -1.15 . . . . 0.0 109.996 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.59 142.39 22.89 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.651 -0.656 . . . . 0.0 111.263 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.7 t -137.03 144.01 43.01 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.595 -0.69 . . . . 0.0 110.079 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -125.59 -67.85 0.86 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.451 -0.781 . . . . 0.0 110.461 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -150.68 -58.43 0.17 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.261 -0.9 . . . . 0.0 110.332 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -104.79 42.44 1.21 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.491 -0.756 . . . . 0.0 110.106 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -89.07 -49.78 6.56 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.321 -0.862 . . . . 0.0 110.141 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.01 106.34 0.65 Allowed Glycine 0 N--CA 1.493 2.451 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.483 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 74.9 m -83.32 -168.35 2.06 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.56 -0.965 . . . . 0.0 110.262 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.0 m -80.51 179.67 7.62 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.262 -0.899 . . . . 0.0 110.729 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.0 p -68.49 122.25 18.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.474 -0.766 . . . . 0.0 109.859 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.09 14.38 69.41 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.483 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 5.1 m-85 -113.77 156.29 24.1 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.307 -1.114 . . . . 0.0 110.191 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.418 ' CG2' ' N ' ' A' ' 19' ' ' CYS . 1.5 p -128.6 163.43 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.418 -0.801 . . . . 0.0 110.623 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.418 ' N ' ' CG2' ' A' ' 18' ' ' VAL . 14.9 t -89.74 109.97 20.91 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.881 -0.512 . . . . 0.0 110.139 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.509 ' HB2' HG23 ' A' ' 27' ' ' VAL . 1.1 m -90.42 120.39 31.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.427 -0.796 . . . . 0.0 110.744 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -30.88 56.13 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.581 -0.699 . . . . 0.0 110.195 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.464 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 19.6 m -61.24 -48.19 82.63 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.497 -0.752 . . . . 0.0 110.235 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.701 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.5 m95 -100.37 -2.52 33.23 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.445 -0.784 . . . . 0.0 110.847 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 mtmm 54.87 35.19 23.77 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.406 -0.809 . . . . 0.0 111.981 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.701 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -144.55 157.36 44.26 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.057 -1.027 . . . . 0.0 109.882 178.731 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.41 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 56.8 m -71.89 104.8 3.6 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.337 -0.852 . . . . 0.0 110.888 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.571 HG22 ' NE1' ' A' ' 25' ' ' TRP . 12.2 t -95.13 163.41 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.55 -0.719 . . . . 0.0 109.461 179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.6 tt -78.17 129.96 35.76 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.339 -0.851 . . . . 0.0 110.189 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.92 107.22 10.29 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.596 -0.69 . . . . 0.0 110.125 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.51 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.88 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.367 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 72.2 m -119.98 35.05 4.98 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.506 -0.996 . . . . 0.0 110.58 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 tt -86.51 130.33 34.53 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.21 -0.932 . . . . 0.0 109.969 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.16 -22.34 36.88 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.892 -1.283 . . . . 0.0 109.892 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -64.26 125.28 24.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.333 -1.098 . . . . 0.0 110.184 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -59.13 151.93 21.48 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.631 -0.668 . . . . 0.0 110.667 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.0 m -69.87 145.99 51.6 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.482 -0.761 . . . . 0.0 110.222 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -82.11 -55.03 4.81 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.437 -0.79 . . . . 0.0 109.889 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -162.24 -58.4 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.69 -0.631 . . . . 0.0 109.481 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -97.21 -33.36 11.51 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.667 -0.645 . . . . 0.0 109.523 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.58 ' HA ' ' HB2' ' A' ' 19' ' ' CYS . 0.9 OUTLIER -163.58 -62.13 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.63 -0.669 . . . . 0.0 109.849 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 58.49 40.42 94.38 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 109.954 -1.258 . . . . 0.0 109.954 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.4 m -125.98 156.65 39.49 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.519 -0.989 . . . . 0.0 110.489 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.9 m -83.03 175.9 9.66 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.521 -0.737 . . . . 0.0 110.134 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.6 m -60.36 124.49 20.47 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.429 -0.794 . . . . 0.0 110.172 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.58 15.42 37.51 Favored Glycine 0 N--CA 1.494 2.556 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -132.23 143.07 49.67 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.298 -1.119 . . . . 0.0 110.21 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.503 HG13 ' HB2' ' A' ' 29' ' ' ALA . 19.7 m -120.27 147.44 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.483 -0.76 . . . . 0.0 110.26 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HB2' ' HA ' ' A' ' 11' ' ' ASN . 42.5 t -78.98 103.07 8.67 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.468 -0.77 . . . . 0.0 109.987 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.457 ' HB2' HG21 ' A' ' 27' ' ' VAL . 26.1 t -72.11 128.57 36.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.476 -0.765 . . . . 0.0 110.217 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.461 ' HA ' ' HE2' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -80.35 -16.06 55.42 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.419 -0.801 . . . . 0.0 110.132 179.292 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 m -84.67 -46.95 10.97 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.339 -0.85 . . . . 0.0 110.263 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.694 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.9 m95 -99.98 -15.73 18.19 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.384 -0.823 . . . . 0.0 110.926 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 11.5 mmtt 62.92 35.67 13.26 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.72 -0.613 . . . . 0.0 111.844 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.694 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -136.36 158.48 44.32 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.098 -1.001 . . . . 0.0 109.378 178.121 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.4 m -70.56 104.36 2.77 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.334 -0.854 . . . . 0.0 110.744 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.573 HG22 ' NE1' ' A' ' 25' ' ' TRP . 2.0 t -99.09 156.55 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 109.567 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -65.74 128.55 36.41 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.465 -0.772 . . . . 0.0 110.197 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.503 ' HB2' HG13 ' A' ' 18' ' ' VAL . . . -68.79 101.39 1.33 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.587 -0.696 . . . . 0.0 110.338 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.488 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.944 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.368 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 14' ' ' CYS . 14.1 m -90.48 -9.16 48.4 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.503 -0.998 . . . . 0.0 111.167 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 27' ' ' VAL . 4.2 tp -58.81 120.75 9.57 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.19 -0.944 . . . . 0.0 110.01 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.1 -23.23 6.95 Favored Glycine 0 N--CA 1.493 2.498 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.459 ' O ' ' HA ' ' A' ' 25' ' ' TRP . 23.7 t70 -65.3 156.14 33.0 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.264 -1.139 . . . . 0.0 110.069 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -90.3 147.94 23.19 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.404 -0.81 . . . . 0.0 111.102 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.8 p -140.98 155.2 46.27 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.498 -0.751 . . . . 0.0 109.811 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -122.64 -69.37 0.83 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.336 -0.853 . . . . 0.0 110.443 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -160.62 -55.86 0.05 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.407 -0.808 . . . . 0.0 109.903 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -106.62 15.13 26.13 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.656 -0.653 . . . . 0.0 110.414 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -72.34 -48.87 38.55 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.221 -0.925 . . . . 0.0 109.958 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.43 109.69 2.74 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.8 m -79.79 -166.53 1.02 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.549 -0.971 . . . . 0.0 110.033 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 2' ' ' CYS . 0.5 OUTLIER -71.92 170.81 12.96 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.273 -0.892 . . . . 0.0 110.754 -179.883 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.8 m -66.16 115.3 6.02 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.551 -0.718 . . . . 0.0 109.806 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.36 -17.22 59.4 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.836 -1.306 . . . . 0.0 109.836 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -89.58 140.24 29.74 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.281 -1.129 . . . . 0.0 110.159 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 4.2 t -103.53 160.73 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.524 -0.735 . . . . 0.0 109.741 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.9 t -92.56 115.95 28.56 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.482 -0.761 . . . . 0.0 109.903 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.522 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -77.29 115.9 17.45 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.525 -0.734 . . . . 0.0 110.118 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -78.29 -13.82 59.69 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.512 -0.742 . . . . 0.0 109.855 179.214 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.486 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 49.8 m -91.09 -44.78 9.07 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.458 -0.776 . . . . 0.0 110.187 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.696 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.2 m95 -96.18 -13.62 23.38 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.411 -0.805 . . . . 0.0 110.897 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 3.2 mmmm 66.03 31.34 9.09 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.62 -0.675 . . . . 0.0 111.905 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.696 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -139.02 156.06 47.5 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.062 -1.024 . . . . 0.0 109.673 178.429 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.4 m -73.16 109.97 7.09 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.183 -0.948 . . . . 0.0 110.869 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.689 HG22 ' NE1' ' A' ' 25' ' ' TRP . 1.6 t -104.6 156.38 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.513 -0.742 . . . . 0.0 109.808 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.8 tp -79.09 147.13 32.88 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.407 -0.808 . . . . 0.0 109.949 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.34 88.55 2.58 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.465 -0.772 . . . . 0.0 110.191 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.627 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.856 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.443 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.5 p -109.73 58.52 0.61 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.489 -1.006 . . . . 0.0 110.557 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.425 HD23 ' N ' ' A' ' 4' ' ' GLY . 3.4 tt -81.79 132.3 35.28 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.316 -0.865 . . . . 0.0 109.988 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.425 ' N ' HD23 ' A' ' 3' ' ' LEU . . . 116.26 -30.19 6.63 Favored Glycine 0 N--CA 1.496 2.679 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.67 140.55 57.43 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.369 -1.077 . . . . 0.0 110.144 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -82.08 136.84 35.14 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.337 -0.852 . . . . 0.0 110.519 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.7 p -115.45 106.84 14.43 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.61 -0.681 . . . . 0.0 110.13 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -149.55 -48.84 0.14 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.672 -0.643 . . . . 0.0 110.514 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -70.06 -50.11 44.41 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.489 -0.757 . . . . 0.0 109.978 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -101.7 -30.33 11.39 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.599 -0.688 . . . . 0.0 110.605 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 t30 54.76 50.66 15.28 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.574 -0.704 . . . . 0.0 110.282 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -152.4 90.43 0.13 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.114 -1.594 . . . . 0.0 109.114 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 63.3 m -79.86 -160.6 0.28 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.669 -0.9 . . . . 0.0 110.448 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.6 m -75.74 173.41 11.15 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.429 -0.794 . . . . 0.0 110.358 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 p -64.02 123.94 20.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.36 -0.838 . . . . 0.0 109.918 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.61 -21.86 43.85 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -92.89 120.24 33.02 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.199 -1.177 . . . . 0.0 110.138 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 t -100.59 163.77 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.61 -0.681 . . . . 0.0 109.872 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t -91.21 108.76 20.09 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.551 -0.718 . . . . 0.0 110.144 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.446 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -66.32 146.2 54.86 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.52 -0.738 . . . . 0.0 110.174 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.44 -29.54 17.91 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.481 -0.762 . . . . 0.0 110.918 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.464 HG22 ' CE3' ' A' ' 23' ' ' TRP . 41.3 m -78.15 -49.43 13.87 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.287 -0.883 . . . . 0.0 110.927 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CB ' ' CE3' ' A' ' 25' ' ' TRP . 6.9 m95 -96.08 -18.1 20.42 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.337 -0.852 . . . . 0.0 110.83 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 15.0 mttt 63.76 31.36 14.27 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.645 -0.66 . . . . 0.0 111.837 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.671 ' NE1' HG22 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -121.65 162.13 21.25 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 120.987 -1.071 . . . . 0.0 109.666 178.339 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.414 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 84.7 m -71.62 104.74 3.42 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.364 -0.835 . . . . 0.0 110.892 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.671 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.9 OUTLIER -106.53 161.08 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.541 -0.724 . . . . 0.0 109.69 179.808 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.33 149.05 50.96 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.367 -0.833 . . . . 0.0 110.285 179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.58 66.72 9.67 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.442 -0.786 . . . . 0.0 110.539 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.482 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 179.676 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.404 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.7 p -101.26 57.1 0.85 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.387 -1.066 . . . . 0.0 110.369 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.59 113.64 10.94 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.406 -0.809 . . . . 0.0 110.297 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.51 -21.64 4.25 Favored Glycine 0 N--CA 1.495 2.621 0 N-CA-C 110.319 -1.113 . . . . 0.0 110.319 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.82 123.75 17.51 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.277 -1.131 . . . . 0.0 110.277 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -69.27 135.07 49.95 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.479 -0.763 . . . . 0.0 110.794 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -121.13 146.06 47.16 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.645 -0.659 . . . . 0.0 109.826 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -133.86 -45.57 0.8 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.446 -0.784 . . . . 0.0 110.847 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -169.91 -55.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.327 -0.858 . . . . 0.0 109.826 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -104.63 22.11 15.62 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.675 -0.641 . . . . 0.0 110.584 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.0 t30 -74.49 -59.71 2.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.189 -0.944 . . . . 0.0 110.045 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.25 105.98 0.67 Allowed Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 69.1 m -81.05 179.02 8.05 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.525 -0.985 . . . . 0.0 110.324 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 76.7 m -75.0 174.07 9.84 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.434 -0.791 . . . . 0.0 110.409 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.7 m -66.34 119.32 11.37 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.443 -0.786 . . . . 0.0 109.831 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.97 -22.67 39.19 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -89.59 147.98 23.62 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.284 -1.127 . . . . 0.0 109.942 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.42 ' CG1' ' HB2' ' A' ' 29' ' ' ALA . 27.6 m -130.15 151.46 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.607 -0.683 . . . . 0.0 110.425 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 13' ' ' CYS . 73.8 m -73.45 103.28 4.04 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.464 -0.772 . . . . 0.0 109.985 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.2 t -73.86 137.63 43.88 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.412 -0.805 . . . . 0.0 110.24 -179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.67 -26.68 27.61 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.52 -0.738 . . . . 0.0 110.341 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.9 m -73.39 -45.61 53.75 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.416 -0.802 . . . . 0.0 110.28 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.789 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 5.8 m95 -100.12 -13.43 18.98 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.385 -0.822 . . . . 0.0 111.222 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.6 OUTLIER 62.76 31.66 16.43 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.529 -0.732 . . . . 0.0 111.938 179.78 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.789 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -141.97 160.82 39.44 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.022 -1.049 . . . . 0.0 109.853 178.344 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.401 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 71.0 m -66.49 107.39 2.05 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.349 -0.844 . . . . 0.0 111.473 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.662 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.9 OUTLIER -117.38 172.5 5.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.51 -0.744 . . . . 0.0 109.467 179.268 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.43 ' HA ' HD22 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -73.1 131.27 41.87 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.165 -0.959 . . . . 0.0 110.154 179.669 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.42 ' HB2' ' CG1' ' A' ' 18' ' ' VAL . . . -66.91 124.4 22.88 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.48 -0.762 . . . . 0.0 110.49 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.521 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.891 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.409 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 89.7 m -103.58 9.66 37.33 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.473 -1.016 . . . . 0.0 111.077 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.8 97.73 0.85 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.093 -1.004 . . . . 0.0 109.918 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.22 -22.47 3.57 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.56 128.18 34.79 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.256 -1.144 . . . . 0.0 110.084 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.81 159.27 32.16 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.479 -0.763 . . . . 0.0 110.238 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.43 156.05 38.68 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.538 -0.726 . . . . 0.0 110.101 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -130.98 -65.91 0.77 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.475 -0.766 . . . . 0.0 110.393 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -164.46 -51.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.401 -0.812 . . . . 0.0 110.767 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -94.3 9.84 36.53 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.402 -0.812 . . . . 0.0 111.19 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 58.09 70.32 0.66 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.359 -0.838 . . . . 0.0 110.29 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -87.93 59.36 4.25 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 87.2 m -89.61 178.6 6.24 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.496 -1.003 . . . . 0.0 109.897 179.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.1 m -75.52 179.81 5.07 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.177 -0.952 . . . . 0.0 110.62 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.5 m -68.56 112.58 5.44 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.549 -0.72 . . . . 0.0 109.996 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.77 -7.07 67.71 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.106 -1.197 . . . . 0.0 110.106 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.486 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 3.6 m-85 -91.21 137.49 32.32 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.192 -1.181 . . . . 0.0 110.1 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.2 t -123.82 164.04 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.43 -0.794 . . . . 0.0 110.412 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' TRP . 11.7 t -85.23 119.45 25.62 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.454 -0.779 . . . . 0.0 110.299 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.47 ' CB ' ' CZ3' ' A' ' 25' ' ' TRP . 0.6 OUTLIER -83.39 166.81 18.1 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.493 -0.754 . . . . 0.0 110.599 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.64 -24.4 20.51 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.533 -0.73 . . . . 0.0 111.194 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.5 m -62.48 -81.6 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.274 -0.891 . . . . 0.0 110.851 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.591 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 37.9 m95 -89.52 4.08 50.39 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.201 -0.937 . . . . 0.0 110.738 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 20' ' ' SER . 18.0 mtpt 52.53 62.69 2.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.333 -0.855 . . . . 0.0 110.114 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.591 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.4 p90 -144.32 175.4 10.12 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.466 -0.771 . . . . 0.0 110.66 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.8 m -81.53 122.51 27.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.465 -0.772 . . . . 0.0 110.281 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.456 HG22 ' N ' ' A' ' 28' ' ' LEU . 2.0 p -134.39 166.83 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.573 -0.704 . . . . 0.0 110.079 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.456 ' N ' HG22 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -73.24 139.02 45.91 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.883 -0.511 . . . . 0.0 110.51 -179.853 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.36 166.98 19.97 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.482 -0.761 . . . . 0.0 110.499 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.614 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 -179.945 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.593 0 N-CA-C 110.036 -1.225 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 65.2 m -124.83 51.23 1.66 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.399 -1.059 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.64 103.96 16.41 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.272 -0.892 . . . . 0.0 109.829 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.41 -18.33 3.93 Favored Glycine 0 N--CA 1.495 2.584 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.28 121.57 8.52 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.475 -1.014 . . . . 0.0 110.274 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.86 141.54 47.95 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.312 -0.867 . . . . 0.0 110.715 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.62 141.75 58.35 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.608 -0.682 . . . . 0.0 110.129 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -106.84 -66.47 1.01 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.373 -0.829 . . . . 0.0 110.694 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -141.1 -60.45 0.49 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.231 -0.918 . . . . 0.0 110.309 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -98.01 -35.13 10.54 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.523 -0.736 . . . . 0.0 109.947 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -167.35 -65.16 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.644 -0.66 . . . . 0.0 109.916 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 67.88 36.02 85.88 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 109.852 -1.299 . . . . 0.0 109.852 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 48.4 m -120.55 -179.56 4.02 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.527 -0.984 . . . . 0.0 110.162 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 62.1 m -99.5 177.21 5.24 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.427 -0.796 . . . . 0.0 110.047 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.3 m -62.79 124.62 21.5 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.393 -0.817 . . . . 0.0 110.288 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.07 14.32 60.79 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -128.17 125.15 38.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.138 -1.213 . . . . 0.0 110.409 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.759 HG23 ' HB2' ' A' ' 29' ' ' ALA . 3.1 t -103.04 159.68 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.521 -0.737 . . . . 0.0 109.549 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.69 116.51 24.01 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.371 -0.83 . . . . 0.0 109.969 179.749 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.438 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -75.51 127.46 33.14 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.55 -0.719 . . . . 0.0 110.475 -179.804 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -80.94 -12.7 59.35 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.476 -0.765 . . . . 0.0 110.192 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.8 m -89.99 -45.98 8.82 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.377 -0.827 . . . . 0.0 109.988 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.716 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.2 m95 -97.58 -11.53 23.55 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.528 -0.732 . . . . 0.0 110.926 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.88 22.86 11.37 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.446 -0.784 . . . . 0.0 112.032 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.716 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -131.97 155.13 48.51 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.866 -1.146 . . . . 0.0 109.912 178.6 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 18' ' ' VAL . 68.4 m -72.81 109.36 6.35 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.468 -0.77 . . . . 0.0 110.841 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.686 HG22 ' NE1' ' A' ' 25' ' ' TRP . 2.8 t -99.23 167.58 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.523 -0.736 . . . . 0.0 109.692 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.97 132.44 47.3 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.286 -0.884 . . . . 0.0 110.622 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.759 ' HB2' HG23 ' A' ' 18' ' ' VAL . . . -88.57 170.43 10.86 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.655 -0.653 . . . . 0.0 110.717 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.663 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.729 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.472 0 N-CA-C 109.731 -1.347 . . . . 0.0 109.731 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.7 m -107.76 38.16 2.24 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.481 -1.011 . . . . 0.0 110.379 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' A' ' 27' ' ' VAL . 11.3 tp -72.5 109.43 6.17 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.306 -0.871 . . . . 0.0 110.193 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.87 -22.48 6.82 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 110.108 -1.197 . . . . 0.0 110.108 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.8 118.33 7.57 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.284 -1.127 . . . . 0.0 109.963 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -64.58 146.6 54.39 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.223 -0.923 . . . . 0.0 109.849 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 98.0 m -63.89 161.93 14.67 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.383 -0.823 . . . . 0.0 110.032 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.5 -82.64 0.39 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.207 -0.933 . . . . 0.0 109.941 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -115.74 -55.54 2.42 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.454 -0.779 . . . . 0.0 109.502 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -121.38 -27.21 4.87 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.636 -0.665 . . . . 0.0 110.485 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -176.82 84.19 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.36 -0.837 . . . . 0.0 109.82 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -97.58 64.08 0.92 Allowed Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 67.0 m -126.15 144.84 50.6 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.633 -0.922 . . . . 0.0 110.294 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 28.6 p -69.61 166.17 19.6 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.489 -0.757 . . . . 0.0 110.336 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.87 129.15 38.4 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.466 -0.771 . . . . 0.0 110.524 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.5 -27.65 17.29 Favored Glycine 0 N--CA 1.494 2.538 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -108.28 134.67 50.78 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.275 -1.132 . . . . 0.0 110.361 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.3 m -103.98 149.36 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.487 -0.758 . . . . 0.0 110.701 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.3 t -75.37 113.83 13.2 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.524 -0.735 . . . . 0.0 110.329 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.503 ' HB2' ' O ' ' A' ' 25' ' ' TRP . 0.3 OUTLIER -82.4 126.12 31.82 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.416 -0.802 . . . . 0.0 110.044 179.634 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.7 mtt-85 -80.86 -23.4 39.09 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.343 -0.848 . . . . 0.0 110.411 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.455 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 25.4 m -77.02 -46.84 22.41 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.441 -0.787 . . . . 0.0 110.165 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.741 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.7 m95 -97.26 -6.18 35.09 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.487 -0.758 . . . . 0.0 110.741 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 4.1 mmmm 58.37 26.06 13.6 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.583 -0.698 . . . . 0.0 111.582 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.741 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -134.12 152.96 52.08 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.1 -1.0 . . . . 0.0 109.855 178.841 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.7 m -71.15 109.62 5.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.366 -0.834 . . . . 0.0 110.729 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.636 ' HA ' HD12 ' A' ' 3' ' ' LEU . 2.1 t -99.97 159.45 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 121.469 -0.77 . . . . 0.0 109.939 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.457 HD23 HD13 ' A' ' 3' ' ' LEU . 1.5 pp -74.11 146.82 43.26 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.382 -0.824 . . . . 0.0 110.563 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -105.87 120.55 42.03 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.594 -0.691 . . . . 0.0 109.852 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.552 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.732 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.462 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 86.4 m -103.18 20.67 17.25 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.44 -1.036 . . . . 0.0 110.915 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.97 111.02 12.07 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.031 -1.043 . . . . 0.0 109.892 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.16 -25.78 3.3 Favored Glycine 0 N--CA 1.494 2.567 0 N-CA-C 109.826 -1.31 . . . . 0.0 109.826 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -66.99 118.2 10.12 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.411 -1.052 . . . . 0.0 110.287 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 25' ' ' TRP . 8.7 mptt -70.27 150.3 46.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.448 -0.783 . . . . 0.0 110.584 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.0 m -75.72 179.3 5.5 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.533 -0.729 . . . . 0.0 110.208 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -137.62 -58.32 0.68 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.381 -0.824 . . . . 0.0 110.675 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -154.74 -53.21 0.09 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.402 -0.811 . . . . 0.0 110.731 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -94.29 10.05 35.66 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.445 -0.784 . . . . 0.0 111.417 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 52.46 67.17 1.02 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.344 -0.847 . . . . 0.0 109.938 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -93.5 62.15 2.04 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 16.7 m -79.42 163.62 24.65 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.502 -0.999 . . . . 0.0 109.681 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 40.0 m -61.9 166.59 4.4 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.309 -0.869 . . . . 0.0 110.783 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.8 p -64.71 128.23 34.91 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.359 -0.838 . . . . 0.0 109.98 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.5 6.82 62.31 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -120.42 153.73 36.15 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.196 -1.179 . . . . 0.0 110.01 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.22 147.02 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.39 -0.819 . . . . 0.0 110.328 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.8 t -81.13 119.43 23.56 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.445 -0.784 . . . . 0.0 110.154 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.483 ' HB3' ' CZ3' ' A' ' 25' ' ' TRP . 0.4 OUTLIER -89.42 154.44 20.05 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.487 -0.758 . . . . 0.0 110.333 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -11.7 39.25 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.428 -0.795 . . . . 0.0 111.199 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.461 HG22 ' CE2' ' A' ' 23' ' ' TRP . 6.2 m -69.29 -65.17 0.74 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.259 -0.901 . . . . 0.0 110.267 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.582 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 9.0 m95 -106.93 5.33 28.17 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.414 -0.804 . . . . 0.0 110.423 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.2 mttm 54.37 62.83 2.39 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.436 -0.79 . . . . 0.0 110.801 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.71 ' CE2' HG22 ' A' ' 27' ' ' VAL . 0.8 OUTLIER -148.83 171.31 16.49 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.331 -0.856 . . . . 0.0 110.579 179.664 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.9 m -77.51 129.98 36.38 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.51 -0.744 . . . . 0.0 110.716 -179.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.71 HG22 ' CE2' ' A' ' 25' ' ' TRP . 1.8 t -126.44 167.93 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.557 -0.714 . . . . 0.0 109.829 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -66.85 141.95 57.5 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.301 -0.874 . . . . 0.0 110.102 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.79 97.86 6.81 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.508 -0.745 . . . . 0.0 110.254 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.939 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.354 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 56.4 m -92.82 -17.35 24.23 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.398 -1.06 . . . . 0.0 110.896 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.509 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 0.5 OUTLIER -61.79 112.56 2.33 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.17 -0.956 . . . . 0.0 110.119 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.14 -27.43 4.81 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.15 113.08 3.31 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.446 -1.032 . . . . 0.0 110.105 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -66.39 130.73 44.2 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.514 -0.741 . . . . 0.0 110.598 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 t -110.47 140.47 44.7 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.529 -0.732 . . . . 0.0 109.988 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -151.04 -58.76 0.17 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.553 -0.717 . . . . 0.0 110.979 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -104.99 -75.05 0.63 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.359 -0.838 . . . . 0.0 110.685 -179.47 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -137.38 56.65 1.77 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.279 -0.888 . . . . 0.0 110.247 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.44 -51.62 49.32 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.447 -0.783 . . . . 0.0 110.196 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 74.78 92.47 0.16 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 179.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.7 m -83.63 164.43 19.71 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.515 -0.991 . . . . 0.0 109.941 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 26.3 p -77.3 177.02 8.25 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.371 -0.831 . . . . 0.0 110.701 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 73.3 p -58.38 140.3 53.87 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.378 -0.826 . . . . 0.0 110.697 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.3 1.98 89.29 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 -179.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -133.09 137.75 46.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.162 -1.199 . . . . 0.0 110.23 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 30.2 m -139.78 160.08 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.475 -0.765 . . . . 0.0 110.544 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -72.26 112.17 8.1 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.46 -0.775 . . . . 0.0 109.924 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.565 ' HB3' ' HB2' ' A' ' 23' ' ' TRP . 8.7 t -89.56 158.1 17.79 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.347 -0.846 . . . . 0.0 110.819 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -88.73 -47.84 7.95 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.54 -0.725 . . . . 0.0 109.686 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 50.9 m -65.72 -38.68 89.84 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.642 -0.661 . . . . 0.0 110.005 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.565 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 6.8 m95 -90.47 -32.03 16.54 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.614 -0.679 . . . . 0.0 110.593 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 66.44 27.87 9.74 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.525 -0.734 . . . . 0.0 111.384 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.586 ' NE1' HG22 ' A' ' 27' ' ' VAL . 1.2 p90 -150.5 175.21 12.1 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.188 -0.945 . . . . 0.0 109.738 178.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.509 ' O ' ' HA ' ' A' ' 3' ' ' LEU . 77.8 m -71.63 100.32 2.27 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.094 -1.004 . . . . 0.0 109.525 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.586 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.6 OUTLIER -106.53 157.04 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.479 -0.763 . . . . 0.0 110.186 -179.287 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.27 135.94 57.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.658 -0.651 . . . . 0.0 110.166 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -93.63 59.59 2.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.458 -0.776 . . . . 0.0 110.411 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.53 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.945 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.361 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 59.2 m -105.44 29.11 6.76 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.471 -1.017 . . . . 0.0 110.606 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.475 HD12 ' HE1' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -84.76 109.64 18.21 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.345 -0.847 . . . . 0.0 109.77 179.658 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 136.09 -21.43 3.51 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.871 -1.292 . . . . 0.0 109.871 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -66.66 110.68 3.31 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.236 -1.155 . . . . 0.0 109.753 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -65.35 149.36 50.11 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.439 -0.788 . . . . 0.0 110.642 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.533 ' HB2' ' HB3' ' A' ' 11' ' ' ASN . 29.7 p -149.06 157.62 43.55 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.537 -0.727 . . . . 0.0 110.325 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -118.55 -60.06 1.81 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.424 -0.797 . . . . 0.0 110.638 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -146.5 -57.51 0.28 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.33 -0.856 . . . . 0.0 110.687 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -106.33 38.78 1.96 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.42 -0.8 . . . . 0.0 110.592 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.533 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 28.4 t-20 -73.26 -57.7 3.83 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.232 -0.918 . . . . 0.0 109.965 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 92.66 95.77 1.42 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 71.4 m -90.9 -176.99 4.83 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.494 -1.004 . . . . 0.0 110.262 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.0 m -73.58 158.21 35.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.387 -0.821 . . . . 0.0 109.765 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 71.1 p -56.65 121.98 11.0 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.388 -0.82 . . . . 0.0 110.166 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.62 -23.19 30.45 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.475 ' HE1' HD12 ' A' ' 3' ' ' LEU . 15.9 m-85 -93.63 143.7 26.06 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.271 -1.135 . . . . 0.0 110.358 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 32.8 m -130.89 160.3 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.452 -0.78 . . . . 0.0 110.304 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -77.48 119.19 20.73 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.391 -0.818 . . . . 0.0 110.226 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.6 ' HB3' ' HB2' ' A' ' 23' ' ' TRP . 28.7 t -90.79 153.43 20.25 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.529 -0.732 . . . . 0.0 110.404 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.79 -49.66 9.49 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.348 -0.845 . . . . 0.0 109.57 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.2 m -66.61 -44.46 82.06 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.505 -0.747 . . . . 0.0 109.912 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.62 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 5.8 m95 -81.7 -31.02 32.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.67 -0.644 . . . . 0.0 110.73 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.3 OUTLIER 62.06 25.21 15.09 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.344 -0.847 . . . . 0.0 111.226 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.701 ' NE1' HG22 ' A' ' 27' ' ' VAL . 1.3 p90 -144.45 176.65 9.22 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.105 -0.997 . . . . 0.0 109.913 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.2 m -70.84 101.0 2.03 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.246 -0.909 . . . . 0.0 110.338 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.701 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.8 OUTLIER -113.11 158.28 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.621 -0.674 . . . . 0.0 109.517 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.2 128.01 34.79 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.07 139.96 57.6 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.462 -0.774 . . . . 0.0 110.429 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.608 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 -179.996 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.57 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 95.5 m -99.62 0.53 42.29 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.275 -1.132 . . . . 0.0 110.966 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 tt -72.98 101.17 3.15 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.138 -0.976 . . . . 0.0 110.043 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 134.13 -16.75 4.39 Favored Glycine 0 N--CA 1.494 2.505 0 N-CA-C 110.021 -1.231 . . . . 0.0 110.021 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -61.51 123.66 18.47 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.367 -1.078 . . . . 0.0 110.441 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -66.97 149.22 50.93 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.54 -0.725 . . . . 0.0 111.097 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.53 154.92 31.0 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.541 -0.724 . . . . 0.0 110.137 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.3 -65.27 1.19 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.441 -0.787 . . . . 0.0 110.257 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -129.7 -67.76 0.74 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.506 -0.746 . . . . 0.0 109.821 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -118.76 -17.16 9.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.548 -0.72 . . . . 0.0 110.644 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -149.45 -66.58 0.22 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.157 -0.964 . . . . 0.0 110.173 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 55.58 37.68 68.49 Favored Glycine 0 N--CA 1.495 2.585 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 95.5 m -128.48 170.58 12.99 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.475 -1.015 . . . . 0.0 110.669 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 86.4 m -87.06 176.02 7.82 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.532 -0.73 . . . . 0.0 109.862 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.05 116.29 6.31 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.329 -0.857 . . . . 0.0 109.917 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 102.51 7.52 45.37 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -125.08 137.84 54.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.228 -1.16 . . . . 0.0 110.096 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.4 t -118.27 162.64 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.364 -0.835 . . . . 0.0 110.22 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 11.2 t -77.11 117.31 18.54 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.452 -0.78 . . . . 0.0 109.967 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 t -71.6 133.57 45.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.605 -0.685 . . . . 0.0 110.453 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -15.06 53.63 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.367 -0.833 . . . . 0.0 110.178 179.319 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.465 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 21.1 m -94.81 -46.02 7.07 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.402 -0.811 . . . . 0.0 110.491 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CB ' ' CE3' ' A' ' 25' ' ' TRP . 6.8 m95 -101.03 -13.11 18.37 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.411 -0.806 . . . . 0.0 111.093 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 8.3 mmtt 66.5 15.48 10.12 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.582 -0.698 . . . . 0.0 111.916 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.653 ' CE2' HG12 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -117.54 157.66 25.95 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.893 -1.13 . . . . 0.0 109.633 178.773 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.5 m -62.59 101.41 0.25 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.467 -0.771 . . . . 0.0 111.076 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.653 HG12 ' CE2' ' A' ' 25' ' ' TRP . 11.4 m -102.53 153.85 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.581 -0.699 . . . . 0.0 109.829 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 tp -68.0 138.87 56.22 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.519 -0.738 . . . . 0.0 110.582 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.21 121.87 13.64 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.64 -0.662 . . . . 0.0 110.519 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.736 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 179.844 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.484 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.472 ' HB2' ' CG ' ' A' ' 17' ' ' TYR . 61.5 m -109.21 8.04 25.65 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.557 -0.967 . . . . 0.0 110.986 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.534 HD12 ' HE2' ' A' ' 17' ' ' TYR . 0.9 OUTLIER -69.36 131.74 45.29 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.037 -1.04 . . . . 0.0 110.116 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 112.24 -24.58 13.92 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -61.49 118.82 7.49 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.404 -1.056 . . . . 0.0 110.158 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -70.58 139.48 51.46 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.433 -0.792 . . . . 0.0 110.754 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.451 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 69.8 m -121.06 177.32 5.17 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.628 -0.67 . . . . 0.0 110.226 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -131.18 -57.81 1.01 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.466 -0.771 . . . . 0.0 110.172 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -148.64 -60.66 0.24 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.533 -0.73 . . . . 0.0 109.976 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -129.93 38.15 3.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 0.0 110.098 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -54.18 -51.27 64.9 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.554 -0.716 . . . . 0.0 110.107 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.45 94.74 0.54 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.53 -175.2 5.07 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.447 -1.031 . . . . 0.0 109.884 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.0 p -60.72 157.41 14.8 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.262 -0.899 . . . . 0.0 110.297 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 m -55.77 125.34 20.84 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.486 -0.759 . . . . 0.0 110.301 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 113.33 -20.52 18.66 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.534 ' HE2' HD12 ' A' ' 3' ' ' LEU . 6.6 m-85 -113.37 152.72 29.62 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.286 -1.126 . . . . 0.0 110.58 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.15 138.59 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.606 -0.684 . . . . 0.0 110.405 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.1 m -74.92 119.6 19.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.446 -0.784 . . . . 0.0 109.889 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 89.9 p -81.36 132.59 35.34 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.461 -0.775 . . . . 0.0 110.772 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -80.32 -13.66 59.0 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.507 -0.746 . . . . 0.0 110.304 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.521 HG22 ' CE3' ' A' ' 23' ' ' TRP . 53.1 m -90.82 -49.21 6.57 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.338 -0.851 . . . . 0.0 110.181 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.747 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 6.7 m95 -92.27 -15.99 26.71 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.408 -0.808 . . . . 0.0 110.81 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 6.3 mtmm 65.6 31.16 10.13 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.695 -0.628 . . . . 0.0 111.681 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.747 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -139.05 155.12 48.18 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.13 -0.981 . . . . 0.0 109.348 178.164 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 3' ' ' LEU . 58.5 m -70.12 112.38 6.44 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.34 -0.85 . . . . 0.0 110.933 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.617 HG22 ' NE1' ' A' ' 25' ' ' TRP . 1.3 t -108.94 167.48 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.37 -0.831 . . . . 0.0 109.764 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 tp -70.62 141.38 51.73 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.39 -0.818 . . . . 0.0 110.176 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.97 130.94 44.99 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.506 -0.746 . . . . 0.0 110.358 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.537 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.881 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 87.3 m -100.65 28.77 4.88 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.341 -1.093 . . . . 0.0 110.632 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.7 tt -80.42 113.86 18.91 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.186 -0.946 . . . . 0.0 109.928 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.66 -31.33 2.67 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -56.47 124.69 19.04 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.514 -0.992 . . . . 0.0 110.253 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.61 149.51 49.99 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.342 -0.849 . . . . 0.0 110.702 -179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.9 m -67.71 157.38 34.76 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.579 -0.701 . . . . 0.0 109.713 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -114.83 -75.42 0.59 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.373 -0.83 . . . . 0.0 110.331 -179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -140.3 -59.48 0.53 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.261 -0.899 . . . . 0.0 110.053 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.91 -33.22 12.27 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.511 -0.743 . . . . 0.0 109.983 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -165.14 -67.26 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.605 -0.685 . . . . 0.0 109.914 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 65.98 35.9 91.31 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.2 m -131.78 172.37 12.37 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.523 -0.986 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.2 m -79.41 176.59 9.55 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.467 -0.77 . . . . 0.0 110.24 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.0 m -67.23 117.13 8.82 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.415 -0.803 . . . . 0.0 110.217 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 102.42 -14.63 56.61 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.279 -1.129 . . . . 0.0 110.279 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -91.6 129.8 37.51 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.078 -1.248 . . . . 0.0 110.484 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.4 t -97.37 168.47 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.609 -0.682 . . . . 0.0 110.178 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.25 118.54 37.04 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.254 -0.904 . . . . 0.0 110.46 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.538 ' HB2' ' CZ3' ' A' ' 25' ' ' TRP . 4.4 m -91.05 151.39 21.05 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.551 -0.718 . . . . 0.0 110.343 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.28 -19.19 24.38 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.313 -0.867 . . . . 0.0 111.527 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 66.4 m -57.11 -73.16 0.07 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.163 -0.96 . . . . 0.0 110.209 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.556 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 40.4 m95 -96.44 0.21 50.09 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 179.295 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.82 68.77 0.79 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.383 -0.823 . . . . 0.0 110.569 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.556 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -155.25 178.23 10.45 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.296 -0.878 . . . . 0.0 110.786 179.666 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.9 m -85.39 138.07 32.51 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.438 -0.789 . . . . 0.0 111.392 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.467 ' CG1' ' CZ2' ' A' ' 25' ' ' TRP . 2.7 m -127.02 140.3 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.74 -0.6 . . . . 0.0 110.015 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.2 tp -67.67 124.59 23.7 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.314 -0.866 . . . . 0.0 109.856 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.87 101.85 0.13 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.637 -0.665 . . . . 0.0 110.3 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.394 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.852 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.475 ' HB2' ' CG ' ' A' ' 17' ' ' TYR . 85.7 m -95.09 3.71 54.49 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.516 -0.991 . . . . 0.0 110.933 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.6 tp -64.57 114.02 4.1 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.133 -0.979 . . . . 0.0 109.97 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.95 -28.62 5.35 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -57.81 140.73 51.04 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.387 -1.067 . . . . 0.0 109.968 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.9 mmmt -85.75 141.05 29.98 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.432 -0.793 . . . . 0.0 110.838 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.2 t -133.96 142.96 47.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.733 -0.605 . . . . 0.0 109.467 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.65 -51.8 9.35 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.424 -0.798 . . . . 0.0 110.341 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -157.27 -57.05 0.08 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.502 -0.749 . . . . 0.0 110.229 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -146.81 43.35 1.16 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.448 -0.783 . . . . 0.0 110.074 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -54.51 -53.54 52.95 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.467 -0.771 . . . . 0.0 110.272 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.66 84.11 0.54 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.4 t -79.6 173.38 12.64 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.513 -0.992 . . . . 0.0 109.682 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.7 p -59.24 162.15 4.81 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.276 -0.89 . . . . 0.0 110.634 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -55.12 129.87 39.78 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.56 -0.712 . . . . 0.0 110.774 -179.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.98 7.17 56.61 Favored Glycine 0 N--CA 1.494 2.564 0 N-CA-C 110.699 -0.96 . . . . 0.0 110.699 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.475 ' CG ' ' HB2' ' A' ' 2' ' ' CYS . 26.9 m-85 -136.31 138.16 41.41 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.05 -1.265 . . . . 0.0 110.808 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.463 ' O ' HG22 ' A' ' 27' ' ' VAL . 12.5 t -125.18 166.77 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.641 -0.662 . . . . 0.0 109.913 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 72.7 m -90.44 114.42 26.57 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.306 -0.871 . . . . 0.0 110.126 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.492 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 10.8 t -75.17 159.12 31.98 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.452 -0.78 . . . . 0.0 110.616 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.1 ttp85 -90.89 -22.71 20.78 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.471 -0.768 . . . . 0.0 110.954 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.509 HG22 ' CD2' ' A' ' 23' ' ' TRP . 62.7 m -69.48 -82.65 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.201 -0.937 . . . . 0.0 110.928 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.684 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 14.3 m95 -85.08 -0.13 53.49 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.07 -1.019 . . . . 0.0 110.812 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER 56.67 63.95 1.81 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.323 -0.86 . . . . 0.0 110.811 179.772 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.684 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.5 p90 -145.95 176.88 9.36 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.273 -0.892 . . . . 0.0 110.395 179.153 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.7 m -78.59 122.79 26.36 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.261 -0.899 . . . . 0.0 111.117 -178.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.61 HG12 ' CZ2' ' A' ' 25' ' ' TRP . 24.2 m -115.13 151.34 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.686 -0.634 . . . . 0.0 110.06 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.7 mt -68.11 118.47 11.31 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.336 -0.852 . . . . 0.0 110.04 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.32 132.27 47.38 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.498 -0.751 . . . . 0.0 110.375 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.498 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.961 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 109.454 -1.459 . . . . 0.0 109.454 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 67.1 m -98.73 -5.86 30.6 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.501 -0.999 . . . . 0.0 110.878 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.42 119.09 10.38 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.106 -0.997 . . . . 0.0 109.846 179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.39 -23.11 4.9 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.77 132.37 50.72 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.309 -1.112 . . . . 0.0 109.879 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -81.01 149.72 29.18 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.42 -0.8 . . . . 0.0 110.3 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.0 p -149.94 165.19 33.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.476 -0.765 . . . . 0.0 110.601 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -135.45 -57.85 0.79 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.584 -0.698 . . . . 0.0 110.34 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -139.27 -59.21 0.58 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.35 -0.844 . . . . 0.0 110.336 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -120.87 41.63 3.24 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.474 -0.766 . . . . 0.0 110.233 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -62.8 -53.85 47.92 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.355 -0.841 . . . . 0.0 110.008 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 107.9 75.85 0.93 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 98.8 m -79.25 169.93 17.38 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.439 -1.036 . . . . 0.0 109.389 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.0 m -67.68 161.95 24.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.251 -0.906 . . . . 0.0 110.017 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.5 p -58.8 120.41 8.93 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.404 -0.81 . . . . 0.0 109.907 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.99 -17.53 44.68 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.442 ' HA ' ' O ' ' A' ' 27' ' ' VAL . 27.8 m-85 -95.05 147.41 23.44 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.24 -1.153 . . . . 0.0 110.283 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 t -128.59 162.44 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.507 -0.746 . . . . 0.0 110.081 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -88.63 110.7 21.15 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.353 -0.842 . . . . 0.0 110.217 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.438 ' HB3' ' CZ3' ' A' ' 25' ' ' TRP . 0.5 OUTLIER -84.08 153.13 23.95 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.494 -0.754 . . . . 0.0 110.396 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -90.57 -4.05 57.14 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.417 -0.802 . . . . 0.0 111.164 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.482 HG22 ' CE2' ' A' ' 23' ' ' TRP . 9.5 m -77.77 -66.74 0.8 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.97 -1.081 . . . . 0.0 110.224 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.592 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 11.8 m95 -104.36 6.8 35.43 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.467 -0.77 . . . . 0.0 110.152 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.2 mttt 52.32 65.22 1.57 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.482 -0.761 . . . . 0.0 110.725 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.592 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -151.35 172.03 16.56 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.319 -0.863 . . . . 0.0 110.842 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.435 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 72.5 m -79.67 118.61 21.65 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.496 -0.753 . . . . 0.0 109.863 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.568 ' HB ' ' CZ2' ' A' ' 25' ' ' TRP . 1.6 p -121.69 160.72 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.497 -0.752 . . . . 0.0 110.529 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -67.53 127.08 31.4 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.167 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.82 117.79 9.42 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.539 -0.726 . . . . 0.0 110.249 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -113.21 96.08 0.79 Allowed Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -74.38 80.58 2.22 Favored 'Trans proline' 0 C--N 1.314 -1.268 0 O-C-N 123.906 1.477 . . . . 0.0 110.218 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 3.7 m-90 . . . . . 0 N--CA 1.501 2.089 0 CA-C-O 118.474 -0.774 . . . . 0.0 110.642 -179.821 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.464 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 93.2 m -110.35 13.58 22.86 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.473 -1.016 . . . . 0.0 110.893 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 tt -65.95 115.06 5.63 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.068 -1.02 . . . . 0.0 110.382 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.88 -29.77 3.48 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.403 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 35.9 t70 -64.88 156.8 29.76 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.403 -1.057 . . . . 0.0 110.538 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.4 ' HG3' ' HB2' ' A' ' 9' ' ' TYR . 0.0 OUTLIER -89.25 149.95 22.85 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.412 -0.805 . . . . 0.0 110.51 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.456 ' SG ' ' SG ' ' A' ' 13' ' ' CYS . 0.1 OUTLIER -105.28 23.46 13.67 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.412 -0.805 . . . . 0.0 110.669 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -116.99 -44.84 2.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.233 -0.917 . . . . 0.0 110.487 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.4 ' HB2' ' HG3' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -66.76 -57.86 6.23 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.439 -0.788 . . . . 0.0 110.499 -179.588 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -108.82 -26.35 10.33 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.481 -0.762 . . . . 0.0 110.782 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.4 t30 53.26 50.14 18.29 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.497 -0.752 . . . . 0.0 110.298 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -141.02 85.08 0.21 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 81.8 m -83.83 -169.85 2.78 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.654 -0.909 . . . . 0.0 110.7 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 0.8 OUTLIER -77.82 175.45 9.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.457 -0.777 . . . . 0.0 110.183 179.981 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 55.6 p -69.01 114.89 7.7 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.334 -0.854 . . . . 0.0 110.111 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.6 4.39 55.97 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 110.229 -1.149 . . . . 0.0 110.229 -179.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.524 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 3.3 m-85 -100.27 144.12 29.66 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.048 -1.266 . . . . 0.0 109.904 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.6 m -123.44 161.47 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.467 -0.77 . . . . 0.0 110.71 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 m -82.6 114.05 20.72 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.592 -0.693 . . . . 0.0 109.891 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.489 ' OG ' HG21 ' A' ' 27' ' ' VAL . 0.3 OUTLIER -70.89 153.13 42.97 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.401 -0.812 . . . . 0.0 110.604 -179.776 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.45 10.76 23.94 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.581 -0.699 . . . . 0.0 110.88 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.5 m -103.15 -78.71 0.54 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.126 -0.984 . . . . 0.0 110.044 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.63 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 23.9 m95 -89.74 6.62 40.77 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.252 -0.905 . . . . 0.0 110.607 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.9 mptt 53.31 54.85 9.57 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.42 -0.8 . . . . 0.0 110.296 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.7 ' CE2' HG22 ' A' ' 27' ' ' VAL . 0.9 OUTLIER -136.32 173.53 11.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.292 -0.88 . . . . 0.0 110.723 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.403 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 85.8 m -73.68 131.19 41.37 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.476 -0.765 . . . . 0.0 111.1 -178.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.7 HG22 ' CE2' ' A' ' 25' ' ' TRP . 2.9 t -135.63 161.67 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.66 -0.65 . . . . 0.0 109.856 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.3 mt -74.52 134.25 42.24 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.441 -0.787 . . . . 0.0 110.23 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.93 128.05 32.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.515 -0.74 . . . . 0.0 110.21 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.43 161.26 37.32 Favored Glycine 0 N--CA 1.495 2.603 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -71.82 131.03 17.71 Favored 'Trans proline' 0 C--N 1.312 -1.351 0 O-C-N 123.905 1.477 . . . . 0.0 110.551 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 43.7 m95 . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 117.836 -1.078 . . . . 0.0 110.104 179.966 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.429 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 13.0 m 59.66 38.04 22.12 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.64 -0.918 . . . . 0.0 110.686 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 tt -96.14 107.58 19.92 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.407 -0.808 . . . . 0.0 109.553 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 143.24 -25.16 2.2 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.04 128.23 35.14 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.364 -1.08 . . . . 0.0 110.151 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 25' ' ' TRP . 13.2 pttp -84.62 149.87 25.56 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.552 -0.717 . . . . 0.0 110.55 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 11' ' ' ASN . 28.5 p -143.05 139.74 30.66 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.575 -0.703 . . . . 0.0 110.226 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -103.55 -33.58 8.97 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.565 -0.71 . . . . 0.0 110.879 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -154.88 -59.11 0.11 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.242 -0.911 . . . . 0.0 110.265 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -132.5 46.39 2.64 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.558 -0.714 . . . . 0.0 110.308 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.405 ' HB2' ' HA ' ' A' ' 7' ' ' CYS . 22.7 t-20 -58.18 -49.75 75.94 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.479 -0.763 . . . . 0.0 110.281 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 107.79 80.94 1.31 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 87.8 m -79.91 171.67 14.8 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.403 -1.057 . . . . 0.0 109.55 179.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.0 OUTLIER -67.27 160.1 27.81 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.111 -0.993 . . . . 0.0 110.255 179.777 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 p -59.13 121.07 10.41 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.441 -0.787 . . . . 0.0 110.452 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 103.15 -8.92 53.99 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.401 ' CE1' ' HG ' ' A' ' 28' ' ' LEU . 2.2 m-85 -103.98 148.34 26.31 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.075 -1.25 . . . . 0.0 110.706 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.7 171.11 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.599 -0.688 . . . . 0.0 110.277 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.3 m -94.43 122.56 37.12 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.257 -0.902 . . . . 0.0 110.487 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.534 ' OG ' HG21 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -88.92 165.64 14.47 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.391 -0.818 . . . . 0.0 110.935 179.956 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -91.31 -30.78 16.38 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.514 -0.741 . . . . 0.0 111.266 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.1 m -55.32 -73.67 0.05 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.476 -0.765 . . . . 0.0 111.142 -178.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.575 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 34.6 m95 -100.2 5.82 44.74 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.145 -0.972 . . . . 0.0 110.95 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 20' ' ' SER . 0.1 OUTLIER 52.6 59.82 4.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.302 -0.873 . . . . 0.0 110.146 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.727 ' CE2' HG22 ' A' ' 27' ' ' VAL . 1.1 p90 -141.18 175.21 9.83 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.377 -0.827 . . . . 0.0 110.72 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.1 m -76.07 127.15 32.36 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.544 -0.723 . . . . 0.0 110.583 -179.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.727 HG22 ' CE2' ' A' ' 25' ' ' TRP . 2.3 t -127.96 159.93 38.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.571 -0.706 . . . . 0.0 109.809 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.401 ' HG ' ' CE1' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -66.2 142.44 57.71 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.36 -0.837 . . . . 0.0 110.322 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.92 -27.46 68.87 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.57 -0.706 . . . . 0.0 110.924 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.7 168.09 32.47 Favored Glycine 0 N--CA 1.494 2.557 0 N-CA-C 109.927 -1.269 . . . . 0.0 109.927 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.73 136.65 28.39 Favored 'Trans proline' 0 C--N 1.313 -1.306 0 O-C-N 123.829 1.436 . . . . 0.0 110.783 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 117.855 -1.069 . . . . 0.0 110.457 -179.888 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.418 0 N-CA-C 109.958 -1.257 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 84.0 m -103.06 4.7 37.49 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.522 -0.987 . . . . 0.0 110.851 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.04 114.06 6.25 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.963 -1.085 . . . . 0.0 109.621 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 122.64 -18.35 8.15 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.49 116.39 3.07 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.364 -1.08 . . . . 0.0 110.04 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.53 138.7 57.69 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.411 -0.806 . . . . 0.0 110.641 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 p -128.62 116.81 20.18 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.724 -0.61 . . . . 0.0 110.24 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.36 -59.79 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.434 -0.791 . . . . 0.0 110.459 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -79.47 -44.13 21.89 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.427 -0.796 . . . . 0.0 110.182 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -96.09 -35.58 11.3 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.445 -0.784 . . . . 0.0 110.149 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 54.86 68.19 0.9 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.656 -0.653 . . . . 0.0 110.684 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.15 84.8 0.2 Allowed Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.2 m -80.52 169.88 17.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.544 -0.974 . . . . 0.0 110.502 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.5 m -78.45 177.26 8.65 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.403 -0.811 . . . . 0.0 110.099 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 37.8 m -64.34 129.43 39.9 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.325 -0.859 . . . . 0.0 109.957 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.32 17.79 75.46 Favored Glycine 0 N--CA 1.493 2.491 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.417 ' HB3' ' HB3' ' A' ' 26' ' ' CYS . 11.9 m-85 -125.48 132.21 52.7 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.292 -1.122 . . . . 0.0 109.666 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.9 m -117.64 146.85 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.327 -0.858 . . . . 0.0 110.648 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.5 t -67.11 119.13 11.53 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.603 -0.685 . . . . 0.0 110.05 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.447 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -75.11 132.69 41.41 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.438 -0.788 . . . . 0.0 110.732 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -81.31 -15.07 56.52 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.489 -0.757 . . . . 0.0 109.535 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.458 HG22 ' CE3' ' A' ' 23' ' ' TRP . 98.4 m -101.32 -44.58 5.6 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.475 -0.766 . . . . 0.0 110.401 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.776 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.4 m95 -91.81 -16.97 26.02 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.448 -0.782 . . . . 0.0 111.218 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.0 12.77 8.94 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.56 -0.713 . . . . 0.0 112.252 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.776 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -124.13 160.16 28.41 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.889 -1.132 . . . . 0.0 109.671 178.743 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 78.8 m -71.39 109.1 5.17 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.38 -0.825 . . . . 0.0 110.957 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.522 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.8 OUTLIER -106.38 165.33 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.471 -0.768 . . . . 0.0 109.815 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.85 148.07 50.28 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.344 -0.848 . . . . 0.0 110.409 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.71 14.72 8.0 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.432 -0.793 . . . . 0.0 111.168 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.06 178.61 49.6 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.86 162.95 40.4 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.77 1.405 . . . . 0.0 110.382 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.07 0 CA-C-O 117.847 -1.073 . . . . 0.0 111.041 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.8 p -92.22 4.36 53.41 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.604 -0.939 . . . . 0.0 111.155 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.1 tp -74.72 123.7 25.42 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.097 -1.002 . . . . 0.0 109.942 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 108.56 -14.14 35.61 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.62 139.76 47.58 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.18 -1.188 . . . . 0.0 109.496 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.74 139.88 52.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.507 -0.746 . . . . 0.0 110.7 -179.456 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.5 t -132.1 144.54 50.79 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.526 -0.734 . . . . 0.0 110.369 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -123.28 -66.78 0.99 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.629 -0.669 . . . . 0.0 109.818 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -157.66 -58.93 0.08 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.496 -0.752 . . . . 0.0 110.254 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -105.81 45.53 0.97 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.564 -0.71 . . . . 0.0 110.396 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -76.97 -45.74 26.5 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.35 -0.844 . . . . 0.0 110.281 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.19 74.63 1.28 Allowed Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.9 m -89.57 -168.46 2.16 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.495 -1.003 . . . . 0.0 110.233 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.507 ' HB2' ' CD1' ' A' ' 17' ' ' TYR . 85.8 m -63.94 162.8 13.18 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.309 -0.869 . . . . 0.0 110.336 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.9 m -67.19 115.38 6.8 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.364 -0.835 . . . . 0.0 109.962 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 103.33 14.15 26.73 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.507 ' CD1' ' HB2' ' A' ' 14' ' ' CYS . 3.3 m-85 -106.56 121.41 44.25 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.157 -1.202 . . . . 0.0 109.993 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -91.0 163.55 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.504 -0.748 . . . . 0.0 110.142 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t -95.97 114.31 26.01 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.575 -0.703 . . . . 0.0 109.801 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.462 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -90.36 111.0 22.06 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.331 -0.855 . . . . 0.0 110.401 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -26.12 53.32 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.404 -0.81 . . . . 0.0 109.646 179.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.437 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 53.0 m -67.46 -44.51 78.44 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.61 -0.681 . . . . 0.0 110.076 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.697 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.5 m95 -98.01 -12.26 22.12 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.443 -0.785 . . . . 0.0 110.665 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 64.95 34.39 9.04 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.576 -0.703 . . . . 0.0 111.547 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.697 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -147.06 154.88 41.71 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.076 -1.015 . . . . 0.0 109.915 178.793 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.31 115.54 15.06 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.362 -0.836 . . . . 0.0 110.886 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.603 HG22 ' NE1' ' A' ' 25' ' ' TRP . 1.0 OUTLIER -106.83 170.21 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.719 -0.613 . . . . 0.0 109.99 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.85 148.34 31.39 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.348 -0.845 . . . . 0.0 110.039 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.15 90.71 6.59 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.413 -0.804 . . . . 0.0 110.421 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.29 -92.36 1.73 Allowed Glycine 0 N--CA 1.494 2.526 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.46 109.11 2.78 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 O-C-N 124.002 1.527 . . . . 0.0 110.391 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 47.6 t-105 . . . . . 0 N--CA 1.495 1.81 0 CA-C-O 117.927 -1.035 . . . . 0.0 110.5 -179.882 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.415 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.1 p -101.59 60.98 0.9 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.474 -1.016 . . . . 0.0 110.542 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.9 tt -78.12 107.16 10.5 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.356 -0.84 . . . . 0.0 109.902 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.01 -16.84 3.66 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.7 122.69 17.84 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.246 -1.15 . . . . 0.0 109.996 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.59 142.39 22.89 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.651 -0.656 . . . . 0.0 111.263 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.7 t -137.03 144.01 43.01 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.595 -0.69 . . . . 0.0 110.079 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -125.59 -67.85 0.86 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.451 -0.781 . . . . 0.0 110.461 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -150.68 -58.43 0.17 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.261 -0.9 . . . . 0.0 110.332 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -104.79 42.44 1.21 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.491 -0.756 . . . . 0.0 110.106 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -89.07 -49.78 6.56 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.321 -0.862 . . . . 0.0 110.141 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.01 106.34 0.65 Allowed Glycine 0 N--CA 1.493 2.451 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.483 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 74.9 m -83.32 -168.35 2.06 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.56 -0.965 . . . . 0.0 110.262 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.0 m -80.51 179.67 7.62 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.262 -0.899 . . . . 0.0 110.729 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.0 p -68.49 122.25 18.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.474 -0.766 . . . . 0.0 109.859 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.09 14.38 69.41 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.483 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 5.1 m-85 -113.77 156.29 24.1 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.307 -1.114 . . . . 0.0 110.191 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.418 ' CG2' ' N ' ' A' ' 19' ' ' CYS . 1.5 p -128.6 163.43 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.418 -0.801 . . . . 0.0 110.623 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.418 ' N ' ' CG2' ' A' ' 18' ' ' VAL . 14.9 t -89.74 109.97 20.91 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.881 -0.512 . . . . 0.0 110.139 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.509 ' HB2' HG23 ' A' ' 27' ' ' VAL . 1.1 m -90.42 120.39 31.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.427 -0.796 . . . . 0.0 110.744 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -30.88 56.13 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.581 -0.699 . . . . 0.0 110.195 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.464 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 19.6 m -61.24 -48.19 82.63 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.497 -0.752 . . . . 0.0 110.235 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.701 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.5 m95 -100.37 -2.52 33.23 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.445 -0.784 . . . . 0.0 110.847 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 mtmm 54.87 35.19 23.77 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.406 -0.809 . . . . 0.0 111.981 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.701 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -144.55 157.36 44.26 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.057 -1.027 . . . . 0.0 109.882 178.731 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.41 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 56.8 m -71.89 104.8 3.6 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.337 -0.852 . . . . 0.0 110.888 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.571 HG22 ' NE1' ' A' ' 25' ' ' TRP . 12.2 t -95.13 163.41 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.55 -0.719 . . . . 0.0 109.461 179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.6 tt -78.17 129.96 35.76 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.339 -0.851 . . . . 0.0 110.189 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.92 107.22 10.29 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.596 -0.69 . . . . 0.0 110.125 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.22 131.75 12.64 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.07 110.87 3.04 Favored 'Trans proline' 0 C--N 1.314 -1.261 0 O-C-N 123.895 1.471 . . . . 0.0 110.482 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 4.4 t90 . . . . . 0 N--CA 1.495 1.798 0 CA-C-O 117.856 -1.069 . . . . 0.0 110.453 -179.88 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.367 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 72.2 m -119.98 35.05 4.98 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.506 -0.996 . . . . 0.0 110.58 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 tt -86.51 130.33 34.53 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.21 -0.932 . . . . 0.0 109.969 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.16 -22.34 36.88 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.892 -1.283 . . . . 0.0 109.892 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -64.26 125.28 24.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.333 -1.098 . . . . 0.0 110.184 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -59.13 151.93 21.48 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.631 -0.668 . . . . 0.0 110.667 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.0 m -69.87 145.99 51.6 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.482 -0.761 . . . . 0.0 110.222 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -82.11 -55.03 4.81 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.437 -0.79 . . . . 0.0 109.889 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -162.24 -58.4 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.69 -0.631 . . . . 0.0 109.481 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -97.21 -33.36 11.51 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.667 -0.645 . . . . 0.0 109.523 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.58 ' HA ' ' HB2' ' A' ' 19' ' ' CYS . 0.9 OUTLIER -163.58 -62.13 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.63 -0.669 . . . . 0.0 109.849 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 58.49 40.42 94.38 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 109.954 -1.258 . . . . 0.0 109.954 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.4 m -125.98 156.65 39.49 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.519 -0.989 . . . . 0.0 110.489 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.9 m -83.03 175.9 9.66 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.521 -0.737 . . . . 0.0 110.134 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.6 m -60.36 124.49 20.47 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.429 -0.794 . . . . 0.0 110.172 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.58 15.42 37.51 Favored Glycine 0 N--CA 1.494 2.556 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -132.23 143.07 49.67 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.298 -1.119 . . . . 0.0 110.21 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.503 HG13 ' HB2' ' A' ' 29' ' ' ALA . 19.7 m -120.27 147.44 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.483 -0.76 . . . . 0.0 110.26 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HB2' ' HA ' ' A' ' 11' ' ' ASN . 42.5 t -78.98 103.07 8.67 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.468 -0.77 . . . . 0.0 109.987 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.457 ' HB2' HG21 ' A' ' 27' ' ' VAL . 26.1 t -72.11 128.57 36.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.476 -0.765 . . . . 0.0 110.217 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.461 ' HA ' ' HE2' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -80.35 -16.06 55.42 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.419 -0.801 . . . . 0.0 110.132 179.292 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 m -84.67 -46.95 10.97 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.339 -0.85 . . . . 0.0 110.263 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.694 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.9 m95 -99.98 -15.73 18.19 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.384 -0.823 . . . . 0.0 110.926 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 11.5 mmtt 62.92 35.67 13.26 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.72 -0.613 . . . . 0.0 111.844 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.694 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -136.36 158.48 44.32 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.098 -1.001 . . . . 0.0 109.378 178.121 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.4 m -70.56 104.36 2.77 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.334 -0.854 . . . . 0.0 110.744 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.573 HG22 ' NE1' ' A' ' 25' ' ' TRP . 2.0 t -99.09 156.55 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 109.567 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -65.74 128.55 36.41 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.465 -0.772 . . . . 0.0 110.197 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.503 ' HB2' HG13 ' A' ' 18' ' ' VAL . . . -68.79 101.39 1.33 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.587 -0.696 . . . . 0.0 110.338 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -106.51 -152.7 19.61 Favored Glycine 0 N--CA 1.493 2.488 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -72.16 -28.91 15.08 Favored 'Trans proline' 0 C--N 1.313 -1.297 0 O-C-N 123.96 1.505 . . . . 0.0 111.034 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.6 m0 . . . . . 0 N--CA 1.497 1.894 0 CA-C-O 117.887 -1.054 . . . . 0.0 110.274 -179.879 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.368 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 14' ' ' CYS . 14.1 m -90.48 -9.16 48.4 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.503 -0.998 . . . . 0.0 111.167 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 27' ' ' VAL . 4.2 tp -58.81 120.75 9.57 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.19 -0.944 . . . . 0.0 110.01 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.1 -23.23 6.95 Favored Glycine 0 N--CA 1.493 2.498 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.459 ' O ' ' HA ' ' A' ' 25' ' ' TRP . 23.7 t70 -65.3 156.14 33.0 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.264 -1.139 . . . . 0.0 110.069 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -90.3 147.94 23.19 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.404 -0.81 . . . . 0.0 111.102 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.8 p -140.98 155.2 46.27 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.498 -0.751 . . . . 0.0 109.811 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -122.64 -69.37 0.83 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.336 -0.853 . . . . 0.0 110.443 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -160.62 -55.86 0.05 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.407 -0.808 . . . . 0.0 109.903 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -106.62 15.13 26.13 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.656 -0.653 . . . . 0.0 110.414 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -72.34 -48.87 38.55 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.221 -0.925 . . . . 0.0 109.958 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.43 109.69 2.74 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.8 m -79.79 -166.53 1.02 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.549 -0.971 . . . . 0.0 110.033 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 2' ' ' CYS . 0.5 OUTLIER -71.92 170.81 12.96 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.273 -0.892 . . . . 0.0 110.754 -179.883 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.8 m -66.16 115.3 6.02 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.551 -0.718 . . . . 0.0 109.806 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.36 -17.22 59.4 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.836 -1.306 . . . . 0.0 109.836 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -89.58 140.24 29.74 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.281 -1.129 . . . . 0.0 110.159 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 4.2 t -103.53 160.73 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.524 -0.735 . . . . 0.0 109.741 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.9 t -92.56 115.95 28.56 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.482 -0.761 . . . . 0.0 109.903 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.522 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -77.29 115.9 17.45 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.525 -0.734 . . . . 0.0 110.118 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -78.29 -13.82 59.69 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.512 -0.742 . . . . 0.0 109.855 179.214 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.486 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 49.8 m -91.09 -44.78 9.07 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.458 -0.776 . . . . 0.0 110.187 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.696 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.2 m95 -96.18 -13.62 23.38 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.411 -0.805 . . . . 0.0 110.897 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 3.2 mmmm 66.03 31.34 9.09 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.62 -0.675 . . . . 0.0 111.905 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.696 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -139.02 156.06 47.5 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.062 -1.024 . . . . 0.0 109.673 178.429 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.4 m -73.16 109.97 7.09 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.183 -0.948 . . . . 0.0 110.869 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.689 HG22 ' NE1' ' A' ' 25' ' ' TRP . 1.6 t -104.6 156.38 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.513 -0.742 . . . . 0.0 109.808 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.8 tp -79.09 147.13 32.88 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.407 -0.808 . . . . 0.0 109.949 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.34 88.55 2.58 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.465 -0.772 . . . . 0.0 110.191 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -154.8 -176.11 26.67 Favored Glycine 0 N--CA 1.495 2.627 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.58 -14.49 24.78 Favored 'Trans proline' 0 C--N 1.314 -1.24 0 O-C-N 123.874 1.46 . . . . 0.0 111.541 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 3.6 m0 . . . . . 0 N--CA 1.5 2.059 0 CA-C-O 117.872 -1.061 . . . . 0.0 110.533 -179.996 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.443 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.5 p -109.73 58.52 0.61 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.489 -1.006 . . . . 0.0 110.557 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.425 HD23 ' N ' ' A' ' 4' ' ' GLY . 3.4 tt -81.79 132.3 35.28 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.316 -0.865 . . . . 0.0 109.988 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.425 ' N ' HD23 ' A' ' 3' ' ' LEU . . . 116.26 -30.19 6.63 Favored Glycine 0 N--CA 1.496 2.679 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.67 140.55 57.43 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.369 -1.077 . . . . 0.0 110.144 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -82.08 136.84 35.14 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.337 -0.852 . . . . 0.0 110.519 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.7 p -115.45 106.84 14.43 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.61 -0.681 . . . . 0.0 110.13 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -149.55 -48.84 0.14 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.672 -0.643 . . . . 0.0 110.514 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -70.06 -50.11 44.41 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.489 -0.757 . . . . 0.0 109.978 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -101.7 -30.33 11.39 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.599 -0.688 . . . . 0.0 110.605 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 t30 54.76 50.66 15.28 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.574 -0.704 . . . . 0.0 110.282 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -152.4 90.43 0.13 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.114 -1.594 . . . . 0.0 109.114 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 63.3 m -79.86 -160.6 0.28 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.669 -0.9 . . . . 0.0 110.448 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.6 m -75.74 173.41 11.15 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.429 -0.794 . . . . 0.0 110.358 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 p -64.02 123.94 20.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.36 -0.838 . . . . 0.0 109.918 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.61 -21.86 43.85 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -92.89 120.24 33.02 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.199 -1.177 . . . . 0.0 110.138 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 t -100.59 163.77 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.61 -0.681 . . . . 0.0 109.872 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t -91.21 108.76 20.09 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.551 -0.718 . . . . 0.0 110.144 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.446 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -66.32 146.2 54.86 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.52 -0.738 . . . . 0.0 110.174 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.44 -29.54 17.91 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.481 -0.762 . . . . 0.0 110.918 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.464 HG22 ' CE3' ' A' ' 23' ' ' TRP . 41.3 m -78.15 -49.43 13.87 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.287 -0.883 . . . . 0.0 110.927 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CB ' ' CE3' ' A' ' 25' ' ' TRP . 6.9 m95 -96.08 -18.1 20.42 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.337 -0.852 . . . . 0.0 110.83 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 15.0 mttt 63.76 31.36 14.27 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.645 -0.66 . . . . 0.0 111.837 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.671 ' NE1' HG22 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -121.65 162.13 21.25 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 120.987 -1.071 . . . . 0.0 109.666 178.339 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.414 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 84.7 m -71.62 104.74 3.42 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.364 -0.835 . . . . 0.0 110.892 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.671 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.9 OUTLIER -106.53 161.08 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.541 -0.724 . . . . 0.0 109.69 179.808 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.33 149.05 50.96 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.367 -0.833 . . . . 0.0 110.285 179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.58 66.72 9.67 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.442 -0.786 . . . . 0.0 110.539 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.94 -78.68 1.23 Allowed Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -75.15 -170.58 0.81 Allowed 'Trans proline' 0 C--N 1.314 -1.279 0 O-C-N 124.022 1.538 . . . . 0.0 110.528 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 . . . . . 0 N--CA 1.498 1.955 0 O-C-N 121.237 -0.915 . . . . 0.0 110.31 179.969 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.404 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.7 p -101.26 57.1 0.85 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.387 -1.066 . . . . 0.0 110.369 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.59 113.64 10.94 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.406 -0.809 . . . . 0.0 110.297 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.51 -21.64 4.25 Favored Glycine 0 N--CA 1.495 2.621 0 N-CA-C 110.319 -1.113 . . . . 0.0 110.319 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.82 123.75 17.51 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.277 -1.131 . . . . 0.0 110.277 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -69.27 135.07 49.95 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.479 -0.763 . . . . 0.0 110.794 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -121.13 146.06 47.16 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.645 -0.659 . . . . 0.0 109.826 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -133.86 -45.57 0.8 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.446 -0.784 . . . . 0.0 110.847 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -169.91 -55.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.327 -0.858 . . . . 0.0 109.826 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -104.63 22.11 15.62 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.675 -0.641 . . . . 0.0 110.584 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.0 t30 -74.49 -59.71 2.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.189 -0.944 . . . . 0.0 110.045 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.25 105.98 0.67 Allowed Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 69.1 m -81.05 179.02 8.05 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.525 -0.985 . . . . 0.0 110.324 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 76.7 m -75.0 174.07 9.84 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.434 -0.791 . . . . 0.0 110.409 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.7 m -66.34 119.32 11.37 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.443 -0.786 . . . . 0.0 109.831 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.97 -22.67 39.19 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -89.59 147.98 23.62 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.284 -1.127 . . . . 0.0 109.942 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.42 ' CG1' ' HB2' ' A' ' 29' ' ' ALA . 27.6 m -130.15 151.46 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.607 -0.683 . . . . 0.0 110.425 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 13' ' ' CYS . 73.8 m -73.45 103.28 4.04 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.464 -0.772 . . . . 0.0 109.985 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.2 t -73.86 137.63 43.88 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.412 -0.805 . . . . 0.0 110.24 -179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.67 -26.68 27.61 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.52 -0.738 . . . . 0.0 110.341 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.9 m -73.39 -45.61 53.75 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.416 -0.802 . . . . 0.0 110.28 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.789 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 5.8 m95 -100.12 -13.43 18.98 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.385 -0.822 . . . . 0.0 111.222 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.6 OUTLIER 62.76 31.66 16.43 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.529 -0.732 . . . . 0.0 111.938 179.78 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.789 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -141.97 160.82 39.44 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.022 -1.049 . . . . 0.0 109.853 178.344 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.401 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 71.0 m -66.49 107.39 2.05 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.349 -0.844 . . . . 0.0 111.473 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.662 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.9 OUTLIER -117.38 172.5 5.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.51 -0.744 . . . . 0.0 109.467 179.268 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.43 ' HA ' HD22 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -73.1 131.27 41.87 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.165 -0.959 . . . . 0.0 110.154 179.669 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.42 ' HB2' ' CG1' ' A' ' 18' ' ' VAL . . . -66.91 124.4 22.88 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.48 -0.762 . . . . 0.0 110.49 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -149.72 159.28 28.02 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -72.92 158.75 49.41 Favored 'Trans proline' 0 C--N 1.313 -1.304 0 O-C-N 123.976 1.514 . . . . 0.0 110.782 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 43.0 m0 . . . . . 0 N--CA 1.502 2.144 0 CA-C-O 118.626 -0.702 . . . . 0.0 110.471 -179.908 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.409 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 89.7 m -103.58 9.66 37.33 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.473 -1.016 . . . . 0.0 111.077 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.8 97.73 0.85 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.093 -1.004 . . . . 0.0 109.918 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.22 -22.47 3.57 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.56 128.18 34.79 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.256 -1.144 . . . . 0.0 110.084 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.81 159.27 32.16 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.479 -0.763 . . . . 0.0 110.238 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.43 156.05 38.68 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.538 -0.726 . . . . 0.0 110.101 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -130.98 -65.91 0.77 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.475 -0.766 . . . . 0.0 110.393 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -164.46 -51.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.401 -0.812 . . . . 0.0 110.767 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -94.3 9.84 36.53 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.402 -0.812 . . . . 0.0 111.19 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 58.09 70.32 0.66 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.359 -0.838 . . . . 0.0 110.29 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -87.93 59.36 4.25 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 87.2 m -89.61 178.6 6.24 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.496 -1.003 . . . . 0.0 109.897 179.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.1 m -75.52 179.81 5.07 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.177 -0.952 . . . . 0.0 110.62 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.5 m -68.56 112.58 5.44 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.549 -0.72 . . . . 0.0 109.996 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.77 -7.07 67.71 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.106 -1.197 . . . . 0.0 110.106 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.486 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 3.6 m-85 -91.21 137.49 32.32 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.192 -1.181 . . . . 0.0 110.1 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.2 t -123.82 164.04 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.43 -0.794 . . . . 0.0 110.412 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' TRP . 11.7 t -85.23 119.45 25.62 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.454 -0.779 . . . . 0.0 110.299 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.47 ' CB ' ' CZ3' ' A' ' 25' ' ' TRP . 0.6 OUTLIER -83.39 166.81 18.1 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.493 -0.754 . . . . 0.0 110.599 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.64 -24.4 20.51 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.533 -0.73 . . . . 0.0 111.194 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.5 m -62.48 -81.6 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.274 -0.891 . . . . 0.0 110.851 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.591 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 37.9 m95 -89.52 4.08 50.39 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.201 -0.937 . . . . 0.0 110.738 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 20' ' ' SER . 18.0 mtpt 52.53 62.69 2.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.333 -0.855 . . . . 0.0 110.114 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.591 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.4 p90 -144.32 175.4 10.12 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.466 -0.771 . . . . 0.0 110.66 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.8 m -81.53 122.51 27.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.465 -0.772 . . . . 0.0 110.281 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.456 HG22 ' N ' ' A' ' 28' ' ' LEU . 2.0 p -134.39 166.83 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.573 -0.704 . . . . 0.0 110.079 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.456 ' N ' HG22 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -73.24 139.02 45.91 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.883 -0.511 . . . . 0.0 110.51 -179.853 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.36 166.98 19.97 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.482 -0.761 . . . . 0.0 110.499 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 140.82 171.44 12.53 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -78.14 171.99 63.87 Favored 'Cis proline' 0 C--N 1.317 -1.13 0 C-N-CA 121.713 -2.203 . . . . 0.0 110.591 -0.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 . . . . . 0 N--CA 1.496 1.85 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.43 179.802 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.593 0 N-CA-C 110.036 -1.225 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 65.2 m -124.83 51.23 1.66 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.399 -1.059 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.64 103.96 16.41 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.272 -0.892 . . . . 0.0 109.829 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.41 -18.33 3.93 Favored Glycine 0 N--CA 1.495 2.584 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.28 121.57 8.52 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.475 -1.014 . . . . 0.0 110.274 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.86 141.54 47.95 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.312 -0.867 . . . . 0.0 110.715 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.62 141.75 58.35 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.608 -0.682 . . . . 0.0 110.129 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -106.84 -66.47 1.01 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.373 -0.829 . . . . 0.0 110.694 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -141.1 -60.45 0.49 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.231 -0.918 . . . . 0.0 110.309 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -98.01 -35.13 10.54 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.523 -0.736 . . . . 0.0 109.947 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -167.35 -65.16 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.644 -0.66 . . . . 0.0 109.916 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 67.88 36.02 85.88 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 109.852 -1.299 . . . . 0.0 109.852 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 48.4 m -120.55 -179.56 4.02 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.527 -0.984 . . . . 0.0 110.162 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 62.1 m -99.5 177.21 5.24 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.427 -0.796 . . . . 0.0 110.047 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.3 m -62.79 124.62 21.5 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.393 -0.817 . . . . 0.0 110.288 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.07 14.32 60.79 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -128.17 125.15 38.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.138 -1.213 . . . . 0.0 110.409 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.759 HG23 ' HB2' ' A' ' 29' ' ' ALA . 3.1 t -103.04 159.68 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.521 -0.737 . . . . 0.0 109.549 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.69 116.51 24.01 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.371 -0.83 . . . . 0.0 109.969 179.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.438 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -75.51 127.46 33.14 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.55 -0.719 . . . . 0.0 110.475 -179.804 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -80.94 -12.7 59.35 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.476 -0.765 . . . . 0.0 110.192 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.8 m -89.99 -45.98 8.82 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.377 -0.827 . . . . 0.0 109.988 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.716 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.2 m95 -97.58 -11.53 23.55 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.528 -0.732 . . . . 0.0 110.926 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.88 22.86 11.37 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.446 -0.784 . . . . 0.0 112.032 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.716 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -131.97 155.13 48.51 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.866 -1.146 . . . . 0.0 109.912 178.6 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 18' ' ' VAL . 68.4 m -72.81 109.36 6.35 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.468 -0.77 . . . . 0.0 110.841 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.686 HG22 ' NE1' ' A' ' 25' ' ' TRP . 2.8 t -99.23 167.58 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.523 -0.736 . . . . 0.0 109.692 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.97 132.44 47.3 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.286 -0.884 . . . . 0.0 110.622 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.759 ' HB2' HG23 ' A' ' 18' ' ' VAL . . . -88.57 170.43 10.86 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.655 -0.653 . . . . 0.0 110.717 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -156.49 -178.44 30.61 Favored Glycine 0 N--CA 1.496 2.663 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -76.4 145.78 82.94 Favored 'Cis proline' 0 C--N 1.315 -1.203 0 C-N-CA 121.759 -2.184 . . . . 0.0 110.613 -0.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 48.2 t-105 . . . . . 0 N--CA 1.494 1.754 0 CA-C-O 117.85 -1.072 . . . . 0.0 110.534 179.86 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.472 0 N-CA-C 109.731 -1.347 . . . . 0.0 109.731 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.7 m -107.76 38.16 2.24 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.481 -1.011 . . . . 0.0 110.379 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' A' ' 27' ' ' VAL . 11.3 tp -72.5 109.43 6.17 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.306 -0.871 . . . . 0.0 110.193 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.87 -22.48 6.82 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 110.108 -1.197 . . . . 0.0 110.108 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.8 118.33 7.57 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.284 -1.127 . . . . 0.0 109.963 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -64.58 146.6 54.39 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.223 -0.923 . . . . 0.0 109.849 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 98.0 m -63.89 161.93 14.67 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.383 -0.823 . . . . 0.0 110.032 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.5 -82.64 0.39 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.207 -0.933 . . . . 0.0 109.941 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -115.74 -55.54 2.42 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.454 -0.779 . . . . 0.0 109.502 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -121.38 -27.21 4.87 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.636 -0.665 . . . . 0.0 110.485 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -176.82 84.19 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.36 -0.837 . . . . 0.0 109.82 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -97.58 64.08 0.92 Allowed Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 67.0 m -126.15 144.84 50.6 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.633 -0.922 . . . . 0.0 110.294 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 28.6 p -69.61 166.17 19.6 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.489 -0.757 . . . . 0.0 110.336 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.87 129.15 38.4 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.466 -0.771 . . . . 0.0 110.524 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.5 -27.65 17.29 Favored Glycine 0 N--CA 1.494 2.538 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -108.28 134.67 50.78 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.275 -1.132 . . . . 0.0 110.361 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.3 m -103.98 149.36 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.487 -0.758 . . . . 0.0 110.701 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.3 t -75.37 113.83 13.2 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.524 -0.735 . . . . 0.0 110.329 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.503 ' HB2' ' O ' ' A' ' 25' ' ' TRP . 0.3 OUTLIER -82.4 126.12 31.82 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.416 -0.802 . . . . 0.0 110.044 179.634 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.7 mtt-85 -80.86 -23.4 39.09 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.343 -0.848 . . . . 0.0 110.411 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.455 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 25.4 m -77.02 -46.84 22.41 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.441 -0.787 . . . . 0.0 110.165 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.741 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.7 m95 -97.26 -6.18 35.09 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.487 -0.758 . . . . 0.0 110.741 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 4.1 mmmm 58.37 26.06 13.6 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.583 -0.698 . . . . 0.0 111.582 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.741 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -134.12 152.96 52.08 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.1 -1.0 . . . . 0.0 109.855 178.841 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.7 m -71.15 109.62 5.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.366 -0.834 . . . . 0.0 110.729 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.636 ' HA ' HD12 ' A' ' 3' ' ' LEU . 2.1 t -99.97 159.45 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 121.469 -0.77 . . . . 0.0 109.939 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.457 HD23 HD13 ' A' ' 3' ' ' LEU . 1.5 pp -74.11 146.82 43.26 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.382 -0.824 . . . . 0.0 110.563 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -105.87 120.55 42.03 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.594 -0.691 . . . . 0.0 109.852 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.482 ' HA3' ' HA ' ' A' ' 31' ' ' PRO . . . -170.9 -128.36 1.02 Allowed Glycine 0 N--CA 1.494 2.552 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.482 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 46.9 Cg_endo -72.96 161.87 92.81 Favored 'Cis proline' 0 N--CA 1.49 1.274 0 C-N-CA 121.866 -2.139 . . . . 0.0 110.875 0.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.901 0 CA-C-O 117.861 -1.066 . . . . 0.0 110.61 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.462 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 86.4 m -103.18 20.67 17.25 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.44 -1.036 . . . . 0.0 110.915 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.97 111.02 12.07 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.031 -1.043 . . . . 0.0 109.892 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.16 -25.78 3.3 Favored Glycine 0 N--CA 1.494 2.567 0 N-CA-C 109.826 -1.31 . . . . 0.0 109.826 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -66.99 118.2 10.12 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.411 -1.052 . . . . 0.0 110.287 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 25' ' ' TRP . 8.7 mptt -70.27 150.3 46.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.448 -0.783 . . . . 0.0 110.584 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.0 m -75.72 179.3 5.5 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.533 -0.729 . . . . 0.0 110.208 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -137.62 -58.32 0.68 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.381 -0.824 . . . . 0.0 110.675 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -154.74 -53.21 0.09 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.402 -0.811 . . . . 0.0 110.731 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -94.29 10.05 35.66 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.445 -0.784 . . . . 0.0 111.417 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 52.46 67.17 1.02 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.344 -0.847 . . . . 0.0 109.938 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -93.5 62.15 2.04 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 16.7 m -79.42 163.62 24.65 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.502 -0.999 . . . . 0.0 109.681 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 40.0 m -61.9 166.59 4.4 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.309 -0.869 . . . . 0.0 110.783 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.8 p -64.71 128.23 34.91 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.359 -0.838 . . . . 0.0 109.98 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.5 6.82 62.31 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -120.42 153.73 36.15 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.196 -1.179 . . . . 0.0 110.01 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.22 147.02 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.39 -0.819 . . . . 0.0 110.328 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.8 t -81.13 119.43 23.56 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.445 -0.784 . . . . 0.0 110.154 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.483 ' HB3' ' CZ3' ' A' ' 25' ' ' TRP . 0.4 OUTLIER -89.42 154.44 20.05 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.487 -0.758 . . . . 0.0 110.333 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -11.7 39.25 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.428 -0.795 . . . . 0.0 111.199 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.461 HG22 ' CE2' ' A' ' 23' ' ' TRP . 6.2 m -69.29 -65.17 0.74 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.259 -0.901 . . . . 0.0 110.267 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.582 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 9.0 m95 -106.93 5.33 28.17 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.414 -0.804 . . . . 0.0 110.423 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.2 mttm 54.37 62.83 2.39 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.436 -0.79 . . . . 0.0 110.801 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.71 ' CE2' HG22 ' A' ' 27' ' ' VAL . 0.8 OUTLIER -148.83 171.31 16.49 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.331 -0.856 . . . . 0.0 110.579 179.664 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.9 m -77.51 129.98 36.38 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.51 -0.744 . . . . 0.0 110.716 -179.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.71 HG22 ' CE2' ' A' ' 25' ' ' TRP . 1.8 t -126.44 167.93 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.557 -0.714 . . . . 0.0 109.829 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -66.85 141.95 57.5 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.301 -0.874 . . . . 0.0 110.102 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.79 97.86 6.81 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.508 -0.745 . . . . 0.0 110.254 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.4 ' HA3' ' C ' ' A' ' 31' ' ' PRO . . . -133.66 -92.61 0.48 Allowed Glycine 0 N--CA 1.493 2.485 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.4 ' C ' ' HA3' ' A' ' 30' ' ' GLY . 50.8 Cg_endo -77.51 158.76 95.15 Favored 'Cis proline' 0 N--CA 1.487 1.099 0 C-N-CA 121.778 -2.176 . . . . 0.0 110.563 -0.486 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.797 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.569 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.354 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 56.4 m -92.82 -17.35 24.23 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.398 -1.06 . . . . 0.0 110.896 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.509 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 0.5 OUTLIER -61.79 112.56 2.33 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.17 -0.956 . . . . 0.0 110.119 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.14 -27.43 4.81 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.15 113.08 3.31 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.446 -1.032 . . . . 0.0 110.105 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -66.39 130.73 44.2 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.514 -0.741 . . . . 0.0 110.598 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 t -110.47 140.47 44.7 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.529 -0.732 . . . . 0.0 109.988 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -151.04 -58.76 0.17 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.553 -0.717 . . . . 0.0 110.979 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -104.99 -75.05 0.63 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.359 -0.838 . . . . 0.0 110.685 -179.47 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -137.38 56.65 1.77 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.279 -0.888 . . . . 0.0 110.247 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.44 -51.62 49.32 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.447 -0.783 . . . . 0.0 110.196 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 74.78 92.47 0.16 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 179.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.7 m -83.63 164.43 19.71 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.515 -0.991 . . . . 0.0 109.941 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 26.3 p -77.3 177.02 8.25 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.371 -0.831 . . . . 0.0 110.701 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 73.3 p -58.38 140.3 53.87 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.378 -0.826 . . . . 0.0 110.697 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.3 1.98 89.29 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 -179.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -133.09 137.75 46.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.162 -1.199 . . . . 0.0 110.23 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 30.2 m -139.78 160.08 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.475 -0.765 . . . . 0.0 110.544 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -72.26 112.17 8.1 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.46 -0.775 . . . . 0.0 109.924 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.565 ' HB3' ' HB2' ' A' ' 23' ' ' TRP . 8.7 t -89.56 158.1 17.79 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.347 -0.846 . . . . 0.0 110.819 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -88.73 -47.84 7.95 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.54 -0.725 . . . . 0.0 109.686 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 50.9 m -65.72 -38.68 89.84 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.642 -0.661 . . . . 0.0 110.005 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.565 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 6.8 m95 -90.47 -32.03 16.54 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.614 -0.679 . . . . 0.0 110.593 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 66.44 27.87 9.74 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.525 -0.734 . . . . 0.0 111.384 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.586 ' NE1' HG22 ' A' ' 27' ' ' VAL . 1.2 p90 -150.5 175.21 12.1 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.188 -0.945 . . . . 0.0 109.738 178.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.509 ' O ' ' HA ' ' A' ' 3' ' ' LEU . 77.8 m -71.63 100.32 2.27 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.094 -1.004 . . . . 0.0 109.525 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.586 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.6 OUTLIER -106.53 157.04 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.479 -0.763 . . . . 0.0 110.186 -179.287 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.27 135.94 57.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.658 -0.651 . . . . 0.0 110.166 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -93.63 59.59 2.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.458 -0.776 . . . . 0.0 110.411 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -92.18 178.94 40.6 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.427 ' O ' ' CB ' ' A' ' 32' ' ' TRP . 46.9 Cg_endo -73.72 162.51 91.93 Favored 'Cis proline' 0 N--CA 1.488 1.204 0 C-N-CA 121.616 -2.243 . . . . 0.0 110.57 0.084 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.427 ' CB ' ' O ' ' A' ' 31' ' ' PRO . 1.0 OUTLIER . . . . . 0 N--CA 1.503 2.211 0 CA-C-O 117.726 -1.13 . . . . 0.0 110.695 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.361 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 59.2 m -105.44 29.11 6.76 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.471 -1.017 . . . . 0.0 110.606 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.475 HD12 ' HE1' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -84.76 109.64 18.21 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.345 -0.847 . . . . 0.0 109.77 179.658 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 136.09 -21.43 3.51 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.871 -1.292 . . . . 0.0 109.871 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -66.66 110.68 3.31 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.236 -1.155 . . . . 0.0 109.753 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -65.35 149.36 50.11 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.439 -0.788 . . . . 0.0 110.642 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.533 ' HB2' ' HB3' ' A' ' 11' ' ' ASN . 29.7 p -149.06 157.62 43.55 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.537 -0.727 . . . . 0.0 110.325 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -118.55 -60.06 1.81 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.424 -0.797 . . . . 0.0 110.638 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -146.5 -57.51 0.28 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.33 -0.856 . . . . 0.0 110.687 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -106.33 38.78 1.96 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.42 -0.8 . . . . 0.0 110.592 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.533 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 28.4 t-20 -73.26 -57.7 3.83 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.232 -0.918 . . . . 0.0 109.965 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 92.66 95.77 1.42 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 71.4 m -90.9 -176.99 4.83 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.494 -1.004 . . . . 0.0 110.262 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.0 m -73.58 158.21 35.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.387 -0.821 . . . . 0.0 109.765 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 71.1 p -56.65 121.98 11.0 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.388 -0.82 . . . . 0.0 110.166 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.62 -23.19 30.45 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.475 ' HE1' HD12 ' A' ' 3' ' ' LEU . 15.9 m-85 -93.63 143.7 26.06 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.271 -1.135 . . . . 0.0 110.358 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 32.8 m -130.89 160.3 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.452 -0.78 . . . . 0.0 110.304 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -77.48 119.19 20.73 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.391 -0.818 . . . . 0.0 110.226 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.6 ' HB3' ' HB2' ' A' ' 23' ' ' TRP . 28.7 t -90.79 153.43 20.25 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.529 -0.732 . . . . 0.0 110.404 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.79 -49.66 9.49 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.348 -0.845 . . . . 0.0 109.57 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.2 m -66.61 -44.46 82.06 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.505 -0.747 . . . . 0.0 109.912 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.62 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 5.8 m95 -81.7 -31.02 32.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.67 -0.644 . . . . 0.0 110.73 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.3 OUTLIER 62.06 25.21 15.09 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.344 -0.847 . . . . 0.0 111.226 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.701 ' NE1' HG22 ' A' ' 27' ' ' VAL . 1.3 p90 -144.45 176.65 9.22 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.105 -0.997 . . . . 0.0 109.913 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.2 m -70.84 101.0 2.03 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.246 -0.909 . . . . 0.0 110.338 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.701 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.8 OUTLIER -113.11 158.28 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.621 -0.674 . . . . 0.0 109.517 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.2 128.01 34.79 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.07 139.96 57.6 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.462 -0.774 . . . . 0.0 110.429 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -145.78 -167.05 12.28 Favored Glycine 0 N--CA 1.495 2.608 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -75.68 174.9 50.42 Favored 'Cis proline' 0 N--CA 1.489 1.246 0 C-N-CA 121.645 -2.231 . . . . 0.0 110.833 -0.145 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 2.9 m95 . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.427 179.979 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.57 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 95.5 m -99.62 0.53 42.29 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.275 -1.132 . . . . 0.0 110.966 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 tt -72.98 101.17 3.15 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.138 -0.976 . . . . 0.0 110.043 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 134.13 -16.75 4.39 Favored Glycine 0 N--CA 1.494 2.505 0 N-CA-C 110.021 -1.231 . . . . 0.0 110.021 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -61.51 123.66 18.47 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.367 -1.078 . . . . 0.0 110.441 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -66.97 149.22 50.93 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.54 -0.725 . . . . 0.0 111.097 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.53 154.92 31.0 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.541 -0.724 . . . . 0.0 110.137 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.3 -65.27 1.19 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.441 -0.787 . . . . 0.0 110.257 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -129.7 -67.76 0.74 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.506 -0.746 . . . . 0.0 109.821 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -118.76 -17.16 9.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.548 -0.72 . . . . 0.0 110.644 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -149.45 -66.58 0.22 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.157 -0.964 . . . . 0.0 110.173 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 55.58 37.68 68.49 Favored Glycine 0 N--CA 1.495 2.585 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 95.5 m -128.48 170.58 12.99 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.475 -1.015 . . . . 0.0 110.669 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 86.4 m -87.06 176.02 7.82 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.532 -0.73 . . . . 0.0 109.862 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.05 116.29 6.31 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.329 -0.857 . . . . 0.0 109.917 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 102.51 7.52 45.37 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -125.08 137.84 54.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.228 -1.16 . . . . 0.0 110.096 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.4 t -118.27 162.64 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.364 -0.835 . . . . 0.0 110.22 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 11.2 t -77.11 117.31 18.54 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.452 -0.78 . . . . 0.0 109.967 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 t -71.6 133.57 45.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.605 -0.685 . . . . 0.0 110.453 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -15.06 53.63 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.367 -0.833 . . . . 0.0 110.178 179.319 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.465 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 21.1 m -94.81 -46.02 7.07 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.402 -0.811 . . . . 0.0 110.491 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CB ' ' CE3' ' A' ' 25' ' ' TRP . 6.8 m95 -101.03 -13.11 18.37 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.411 -0.806 . . . . 0.0 111.093 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 8.3 mmtt 66.5 15.48 10.12 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.582 -0.698 . . . . 0.0 111.916 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.653 ' CE2' HG12 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -117.54 157.66 25.95 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.893 -1.13 . . . . 0.0 109.633 178.773 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.5 m -62.59 101.41 0.25 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.467 -0.771 . . . . 0.0 111.076 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.653 HG12 ' CE2' ' A' ' 25' ' ' TRP . 11.4 m -102.53 153.85 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.581 -0.699 . . . . 0.0 109.829 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 tp -68.0 138.87 56.22 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.519 -0.738 . . . . 0.0 110.582 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.21 121.87 13.64 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.64 -0.662 . . . . 0.0 110.519 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' A' ' 31' ' ' PRO . . . -134.53 -155.81 7.61 Favored Glycine 0 N--CA 1.497 2.736 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.456 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 51.8 Cg_endo -78.42 -165.3 4.5 Favored 'Cis proline' 0 N--CA 1.489 1.237 0 C-N-CA 122.073 -2.053 . . . . 0.0 110.798 -0.261 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 . . . . . 0 N--CA 1.5 2.027 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.694 -179.938 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.484 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.472 ' HB2' ' CG ' ' A' ' 17' ' ' TYR . 61.5 m -109.21 8.04 25.65 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.557 -0.967 . . . . 0.0 110.986 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.534 HD12 ' HE2' ' A' ' 17' ' ' TYR . 0.9 OUTLIER -69.36 131.74 45.29 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.037 -1.04 . . . . 0.0 110.116 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 112.24 -24.58 13.92 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -61.49 118.82 7.49 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.404 -1.056 . . . . 0.0 110.158 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -70.58 139.48 51.46 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.433 -0.792 . . . . 0.0 110.754 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.451 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 69.8 m -121.06 177.32 5.17 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.628 -0.67 . . . . 0.0 110.226 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -131.18 -57.81 1.01 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.466 -0.771 . . . . 0.0 110.172 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -148.64 -60.66 0.24 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.533 -0.73 . . . . 0.0 109.976 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -129.93 38.15 3.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 0.0 110.098 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -54.18 -51.27 64.9 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.554 -0.716 . . . . 0.0 110.107 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.45 94.74 0.54 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.53 -175.2 5.07 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.447 -1.031 . . . . 0.0 109.884 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.0 p -60.72 157.41 14.8 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.262 -0.899 . . . . 0.0 110.297 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 m -55.77 125.34 20.84 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.486 -0.759 . . . . 0.0 110.301 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 113.33 -20.52 18.66 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.534 ' HE2' HD12 ' A' ' 3' ' ' LEU . 6.6 m-85 -113.37 152.72 29.62 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.286 -1.126 . . . . 0.0 110.58 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.15 138.59 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.606 -0.684 . . . . 0.0 110.405 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.1 m -74.92 119.6 19.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.446 -0.784 . . . . 0.0 109.889 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 89.9 p -81.36 132.59 35.34 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.461 -0.775 . . . . 0.0 110.772 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -80.32 -13.66 59.0 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.507 -0.746 . . . . 0.0 110.304 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.521 HG22 ' CE3' ' A' ' 23' ' ' TRP . 53.1 m -90.82 -49.21 6.57 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.338 -0.851 . . . . 0.0 110.181 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.747 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 6.7 m95 -92.27 -15.99 26.71 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.408 -0.808 . . . . 0.0 110.81 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 6.3 mtmm 65.6 31.16 10.13 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.695 -0.628 . . . . 0.0 111.681 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.747 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -139.05 155.12 48.18 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.13 -0.981 . . . . 0.0 109.348 178.164 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 3' ' ' LEU . 58.5 m -70.12 112.38 6.44 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.34 -0.85 . . . . 0.0 110.933 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.617 HG22 ' NE1' ' A' ' 25' ' ' TRP . 1.3 t -108.94 167.48 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.37 -0.831 . . . . 0.0 109.764 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 tp -70.62 141.38 51.73 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.39 -0.818 . . . . 0.0 110.176 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.97 130.94 44.99 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.506 -0.746 . . . . 0.0 110.358 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.05 -173.05 35.87 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -75.61 154.03 98.59 Favored 'Cis proline' 0 C--N 1.315 -1.192 0 C-N-CA 121.549 -2.271 . . . . 0.0 110.721 -0.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.801 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.174 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 87.3 m -100.65 28.77 4.88 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.341 -1.093 . . . . 0.0 110.632 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.7 tt -80.42 113.86 18.91 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.186 -0.946 . . . . 0.0 109.928 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.66 -31.33 2.67 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -56.47 124.69 19.04 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.514 -0.992 . . . . 0.0 110.253 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.61 149.51 49.99 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.342 -0.849 . . . . 0.0 110.702 -179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.9 m -67.71 157.38 34.76 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.579 -0.701 . . . . 0.0 109.713 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -114.83 -75.42 0.59 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.373 -0.83 . . . . 0.0 110.331 -179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -140.3 -59.48 0.53 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.261 -0.899 . . . . 0.0 110.053 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.91 -33.22 12.27 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.511 -0.743 . . . . 0.0 109.983 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -165.14 -67.26 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.605 -0.685 . . . . 0.0 109.914 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 65.98 35.9 91.31 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.2 m -131.78 172.37 12.37 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.523 -0.986 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.2 m -79.41 176.59 9.55 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.467 -0.77 . . . . 0.0 110.24 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.0 m -67.23 117.13 8.82 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.415 -0.803 . . . . 0.0 110.217 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 102.42 -14.63 56.61 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.279 -1.129 . . . . 0.0 110.279 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -91.6 129.8 37.51 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.078 -1.248 . . . . 0.0 110.484 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.4 t -97.37 168.47 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.609 -0.682 . . . . 0.0 110.178 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.25 118.54 37.04 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.254 -0.904 . . . . 0.0 110.46 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.538 ' HB2' ' CZ3' ' A' ' 25' ' ' TRP . 4.4 m -91.05 151.39 21.05 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.551 -0.718 . . . . 0.0 110.343 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.28 -19.19 24.38 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.313 -0.867 . . . . 0.0 111.527 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 66.4 m -57.11 -73.16 0.07 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.163 -0.96 . . . . 0.0 110.209 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.556 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 40.4 m95 -96.44 0.21 50.09 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 179.295 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.82 68.77 0.79 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.383 -0.823 . . . . 0.0 110.569 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.556 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -155.25 178.23 10.45 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.296 -0.878 . . . . 0.0 110.786 179.666 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.9 m -85.39 138.07 32.51 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.438 -0.789 . . . . 0.0 111.392 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.467 ' CG1' ' CZ2' ' A' ' 25' ' ' TRP . 2.7 m -127.02 140.3 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.74 -0.6 . . . . 0.0 110.015 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.2 tp -67.67 124.59 23.7 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.314 -0.866 . . . . 0.0 109.856 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.87 101.85 0.13 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.637 -0.665 . . . . 0.0 110.3 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.466 ' HA2' ' C ' ' A' ' 31' ' ' PRO . . . -127.73 161.28 21.74 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.466 ' C ' ' HA2' ' A' ' 30' ' ' GLY . 47.8 Cg_endo -73.36 157.47 99.13 Favored 'Cis proline' 0 N--CA 1.49 1.314 0 C-N-CA 121.774 -2.177 . . . . 0.0 110.794 -0.13 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.498 1.947 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.477 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.475 ' HB2' ' CG ' ' A' ' 17' ' ' TYR . 85.7 m -95.09 3.71 54.49 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.516 -0.991 . . . . 0.0 110.933 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.6 tp -64.57 114.02 4.1 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.133 -0.979 . . . . 0.0 109.97 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.95 -28.62 5.35 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -57.81 140.73 51.04 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.387 -1.067 . . . . 0.0 109.968 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.9 mmmt -85.75 141.05 29.98 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.432 -0.793 . . . . 0.0 110.838 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.2 t -133.96 142.96 47.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.733 -0.605 . . . . 0.0 109.467 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.65 -51.8 9.35 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.424 -0.798 . . . . 0.0 110.341 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -157.27 -57.05 0.08 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.502 -0.749 . . . . 0.0 110.229 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -146.81 43.35 1.16 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.448 -0.783 . . . . 0.0 110.074 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -54.51 -53.54 52.95 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.467 -0.771 . . . . 0.0 110.272 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.66 84.11 0.54 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.4 t -79.6 173.38 12.64 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.513 -0.992 . . . . 0.0 109.682 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.7 p -59.24 162.15 4.81 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.276 -0.89 . . . . 0.0 110.634 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -55.12 129.87 39.78 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.56 -0.712 . . . . 0.0 110.774 -179.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.98 7.17 56.61 Favored Glycine 0 N--CA 1.494 2.564 0 N-CA-C 110.699 -0.96 . . . . 0.0 110.699 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.475 ' CG ' ' HB2' ' A' ' 2' ' ' CYS . 26.9 m-85 -136.31 138.16 41.41 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.05 -1.265 . . . . 0.0 110.808 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.463 ' O ' HG22 ' A' ' 27' ' ' VAL . 12.5 t -125.18 166.77 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.641 -0.662 . . . . 0.0 109.913 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 72.7 m -90.44 114.42 26.57 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.306 -0.871 . . . . 0.0 110.126 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.492 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 10.8 t -75.17 159.12 31.98 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.452 -0.78 . . . . 0.0 110.616 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.1 ttp85 -90.89 -22.71 20.78 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.471 -0.768 . . . . 0.0 110.954 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.509 HG22 ' CD2' ' A' ' 23' ' ' TRP . 62.7 m -69.48 -82.65 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.201 -0.937 . . . . 0.0 110.928 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.684 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 14.3 m95 -85.08 -0.13 53.49 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.07 -1.019 . . . . 0.0 110.812 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER 56.67 63.95 1.81 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.323 -0.86 . . . . 0.0 110.811 179.772 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.684 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.5 p90 -145.95 176.88 9.36 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.273 -0.892 . . . . 0.0 110.395 179.153 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.7 m -78.59 122.79 26.36 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.261 -0.899 . . . . 0.0 111.117 -178.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.61 HG12 ' CZ2' ' A' ' 25' ' ' TRP . 24.2 m -115.13 151.34 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.686 -0.634 . . . . 0.0 110.06 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.7 mt -68.11 118.47 11.31 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.336 -0.852 . . . . 0.0 110.04 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.32 132.27 47.38 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.498 -0.751 . . . . 0.0 110.375 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.423 ' HA3' ' HA ' ' A' ' 31' ' ' PRO . . . 139.59 -150.84 21.63 Favored Glycine 0 N--CA 1.493 2.498 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.423 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 47.7 Cg_endo -74.53 149.89 94.64 Favored 'Cis proline' 0 N--CA 1.49 1.274 0 C-N-CA 121.912 -2.12 . . . . 0.0 110.73 -0.015 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 29.9 t-105 . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.339 179.871 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 109.454 -1.459 . . . . 0.0 109.454 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 67.1 m -98.73 -5.86 30.6 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.501 -0.999 . . . . 0.0 110.878 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.42 119.09 10.38 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.106 -0.997 . . . . 0.0 109.846 179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.39 -23.11 4.9 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.77 132.37 50.72 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.309 -1.112 . . . . 0.0 109.879 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -81.01 149.72 29.18 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.42 -0.8 . . . . 0.0 110.3 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.0 p -149.94 165.19 33.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.476 -0.765 . . . . 0.0 110.601 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -135.45 -57.85 0.79 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.584 -0.698 . . . . 0.0 110.34 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -139.27 -59.21 0.58 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.35 -0.844 . . . . 0.0 110.336 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -120.87 41.63 3.24 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.474 -0.766 . . . . 0.0 110.233 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -62.8 -53.85 47.92 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.355 -0.841 . . . . 0.0 110.008 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 107.9 75.85 0.93 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 98.8 m -79.25 169.93 17.38 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.439 -1.036 . . . . 0.0 109.389 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.0 m -67.68 161.95 24.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.251 -0.906 . . . . 0.0 110.017 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.5 p -58.8 120.41 8.93 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.404 -0.81 . . . . 0.0 109.907 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.99 -17.53 44.68 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.442 ' HA ' ' O ' ' A' ' 27' ' ' VAL . 27.8 m-85 -95.05 147.41 23.44 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.24 -1.153 . . . . 0.0 110.283 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 t -128.59 162.44 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.507 -0.746 . . . . 0.0 110.081 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -88.63 110.7 21.15 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.353 -0.842 . . . . 0.0 110.217 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.438 ' HB3' ' CZ3' ' A' ' 25' ' ' TRP . 0.5 OUTLIER -84.08 153.13 23.95 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.494 -0.754 . . . . 0.0 110.396 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -90.57 -4.05 57.14 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.417 -0.802 . . . . 0.0 111.164 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.482 HG22 ' CE2' ' A' ' 23' ' ' TRP . 9.5 m -77.77 -66.74 0.8 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.97 -1.081 . . . . 0.0 110.224 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.592 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 11.8 m95 -104.36 6.8 35.43 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.467 -0.77 . . . . 0.0 110.152 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.2 mttt 52.32 65.22 1.57 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.482 -0.761 . . . . 0.0 110.725 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.592 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -151.35 172.03 16.56 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.319 -0.863 . . . . 0.0 110.842 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.435 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 72.5 m -79.67 118.61 21.65 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.496 -0.753 . . . . 0.0 109.863 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.568 ' HB ' ' CZ2' ' A' ' 25' ' ' TRP . 1.6 p -121.69 160.72 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.497 -0.752 . . . . 0.0 110.529 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -67.53 127.08 31.4 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.167 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.82 117.79 9.42 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.539 -0.726 . . . . 0.0 110.249 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.465 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.856 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.464 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 93.2 m -110.35 13.58 22.86 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.473 -1.016 . . . . 0.0 110.893 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 tt -65.95 115.06 5.63 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.068 -1.02 . . . . 0.0 110.382 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.88 -29.77 3.48 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.403 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 35.9 t70 -64.88 156.8 29.76 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.403 -1.057 . . . . 0.0 110.538 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.4 ' HG3' ' HB2' ' A' ' 9' ' ' TYR . 0.0 OUTLIER -89.25 149.95 22.85 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.412 -0.805 . . . . 0.0 110.51 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.456 ' SG ' ' SG ' ' A' ' 13' ' ' CYS . 0.1 OUTLIER -105.28 23.46 13.67 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.412 -0.805 . . . . 0.0 110.669 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -116.99 -44.84 2.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.233 -0.917 . . . . 0.0 110.487 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.4 ' HB2' ' HG3' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -66.76 -57.86 6.23 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.439 -0.788 . . . . 0.0 110.499 -179.588 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -108.82 -26.35 10.33 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.481 -0.762 . . . . 0.0 110.782 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.4 t30 53.26 50.14 18.29 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.497 -0.752 . . . . 0.0 110.298 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -141.02 85.08 0.21 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 81.8 m -83.83 -169.85 2.78 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.654 -0.909 . . . . 0.0 110.7 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 0.8 OUTLIER -77.82 175.45 9.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.457 -0.777 . . . . 0.0 110.183 179.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 55.6 p -69.01 114.89 7.7 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.334 -0.854 . . . . 0.0 110.111 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.6 4.39 55.97 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 110.229 -1.149 . . . . 0.0 110.229 -179.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.524 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 3.3 m-85 -100.27 144.12 29.66 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.048 -1.266 . . . . 0.0 109.904 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.6 m -123.44 161.47 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.467 -0.77 . . . . 0.0 110.71 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 m -82.6 114.05 20.72 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.592 -0.693 . . . . 0.0 109.891 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.489 ' OG ' HG21 ' A' ' 27' ' ' VAL . 0.3 OUTLIER -70.89 153.13 42.97 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.401 -0.812 . . . . 0.0 110.604 -179.776 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.45 10.76 23.94 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.581 -0.699 . . . . 0.0 110.88 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.5 m -103.15 -78.71 0.54 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.126 -0.984 . . . . 0.0 110.044 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.63 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 23.9 m95 -89.74 6.62 40.77 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.252 -0.905 . . . . 0.0 110.607 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.9 mptt 53.31 54.85 9.57 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.42 -0.8 . . . . 0.0 110.296 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.7 ' CE2' HG22 ' A' ' 27' ' ' VAL . 0.9 OUTLIER -136.32 173.53 11.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.292 -0.88 . . . . 0.0 110.723 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.403 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 85.8 m -73.68 131.19 41.37 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.476 -0.765 . . . . 0.0 111.1 -178.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.7 HG22 ' CE2' ' A' ' 25' ' ' TRP . 2.9 t -135.63 161.67 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.66 -0.65 . . . . 0.0 109.856 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.3 mt -74.52 134.25 42.24 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.441 -0.787 . . . . 0.0 110.23 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.93 128.05 32.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.515 -0.74 . . . . 0.0 110.21 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.603 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.788 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.429 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 13.0 m 59.66 38.04 22.12 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.64 -0.918 . . . . 0.0 110.686 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 tt -96.14 107.58 19.92 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.407 -0.808 . . . . 0.0 109.553 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 143.24 -25.16 2.2 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.04 128.23 35.14 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.364 -1.08 . . . . 0.0 110.151 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 25' ' ' TRP . 13.2 pttp -84.62 149.87 25.56 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.552 -0.717 . . . . 0.0 110.55 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 11' ' ' ASN . 28.5 p -143.05 139.74 30.66 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.575 -0.703 . . . . 0.0 110.226 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -103.55 -33.58 8.97 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.565 -0.71 . . . . 0.0 110.879 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -154.88 -59.11 0.11 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.242 -0.911 . . . . 0.0 110.265 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -132.5 46.39 2.64 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.558 -0.714 . . . . 0.0 110.308 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.405 ' HB2' ' HA ' ' A' ' 7' ' ' CYS . 22.7 t-20 -58.18 -49.75 75.94 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.479 -0.763 . . . . 0.0 110.281 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 107.79 80.94 1.31 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 87.8 m -79.91 171.67 14.8 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.403 -1.057 . . . . 0.0 109.55 179.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.0 OUTLIER -67.27 160.1 27.81 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.111 -0.993 . . . . 0.0 110.255 179.777 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 p -59.13 121.07 10.41 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.441 -0.787 . . . . 0.0 110.452 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 103.15 -8.92 53.99 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.401 ' CE1' ' HG ' ' A' ' 28' ' ' LEU . 2.2 m-85 -103.98 148.34 26.31 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.075 -1.25 . . . . 0.0 110.706 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.7 171.11 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.599 -0.688 . . . . 0.0 110.277 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.3 m -94.43 122.56 37.12 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.257 -0.902 . . . . 0.0 110.487 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.534 ' OG ' HG21 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -88.92 165.64 14.47 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.391 -0.818 . . . . 0.0 110.935 179.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -91.31 -30.78 16.38 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.514 -0.741 . . . . 0.0 111.266 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.1 m -55.32 -73.67 0.05 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.476 -0.765 . . . . 0.0 111.142 -178.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.575 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 34.6 m95 -100.2 5.82 44.74 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.145 -0.972 . . . . 0.0 110.95 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 20' ' ' SER . 0.1 OUTLIER 52.6 59.82 4.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.302 -0.873 . . . . 0.0 110.146 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.727 ' CE2' HG22 ' A' ' 27' ' ' VAL . 1.1 p90 -141.18 175.21 9.83 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.377 -0.827 . . . . 0.0 110.72 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.1 m -76.07 127.15 32.36 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.544 -0.723 . . . . 0.0 110.583 -179.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.727 HG22 ' CE2' ' A' ' 25' ' ' TRP . 2.3 t -127.96 159.93 38.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.571 -0.706 . . . . 0.0 109.809 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.401 ' HG ' ' CE1' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -66.2 142.44 57.71 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.36 -0.837 . . . . 0.0 110.322 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.92 -27.46 68.87 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.57 -0.706 . . . . 0.0 110.924 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.557 0 N-CA-C 109.927 -1.269 . . . . 0.0 109.927 179.905 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.418 0 N-CA-C 109.958 -1.257 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 84.0 m -103.06 4.7 37.49 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.522 -0.987 . . . . 0.0 110.851 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.04 114.06 6.25 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.963 -1.085 . . . . 0.0 109.621 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 122.64 -18.35 8.15 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.49 116.39 3.07 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.364 -1.08 . . . . 0.0 110.04 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.53 138.7 57.69 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.411 -0.806 . . . . 0.0 110.641 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 p -128.62 116.81 20.18 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.724 -0.61 . . . . 0.0 110.24 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.36 -59.79 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.434 -0.791 . . . . 0.0 110.459 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -79.47 -44.13 21.89 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.427 -0.796 . . . . 0.0 110.182 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -96.09 -35.58 11.3 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.445 -0.784 . . . . 0.0 110.149 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 54.86 68.19 0.9 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.656 -0.653 . . . . 0.0 110.684 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.15 84.8 0.2 Allowed Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.2 m -80.52 169.88 17.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.544 -0.974 . . . . 0.0 110.502 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.5 m -78.45 177.26 8.65 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.403 -0.811 . . . . 0.0 110.099 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 37.8 m -64.34 129.43 39.9 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.325 -0.859 . . . . 0.0 109.957 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.32 17.79 75.46 Favored Glycine 0 N--CA 1.493 2.491 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.417 ' HB3' ' HB3' ' A' ' 26' ' ' CYS . 11.9 m-85 -125.48 132.21 52.7 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.292 -1.122 . . . . 0.0 109.666 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.9 m -117.64 146.85 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.327 -0.858 . . . . 0.0 110.648 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.5 t -67.11 119.13 11.53 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.603 -0.685 . . . . 0.0 110.05 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.447 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -75.11 132.69 41.41 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.438 -0.788 . . . . 0.0 110.732 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -81.31 -15.07 56.52 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.489 -0.757 . . . . 0.0 109.535 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.458 HG22 ' CE3' ' A' ' 23' ' ' TRP . 98.4 m -101.32 -44.58 5.6 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.475 -0.766 . . . . 0.0 110.401 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.776 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.4 m95 -91.81 -16.97 26.02 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.448 -0.782 . . . . 0.0 111.218 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.0 12.77 8.94 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.56 -0.713 . . . . 0.0 112.252 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.776 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -124.13 160.16 28.41 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.889 -1.132 . . . . 0.0 109.671 178.743 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 78.8 m -71.39 109.1 5.17 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.38 -0.825 . . . . 0.0 110.957 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.522 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.8 OUTLIER -106.38 165.33 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.471 -0.768 . . . . 0.0 109.815 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.85 148.07 50.28 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.344 -0.848 . . . . 0.0 110.409 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.71 14.72 8.0 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.432 -0.793 . . . . 0.0 111.168 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 179.61 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.8 p -92.22 4.36 53.41 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.604 -0.939 . . . . 0.0 111.155 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.1 tp -74.72 123.7 25.42 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.097 -1.002 . . . . 0.0 109.942 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 108.56 -14.14 35.61 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.62 139.76 47.58 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.18 -1.188 . . . . 0.0 109.496 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.74 139.88 52.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.507 -0.746 . . . . 0.0 110.7 -179.456 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.5 t -132.1 144.54 50.79 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.526 -0.734 . . . . 0.0 110.369 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -123.28 -66.78 0.99 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.629 -0.669 . . . . 0.0 109.818 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -157.66 -58.93 0.08 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.496 -0.752 . . . . 0.0 110.254 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -105.81 45.53 0.97 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.564 -0.71 . . . . 0.0 110.396 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -76.97 -45.74 26.5 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.35 -0.844 . . . . 0.0 110.281 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.19 74.63 1.28 Allowed Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.9 m -89.57 -168.46 2.16 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.495 -1.003 . . . . 0.0 110.233 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.507 ' HB2' ' CD1' ' A' ' 17' ' ' TYR . 85.8 m -63.94 162.8 13.18 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.309 -0.869 . . . . 0.0 110.336 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.9 m -67.19 115.38 6.8 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.364 -0.835 . . . . 0.0 109.962 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 103.33 14.15 26.73 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.507 ' CD1' ' HB2' ' A' ' 14' ' ' CYS . 3.3 m-85 -106.56 121.41 44.25 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.157 -1.202 . . . . 0.0 109.993 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -91.0 163.55 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.504 -0.748 . . . . 0.0 110.142 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t -95.97 114.31 26.01 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.575 -0.703 . . . . 0.0 109.801 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.462 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -90.36 111.0 22.06 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.331 -0.855 . . . . 0.0 110.401 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -26.12 53.32 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.404 -0.81 . . . . 0.0 109.646 179.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.437 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 53.0 m -67.46 -44.51 78.44 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.61 -0.681 . . . . 0.0 110.076 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.697 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.5 m95 -98.01 -12.26 22.12 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.443 -0.785 . . . . 0.0 110.665 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 64.95 34.39 9.04 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.576 -0.703 . . . . 0.0 111.547 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.697 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -147.06 154.88 41.71 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.076 -1.015 . . . . 0.0 109.915 178.793 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.31 115.54 15.06 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.362 -0.836 . . . . 0.0 110.886 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.603 HG22 ' NE1' ' A' ' 25' ' ' TRP . 1.0 OUTLIER -106.83 170.21 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.719 -0.613 . . . . 0.0 109.99 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.85 148.34 31.39 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.348 -0.845 . . . . 0.0 110.039 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.15 90.71 6.59 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.413 -0.804 . . . . 0.0 110.421 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.526 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 179.865 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.415 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.1 p -101.59 60.98 0.9 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.474 -1.016 . . . . 0.0 110.542 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.9 tt -78.12 107.16 10.5 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.356 -0.84 . . . . 0.0 109.902 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.01 -16.84 3.66 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.7 122.69 17.84 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.246 -1.15 . . . . 0.0 109.996 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.59 142.39 22.89 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.651 -0.656 . . . . 0.0 111.263 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.7 t -137.03 144.01 43.01 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.595 -0.69 . . . . 0.0 110.079 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -125.59 -67.85 0.86 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.451 -0.781 . . . . 0.0 110.461 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -150.68 -58.43 0.17 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.261 -0.9 . . . . 0.0 110.332 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -104.79 42.44 1.21 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.491 -0.756 . . . . 0.0 110.106 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -89.07 -49.78 6.56 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.321 -0.862 . . . . 0.0 110.141 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.01 106.34 0.65 Allowed Glycine 0 N--CA 1.493 2.451 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.483 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 74.9 m -83.32 -168.35 2.06 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.56 -0.965 . . . . 0.0 110.262 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.0 m -80.51 179.67 7.62 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.262 -0.899 . . . . 0.0 110.729 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.0 p -68.49 122.25 18.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.474 -0.766 . . . . 0.0 109.859 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.09 14.38 69.41 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.483 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 5.1 m-85 -113.77 156.29 24.1 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.307 -1.114 . . . . 0.0 110.191 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.418 ' CG2' ' N ' ' A' ' 19' ' ' CYS . 1.5 p -128.6 163.43 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.418 -0.801 . . . . 0.0 110.623 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.418 ' N ' ' CG2' ' A' ' 18' ' ' VAL . 14.9 t -89.74 109.97 20.91 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.881 -0.512 . . . . 0.0 110.139 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.509 ' HB2' HG23 ' A' ' 27' ' ' VAL . 1.1 m -90.42 120.39 31.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.427 -0.796 . . . . 0.0 110.744 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -30.88 56.13 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.581 -0.699 . . . . 0.0 110.195 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.464 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 19.6 m -61.24 -48.19 82.63 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.497 -0.752 . . . . 0.0 110.235 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.701 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.5 m95 -100.37 -2.52 33.23 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.445 -0.784 . . . . 0.0 110.847 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 mtmm 54.87 35.19 23.77 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.406 -0.809 . . . . 0.0 111.981 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.701 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -144.55 157.36 44.26 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.057 -1.027 . . . . 0.0 109.882 178.731 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.41 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 56.8 m -71.89 104.8 3.6 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.337 -0.852 . . . . 0.0 110.888 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.571 HG22 ' NE1' ' A' ' 25' ' ' TRP . 12.2 t -95.13 163.41 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.55 -0.719 . . . . 0.0 109.461 179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.6 tt -78.17 129.96 35.76 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.339 -0.851 . . . . 0.0 110.189 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.92 107.22 10.29 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.596 -0.69 . . . . 0.0 110.125 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.51 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.88 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.367 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 72.2 m -119.98 35.05 4.98 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.506 -0.996 . . . . 0.0 110.58 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 tt -86.51 130.33 34.53 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.21 -0.932 . . . . 0.0 109.969 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.16 -22.34 36.88 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.892 -1.283 . . . . 0.0 109.892 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -64.26 125.28 24.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.333 -1.098 . . . . 0.0 110.184 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -59.13 151.93 21.48 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.631 -0.668 . . . . 0.0 110.667 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.0 m -69.87 145.99 51.6 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.482 -0.761 . . . . 0.0 110.222 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -82.11 -55.03 4.81 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.437 -0.79 . . . . 0.0 109.889 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -162.24 -58.4 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.69 -0.631 . . . . 0.0 109.481 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -97.21 -33.36 11.51 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.667 -0.645 . . . . 0.0 109.523 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.58 ' HA ' ' HB2' ' A' ' 19' ' ' CYS . 0.9 OUTLIER -163.58 -62.13 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.63 -0.669 . . . . 0.0 109.849 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 58.49 40.42 94.38 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 109.954 -1.258 . . . . 0.0 109.954 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.4 m -125.98 156.65 39.49 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.519 -0.989 . . . . 0.0 110.489 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.9 m -83.03 175.9 9.66 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.521 -0.737 . . . . 0.0 110.134 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.6 m -60.36 124.49 20.47 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.429 -0.794 . . . . 0.0 110.172 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.58 15.42 37.51 Favored Glycine 0 N--CA 1.494 2.556 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -132.23 143.07 49.67 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.298 -1.119 . . . . 0.0 110.21 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.503 HG13 ' HB2' ' A' ' 29' ' ' ALA . 19.7 m -120.27 147.44 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.483 -0.76 . . . . 0.0 110.26 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HB2' ' HA ' ' A' ' 11' ' ' ASN . 42.5 t -78.98 103.07 8.67 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.468 -0.77 . . . . 0.0 109.987 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.457 ' HB2' HG21 ' A' ' 27' ' ' VAL . 26.1 t -72.11 128.57 36.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.476 -0.765 . . . . 0.0 110.217 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.461 ' HA ' ' HE2' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -80.35 -16.06 55.42 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.419 -0.801 . . . . 0.0 110.132 179.292 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 m -84.67 -46.95 10.97 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.339 -0.85 . . . . 0.0 110.263 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.694 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.9 m95 -99.98 -15.73 18.19 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.384 -0.823 . . . . 0.0 110.926 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 11.5 mmtt 62.92 35.67 13.26 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.72 -0.613 . . . . 0.0 111.844 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.694 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -136.36 158.48 44.32 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.098 -1.001 . . . . 0.0 109.378 178.121 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.4 m -70.56 104.36 2.77 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.334 -0.854 . . . . 0.0 110.744 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.573 HG22 ' NE1' ' A' ' 25' ' ' TRP . 2.0 t -99.09 156.55 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 109.567 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -65.74 128.55 36.41 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.465 -0.772 . . . . 0.0 110.197 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.503 ' HB2' HG13 ' A' ' 18' ' ' VAL . . . -68.79 101.39 1.33 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.587 -0.696 . . . . 0.0 110.338 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.488 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.944 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.368 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 14' ' ' CYS . 14.1 m -90.48 -9.16 48.4 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.503 -0.998 . . . . 0.0 111.167 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 27' ' ' VAL . 4.2 tp -58.81 120.75 9.57 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.19 -0.944 . . . . 0.0 110.01 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.1 -23.23 6.95 Favored Glycine 0 N--CA 1.493 2.498 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.459 ' O ' ' HA ' ' A' ' 25' ' ' TRP . 23.7 t70 -65.3 156.14 33.0 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.264 -1.139 . . . . 0.0 110.069 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -90.3 147.94 23.19 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.404 -0.81 . . . . 0.0 111.102 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.8 p -140.98 155.2 46.27 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.498 -0.751 . . . . 0.0 109.811 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -122.64 -69.37 0.83 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.336 -0.853 . . . . 0.0 110.443 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -160.62 -55.86 0.05 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.407 -0.808 . . . . 0.0 109.903 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -106.62 15.13 26.13 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.656 -0.653 . . . . 0.0 110.414 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -72.34 -48.87 38.55 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.221 -0.925 . . . . 0.0 109.958 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.43 109.69 2.74 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.8 m -79.79 -166.53 1.02 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.549 -0.971 . . . . 0.0 110.033 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 2' ' ' CYS . 0.5 OUTLIER -71.92 170.81 12.96 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.273 -0.892 . . . . 0.0 110.754 -179.883 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.8 m -66.16 115.3 6.02 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.551 -0.718 . . . . 0.0 109.806 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.36 -17.22 59.4 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.836 -1.306 . . . . 0.0 109.836 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -89.58 140.24 29.74 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.281 -1.129 . . . . 0.0 110.159 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 4.2 t -103.53 160.73 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.524 -0.735 . . . . 0.0 109.741 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.9 t -92.56 115.95 28.56 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.482 -0.761 . . . . 0.0 109.903 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.522 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -77.29 115.9 17.45 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.525 -0.734 . . . . 0.0 110.118 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -78.29 -13.82 59.69 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.512 -0.742 . . . . 0.0 109.855 179.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.486 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 49.8 m -91.09 -44.78 9.07 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.458 -0.776 . . . . 0.0 110.187 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.696 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.2 m95 -96.18 -13.62 23.38 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.411 -0.805 . . . . 0.0 110.897 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 3.2 mmmm 66.03 31.34 9.09 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.62 -0.675 . . . . 0.0 111.905 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.696 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -139.02 156.06 47.5 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.062 -1.024 . . . . 0.0 109.673 178.429 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.4 m -73.16 109.97 7.09 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.183 -0.948 . . . . 0.0 110.869 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.689 HG22 ' NE1' ' A' ' 25' ' ' TRP . 1.6 t -104.6 156.38 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.513 -0.742 . . . . 0.0 109.808 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.8 tp -79.09 147.13 32.88 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.407 -0.808 . . . . 0.0 109.949 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.34 88.55 2.58 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.465 -0.772 . . . . 0.0 110.191 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.627 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.856 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.443 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.5 p -109.73 58.52 0.61 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.489 -1.006 . . . . 0.0 110.557 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.425 HD23 ' N ' ' A' ' 4' ' ' GLY . 3.4 tt -81.79 132.3 35.28 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.316 -0.865 . . . . 0.0 109.988 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.425 ' N ' HD23 ' A' ' 3' ' ' LEU . . . 116.26 -30.19 6.63 Favored Glycine 0 N--CA 1.496 2.679 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.67 140.55 57.43 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.369 -1.077 . . . . 0.0 110.144 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -82.08 136.84 35.14 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.337 -0.852 . . . . 0.0 110.519 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.7 p -115.45 106.84 14.43 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.61 -0.681 . . . . 0.0 110.13 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -149.55 -48.84 0.14 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.672 -0.643 . . . . 0.0 110.514 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -70.06 -50.11 44.41 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.489 -0.757 . . . . 0.0 109.978 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -101.7 -30.33 11.39 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.599 -0.688 . . . . 0.0 110.605 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 t30 54.76 50.66 15.28 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.574 -0.704 . . . . 0.0 110.282 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -152.4 90.43 0.13 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.114 -1.594 . . . . 0.0 109.114 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 63.3 m -79.86 -160.6 0.28 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.669 -0.9 . . . . 0.0 110.448 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.6 m -75.74 173.41 11.15 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.429 -0.794 . . . . 0.0 110.358 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 p -64.02 123.94 20.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.36 -0.838 . . . . 0.0 109.918 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.61 -21.86 43.85 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -92.89 120.24 33.02 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.199 -1.177 . . . . 0.0 110.138 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 t -100.59 163.77 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.61 -0.681 . . . . 0.0 109.872 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t -91.21 108.76 20.09 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.551 -0.718 . . . . 0.0 110.144 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.446 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -66.32 146.2 54.86 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.52 -0.738 . . . . 0.0 110.174 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.44 -29.54 17.91 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.481 -0.762 . . . . 0.0 110.918 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.464 HG22 ' CE3' ' A' ' 23' ' ' TRP . 41.3 m -78.15 -49.43 13.87 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.287 -0.883 . . . . 0.0 110.927 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CB ' ' CE3' ' A' ' 25' ' ' TRP . 6.9 m95 -96.08 -18.1 20.42 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.337 -0.852 . . . . 0.0 110.83 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 15.0 mttt 63.76 31.36 14.27 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.645 -0.66 . . . . 0.0 111.837 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.671 ' NE1' HG22 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -121.65 162.13 21.25 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 120.987 -1.071 . . . . 0.0 109.666 178.339 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.414 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 84.7 m -71.62 104.74 3.42 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.364 -0.835 . . . . 0.0 110.892 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.671 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.9 OUTLIER -106.53 161.08 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.541 -0.724 . . . . 0.0 109.69 179.808 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.33 149.05 50.96 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.367 -0.833 . . . . 0.0 110.285 179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.58 66.72 9.67 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.442 -0.786 . . . . 0.0 110.539 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.482 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 179.676 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.404 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.7 p -101.26 57.1 0.85 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.387 -1.066 . . . . 0.0 110.369 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.59 113.64 10.94 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.406 -0.809 . . . . 0.0 110.297 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.51 -21.64 4.25 Favored Glycine 0 N--CA 1.495 2.621 0 N-CA-C 110.319 -1.113 . . . . 0.0 110.319 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.82 123.75 17.51 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.277 -1.131 . . . . 0.0 110.277 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -69.27 135.07 49.95 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.479 -0.763 . . . . 0.0 110.794 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -121.13 146.06 47.16 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.645 -0.659 . . . . 0.0 109.826 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -133.86 -45.57 0.8 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.446 -0.784 . . . . 0.0 110.847 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -169.91 -55.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.327 -0.858 . . . . 0.0 109.826 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -104.63 22.11 15.62 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.675 -0.641 . . . . 0.0 110.584 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.0 t30 -74.49 -59.71 2.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.189 -0.944 . . . . 0.0 110.045 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.25 105.98 0.67 Allowed Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 69.1 m -81.05 179.02 8.05 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.525 -0.985 . . . . 0.0 110.324 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 76.7 m -75.0 174.07 9.84 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.434 -0.791 . . . . 0.0 110.409 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.7 m -66.34 119.32 11.37 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.443 -0.786 . . . . 0.0 109.831 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.97 -22.67 39.19 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -89.59 147.98 23.62 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.284 -1.127 . . . . 0.0 109.942 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.42 ' CG1' ' HB2' ' A' ' 29' ' ' ALA . 27.6 m -130.15 151.46 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.607 -0.683 . . . . 0.0 110.425 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 13' ' ' CYS . 73.8 m -73.45 103.28 4.04 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.464 -0.772 . . . . 0.0 109.985 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.2 t -73.86 137.63 43.88 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.412 -0.805 . . . . 0.0 110.24 -179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.67 -26.68 27.61 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.52 -0.738 . . . . 0.0 110.341 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.9 m -73.39 -45.61 53.75 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.416 -0.802 . . . . 0.0 110.28 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.789 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 5.8 m95 -100.12 -13.43 18.98 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.385 -0.822 . . . . 0.0 111.222 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.6 OUTLIER 62.76 31.66 16.43 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.529 -0.732 . . . . 0.0 111.938 179.78 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.789 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -141.97 160.82 39.44 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.022 -1.049 . . . . 0.0 109.853 178.344 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.401 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 71.0 m -66.49 107.39 2.05 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.349 -0.844 . . . . 0.0 111.473 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.662 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.9 OUTLIER -117.38 172.5 5.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.51 -0.744 . . . . 0.0 109.467 179.268 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.43 ' HA ' HD22 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -73.1 131.27 41.87 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.165 -0.959 . . . . 0.0 110.154 179.669 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.42 ' HB2' ' CG1' ' A' ' 18' ' ' VAL . . . -66.91 124.4 22.88 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.48 -0.762 . . . . 0.0 110.49 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.521 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.891 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.409 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 89.7 m -103.58 9.66 37.33 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.473 -1.016 . . . . 0.0 111.077 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.8 97.73 0.85 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.093 -1.004 . . . . 0.0 109.918 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.22 -22.47 3.57 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.56 128.18 34.79 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.256 -1.144 . . . . 0.0 110.084 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.81 159.27 32.16 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.479 -0.763 . . . . 0.0 110.238 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.43 156.05 38.68 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.538 -0.726 . . . . 0.0 110.101 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -130.98 -65.91 0.77 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.475 -0.766 . . . . 0.0 110.393 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -164.46 -51.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.401 -0.812 . . . . 0.0 110.767 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -94.3 9.84 36.53 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.402 -0.812 . . . . 0.0 111.19 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 58.09 70.32 0.66 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.359 -0.838 . . . . 0.0 110.29 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -87.93 59.36 4.25 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 87.2 m -89.61 178.6 6.24 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.496 -1.003 . . . . 0.0 109.897 179.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.1 m -75.52 179.81 5.07 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.177 -0.952 . . . . 0.0 110.62 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.5 m -68.56 112.58 5.44 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.549 -0.72 . . . . 0.0 109.996 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.77 -7.07 67.71 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.106 -1.197 . . . . 0.0 110.106 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.486 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 3.6 m-85 -91.21 137.49 32.32 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.192 -1.181 . . . . 0.0 110.1 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.2 t -123.82 164.04 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.43 -0.794 . . . . 0.0 110.412 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' TRP . 11.7 t -85.23 119.45 25.62 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.454 -0.779 . . . . 0.0 110.299 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.47 ' CB ' ' CZ3' ' A' ' 25' ' ' TRP . 0.6 OUTLIER -83.39 166.81 18.1 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.493 -0.754 . . . . 0.0 110.599 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.64 -24.4 20.51 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.533 -0.73 . . . . 0.0 111.194 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.5 m -62.48 -81.6 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.274 -0.891 . . . . 0.0 110.851 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.591 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 37.9 m95 -89.52 4.08 50.39 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.201 -0.937 . . . . 0.0 110.738 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 20' ' ' SER . 18.0 mtpt 52.53 62.69 2.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.333 -0.855 . . . . 0.0 110.114 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.591 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.4 p90 -144.32 175.4 10.12 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.466 -0.771 . . . . 0.0 110.66 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.8 m -81.53 122.51 27.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.465 -0.772 . . . . 0.0 110.281 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.456 HG22 ' N ' ' A' ' 28' ' ' LEU . 2.0 p -134.39 166.83 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.573 -0.704 . . . . 0.0 110.079 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.456 ' N ' HG22 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -73.24 139.02 45.91 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.883 -0.511 . . . . 0.0 110.51 -179.853 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.36 166.98 19.97 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.482 -0.761 . . . . 0.0 110.499 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.614 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 -179.945 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.593 0 N-CA-C 110.036 -1.225 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 65.2 m -124.83 51.23 1.66 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.399 -1.059 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.64 103.96 16.41 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.272 -0.892 . . . . 0.0 109.829 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.41 -18.33 3.93 Favored Glycine 0 N--CA 1.495 2.584 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.28 121.57 8.52 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.475 -1.014 . . . . 0.0 110.274 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.86 141.54 47.95 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.312 -0.867 . . . . 0.0 110.715 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.62 141.75 58.35 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.608 -0.682 . . . . 0.0 110.129 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -106.84 -66.47 1.01 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.373 -0.829 . . . . 0.0 110.694 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -141.1 -60.45 0.49 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.231 -0.918 . . . . 0.0 110.309 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -98.01 -35.13 10.54 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.523 -0.736 . . . . 0.0 109.947 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -167.35 -65.16 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.644 -0.66 . . . . 0.0 109.916 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 67.88 36.02 85.88 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 109.852 -1.299 . . . . 0.0 109.852 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 48.4 m -120.55 -179.56 4.02 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.527 -0.984 . . . . 0.0 110.162 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 62.1 m -99.5 177.21 5.24 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.427 -0.796 . . . . 0.0 110.047 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.3 m -62.79 124.62 21.5 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.393 -0.817 . . . . 0.0 110.288 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.07 14.32 60.79 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -128.17 125.15 38.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.138 -1.213 . . . . 0.0 110.409 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.759 HG23 ' HB2' ' A' ' 29' ' ' ALA . 3.1 t -103.04 159.68 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.521 -0.737 . . . . 0.0 109.549 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.69 116.51 24.01 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.371 -0.83 . . . . 0.0 109.969 179.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.438 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -75.51 127.46 33.14 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.55 -0.719 . . . . 0.0 110.475 -179.804 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -80.94 -12.7 59.35 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.476 -0.765 . . . . 0.0 110.192 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.8 m -89.99 -45.98 8.82 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.377 -0.827 . . . . 0.0 109.988 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.716 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.2 m95 -97.58 -11.53 23.55 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.528 -0.732 . . . . 0.0 110.926 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.88 22.86 11.37 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.446 -0.784 . . . . 0.0 112.032 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.716 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -131.97 155.13 48.51 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.866 -1.146 . . . . 0.0 109.912 178.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 18' ' ' VAL . 68.4 m -72.81 109.36 6.35 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.468 -0.77 . . . . 0.0 110.841 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.686 HG22 ' NE1' ' A' ' 25' ' ' TRP . 2.8 t -99.23 167.58 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.523 -0.736 . . . . 0.0 109.692 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.97 132.44 47.3 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.286 -0.884 . . . . 0.0 110.622 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.759 ' HB2' HG23 ' A' ' 18' ' ' VAL . . . -88.57 170.43 10.86 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.655 -0.653 . . . . 0.0 110.717 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.663 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.729 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.472 0 N-CA-C 109.731 -1.347 . . . . 0.0 109.731 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.7 m -107.76 38.16 2.24 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.481 -1.011 . . . . 0.0 110.379 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' A' ' 27' ' ' VAL . 11.3 tp -72.5 109.43 6.17 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.306 -0.871 . . . . 0.0 110.193 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.87 -22.48 6.82 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 110.108 -1.197 . . . . 0.0 110.108 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.8 118.33 7.57 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.284 -1.127 . . . . 0.0 109.963 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -64.58 146.6 54.39 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.223 -0.923 . . . . 0.0 109.849 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 98.0 m -63.89 161.93 14.67 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.383 -0.823 . . . . 0.0 110.032 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.5 -82.64 0.39 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.207 -0.933 . . . . 0.0 109.941 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -115.74 -55.54 2.42 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.454 -0.779 . . . . 0.0 109.502 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -121.38 -27.21 4.87 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.636 -0.665 . . . . 0.0 110.485 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -176.82 84.19 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.36 -0.837 . . . . 0.0 109.82 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -97.58 64.08 0.92 Allowed Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 67.0 m -126.15 144.84 50.6 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.633 -0.922 . . . . 0.0 110.294 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 28.6 p -69.61 166.17 19.6 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.489 -0.757 . . . . 0.0 110.336 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.87 129.15 38.4 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.466 -0.771 . . . . 0.0 110.524 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.5 -27.65 17.29 Favored Glycine 0 N--CA 1.494 2.538 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -108.28 134.67 50.78 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.275 -1.132 . . . . 0.0 110.361 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.3 m -103.98 149.36 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.487 -0.758 . . . . 0.0 110.701 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.3 t -75.37 113.83 13.2 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.524 -0.735 . . . . 0.0 110.329 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.503 ' HB2' ' O ' ' A' ' 25' ' ' TRP . 0.3 OUTLIER -82.4 126.12 31.82 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.416 -0.802 . . . . 0.0 110.044 179.634 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.7 mtt-85 -80.86 -23.4 39.09 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.343 -0.848 . . . . 0.0 110.411 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.455 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 25.4 m -77.02 -46.84 22.41 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.441 -0.787 . . . . 0.0 110.165 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.741 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.7 m95 -97.26 -6.18 35.09 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.487 -0.758 . . . . 0.0 110.741 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 4.1 mmmm 58.37 26.06 13.6 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.583 -0.698 . . . . 0.0 111.582 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.741 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -134.12 152.96 52.08 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.1 -1.0 . . . . 0.0 109.855 178.841 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.7 m -71.15 109.62 5.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.366 -0.834 . . . . 0.0 110.729 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.636 ' HA ' HD12 ' A' ' 3' ' ' LEU . 2.1 t -99.97 159.45 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 121.469 -0.77 . . . . 0.0 109.939 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.457 HD23 HD13 ' A' ' 3' ' ' LEU . 1.5 pp -74.11 146.82 43.26 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.382 -0.824 . . . . 0.0 110.563 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -105.87 120.55 42.03 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.594 -0.691 . . . . 0.0 109.852 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.552 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.732 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.462 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 86.4 m -103.18 20.67 17.25 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.44 -1.036 . . . . 0.0 110.915 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.97 111.02 12.07 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.031 -1.043 . . . . 0.0 109.892 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.16 -25.78 3.3 Favored Glycine 0 N--CA 1.494 2.567 0 N-CA-C 109.826 -1.31 . . . . 0.0 109.826 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -66.99 118.2 10.12 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.411 -1.052 . . . . 0.0 110.287 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 25' ' ' TRP . 8.7 mptt -70.27 150.3 46.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.448 -0.783 . . . . 0.0 110.584 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.0 m -75.72 179.3 5.5 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.533 -0.729 . . . . 0.0 110.208 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -137.62 -58.32 0.68 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.381 -0.824 . . . . 0.0 110.675 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -154.74 -53.21 0.09 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.402 -0.811 . . . . 0.0 110.731 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -94.29 10.05 35.66 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.445 -0.784 . . . . 0.0 111.417 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 52.46 67.17 1.02 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.344 -0.847 . . . . 0.0 109.938 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -93.5 62.15 2.04 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 16.7 m -79.42 163.62 24.65 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.502 -0.999 . . . . 0.0 109.681 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 40.0 m -61.9 166.59 4.4 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.309 -0.869 . . . . 0.0 110.783 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.8 p -64.71 128.23 34.91 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.359 -0.838 . . . . 0.0 109.98 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.5 6.82 62.31 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -120.42 153.73 36.15 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.196 -1.179 . . . . 0.0 110.01 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.22 147.02 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.39 -0.819 . . . . 0.0 110.328 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.8 t -81.13 119.43 23.56 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.445 -0.784 . . . . 0.0 110.154 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.483 ' HB3' ' CZ3' ' A' ' 25' ' ' TRP . 0.4 OUTLIER -89.42 154.44 20.05 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.487 -0.758 . . . . 0.0 110.333 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -11.7 39.25 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.428 -0.795 . . . . 0.0 111.199 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.461 HG22 ' CE2' ' A' ' 23' ' ' TRP . 6.2 m -69.29 -65.17 0.74 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.259 -0.901 . . . . 0.0 110.267 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.582 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 9.0 m95 -106.93 5.33 28.17 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.414 -0.804 . . . . 0.0 110.423 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.2 mttm 54.37 62.83 2.39 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.436 -0.79 . . . . 0.0 110.801 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.71 ' CE2' HG22 ' A' ' 27' ' ' VAL . 0.8 OUTLIER -148.83 171.31 16.49 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.331 -0.856 . . . . 0.0 110.579 179.664 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.9 m -77.51 129.98 36.38 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.51 -0.744 . . . . 0.0 110.716 -179.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.71 HG22 ' CE2' ' A' ' 25' ' ' TRP . 1.8 t -126.44 167.93 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.557 -0.714 . . . . 0.0 109.829 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -66.85 141.95 57.5 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.301 -0.874 . . . . 0.0 110.102 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.79 97.86 6.81 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.508 -0.745 . . . . 0.0 110.254 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.939 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.354 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 56.4 m -92.82 -17.35 24.23 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.398 -1.06 . . . . 0.0 110.896 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.509 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 0.5 OUTLIER -61.79 112.56 2.33 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.17 -0.956 . . . . 0.0 110.119 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.14 -27.43 4.81 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.15 113.08 3.31 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.446 -1.032 . . . . 0.0 110.105 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -66.39 130.73 44.2 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.514 -0.741 . . . . 0.0 110.598 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 t -110.47 140.47 44.7 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.529 -0.732 . . . . 0.0 109.988 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -151.04 -58.76 0.17 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.553 -0.717 . . . . 0.0 110.979 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -104.99 -75.05 0.63 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.359 -0.838 . . . . 0.0 110.685 -179.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -137.38 56.65 1.77 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.279 -0.888 . . . . 0.0 110.247 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.44 -51.62 49.32 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.447 -0.783 . . . . 0.0 110.196 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 74.78 92.47 0.16 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 179.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.7 m -83.63 164.43 19.71 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.515 -0.991 . . . . 0.0 109.941 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 26.3 p -77.3 177.02 8.25 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.371 -0.831 . . . . 0.0 110.701 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 73.3 p -58.38 140.3 53.87 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.378 -0.826 . . . . 0.0 110.697 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.3 1.98 89.29 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 -179.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -133.09 137.75 46.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.162 -1.199 . . . . 0.0 110.23 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 30.2 m -139.78 160.08 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.475 -0.765 . . . . 0.0 110.544 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -72.26 112.17 8.1 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.46 -0.775 . . . . 0.0 109.924 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.565 ' HB3' ' HB2' ' A' ' 23' ' ' TRP . 8.7 t -89.56 158.1 17.79 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.347 -0.846 . . . . 0.0 110.819 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -88.73 -47.84 7.95 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.54 -0.725 . . . . 0.0 109.686 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 50.9 m -65.72 -38.68 89.84 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.642 -0.661 . . . . 0.0 110.005 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.565 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 6.8 m95 -90.47 -32.03 16.54 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.614 -0.679 . . . . 0.0 110.593 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 66.44 27.87 9.74 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.525 -0.734 . . . . 0.0 111.384 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.586 ' NE1' HG22 ' A' ' 27' ' ' VAL . 1.2 p90 -150.5 175.21 12.1 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.188 -0.945 . . . . 0.0 109.738 178.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.509 ' O ' ' HA ' ' A' ' 3' ' ' LEU . 77.8 m -71.63 100.32 2.27 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.094 -1.004 . . . . 0.0 109.525 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.586 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.6 OUTLIER -106.53 157.04 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.479 -0.763 . . . . 0.0 110.186 -179.287 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.27 135.94 57.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.658 -0.651 . . . . 0.0 110.166 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -93.63 59.59 2.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.458 -0.776 . . . . 0.0 110.411 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.53 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.945 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.361 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 59.2 m -105.44 29.11 6.76 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.471 -1.017 . . . . 0.0 110.606 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.475 HD12 ' HE1' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -84.76 109.64 18.21 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.345 -0.847 . . . . 0.0 109.77 179.658 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 136.09 -21.43 3.51 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.871 -1.292 . . . . 0.0 109.871 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -66.66 110.68 3.31 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.236 -1.155 . . . . 0.0 109.753 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -65.35 149.36 50.11 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.439 -0.788 . . . . 0.0 110.642 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.533 ' HB2' ' HB3' ' A' ' 11' ' ' ASN . 29.7 p -149.06 157.62 43.55 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.537 -0.727 . . . . 0.0 110.325 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -118.55 -60.06 1.81 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.424 -0.797 . . . . 0.0 110.638 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -146.5 -57.51 0.28 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.33 -0.856 . . . . 0.0 110.687 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -106.33 38.78 1.96 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.42 -0.8 . . . . 0.0 110.592 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.533 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 28.4 t-20 -73.26 -57.7 3.83 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.232 -0.918 . . . . 0.0 109.965 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 92.66 95.77 1.42 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 71.4 m -90.9 -176.99 4.83 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.494 -1.004 . . . . 0.0 110.262 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.0 m -73.58 158.21 35.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.387 -0.821 . . . . 0.0 109.765 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 71.1 p -56.65 121.98 11.0 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.388 -0.82 . . . . 0.0 110.166 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.62 -23.19 30.45 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.475 ' HE1' HD12 ' A' ' 3' ' ' LEU . 15.9 m-85 -93.63 143.7 26.06 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.271 -1.135 . . . . 0.0 110.358 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 32.8 m -130.89 160.3 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.452 -0.78 . . . . 0.0 110.304 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -77.48 119.19 20.73 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.391 -0.818 . . . . 0.0 110.226 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.6 ' HB3' ' HB2' ' A' ' 23' ' ' TRP . 28.7 t -90.79 153.43 20.25 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.529 -0.732 . . . . 0.0 110.404 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.79 -49.66 9.49 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.348 -0.845 . . . . 0.0 109.57 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.2 m -66.61 -44.46 82.06 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.505 -0.747 . . . . 0.0 109.912 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.62 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 5.8 m95 -81.7 -31.02 32.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.67 -0.644 . . . . 0.0 110.73 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.3 OUTLIER 62.06 25.21 15.09 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.344 -0.847 . . . . 0.0 111.226 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.701 ' NE1' HG22 ' A' ' 27' ' ' VAL . 1.3 p90 -144.45 176.65 9.22 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.105 -0.997 . . . . 0.0 109.913 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.2 m -70.84 101.0 2.03 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.246 -0.909 . . . . 0.0 110.338 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.701 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.8 OUTLIER -113.11 158.28 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.621 -0.674 . . . . 0.0 109.517 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.2 128.01 34.79 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.07 139.96 57.6 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.462 -0.774 . . . . 0.0 110.429 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.608 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 -179.996 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.57 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 95.5 m -99.62 0.53 42.29 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.275 -1.132 . . . . 0.0 110.966 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 tt -72.98 101.17 3.15 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.138 -0.976 . . . . 0.0 110.043 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 134.13 -16.75 4.39 Favored Glycine 0 N--CA 1.494 2.505 0 N-CA-C 110.021 -1.231 . . . . 0.0 110.021 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -61.51 123.66 18.47 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.367 -1.078 . . . . 0.0 110.441 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -66.97 149.22 50.93 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.54 -0.725 . . . . 0.0 111.097 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.53 154.92 31.0 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.541 -0.724 . . . . 0.0 110.137 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.3 -65.27 1.19 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.441 -0.787 . . . . 0.0 110.257 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -129.7 -67.76 0.74 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.506 -0.746 . . . . 0.0 109.821 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -118.76 -17.16 9.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.548 -0.72 . . . . 0.0 110.644 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -149.45 -66.58 0.22 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.157 -0.964 . . . . 0.0 110.173 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 55.58 37.68 68.49 Favored Glycine 0 N--CA 1.495 2.585 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 95.5 m -128.48 170.58 12.99 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.475 -1.015 . . . . 0.0 110.669 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 86.4 m -87.06 176.02 7.82 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.532 -0.73 . . . . 0.0 109.862 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.05 116.29 6.31 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.329 -0.857 . . . . 0.0 109.917 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 102.51 7.52 45.37 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -125.08 137.84 54.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.228 -1.16 . . . . 0.0 110.096 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.4 t -118.27 162.64 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.364 -0.835 . . . . 0.0 110.22 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 11.2 t -77.11 117.31 18.54 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.452 -0.78 . . . . 0.0 109.967 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 t -71.6 133.57 45.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.605 -0.685 . . . . 0.0 110.453 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -15.06 53.63 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.367 -0.833 . . . . 0.0 110.178 179.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.465 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 21.1 m -94.81 -46.02 7.07 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.402 -0.811 . . . . 0.0 110.491 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CB ' ' CE3' ' A' ' 25' ' ' TRP . 6.8 m95 -101.03 -13.11 18.37 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.411 -0.806 . . . . 0.0 111.093 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 8.3 mmtt 66.5 15.48 10.12 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.582 -0.698 . . . . 0.0 111.916 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.653 ' CE2' HG12 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -117.54 157.66 25.95 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.893 -1.13 . . . . 0.0 109.633 178.773 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.5 m -62.59 101.41 0.25 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.467 -0.771 . . . . 0.0 111.076 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.653 HG12 ' CE2' ' A' ' 25' ' ' TRP . 11.4 m -102.53 153.85 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.581 -0.699 . . . . 0.0 109.829 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 tp -68.0 138.87 56.22 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.519 -0.738 . . . . 0.0 110.582 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.21 121.87 13.64 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.64 -0.662 . . . . 0.0 110.519 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.736 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 179.844 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.484 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.472 ' HB2' ' CG ' ' A' ' 17' ' ' TYR . 61.5 m -109.21 8.04 25.65 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.557 -0.967 . . . . 0.0 110.986 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.534 HD12 ' HE2' ' A' ' 17' ' ' TYR . 0.9 OUTLIER -69.36 131.74 45.29 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.037 -1.04 . . . . 0.0 110.116 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 112.24 -24.58 13.92 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -61.49 118.82 7.49 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.404 -1.056 . . . . 0.0 110.158 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -70.58 139.48 51.46 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.433 -0.792 . . . . 0.0 110.754 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.451 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 69.8 m -121.06 177.32 5.17 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.628 -0.67 . . . . 0.0 110.226 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -131.18 -57.81 1.01 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.466 -0.771 . . . . 0.0 110.172 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -148.64 -60.66 0.24 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.533 -0.73 . . . . 0.0 109.976 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -129.93 38.15 3.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 0.0 110.098 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -54.18 -51.27 64.9 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.554 -0.716 . . . . 0.0 110.107 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.45 94.74 0.54 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.53 -175.2 5.07 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.447 -1.031 . . . . 0.0 109.884 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.0 p -60.72 157.41 14.8 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.262 -0.899 . . . . 0.0 110.297 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 m -55.77 125.34 20.84 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.486 -0.759 . . . . 0.0 110.301 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 113.33 -20.52 18.66 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.534 ' HE2' HD12 ' A' ' 3' ' ' LEU . 6.6 m-85 -113.37 152.72 29.62 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.286 -1.126 . . . . 0.0 110.58 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.15 138.59 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.606 -0.684 . . . . 0.0 110.405 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.1 m -74.92 119.6 19.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.446 -0.784 . . . . 0.0 109.889 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 89.9 p -81.36 132.59 35.34 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.461 -0.775 . . . . 0.0 110.772 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -80.32 -13.66 59.0 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.507 -0.746 . . . . 0.0 110.304 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.521 HG22 ' CE3' ' A' ' 23' ' ' TRP . 53.1 m -90.82 -49.21 6.57 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.338 -0.851 . . . . 0.0 110.181 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.747 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 6.7 m95 -92.27 -15.99 26.71 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.408 -0.808 . . . . 0.0 110.81 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 6.3 mtmm 65.6 31.16 10.13 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.695 -0.628 . . . . 0.0 111.681 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.747 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -139.05 155.12 48.18 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.13 -0.981 . . . . 0.0 109.348 178.164 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 3' ' ' LEU . 58.5 m -70.12 112.38 6.44 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.34 -0.85 . . . . 0.0 110.933 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.617 HG22 ' NE1' ' A' ' 25' ' ' TRP . 1.3 t -108.94 167.48 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.37 -0.831 . . . . 0.0 109.764 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 tp -70.62 141.38 51.73 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.39 -0.818 . . . . 0.0 110.176 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.97 130.94 44.99 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.506 -0.746 . . . . 0.0 110.358 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.537 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.881 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 87.3 m -100.65 28.77 4.88 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.341 -1.093 . . . . 0.0 110.632 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.7 tt -80.42 113.86 18.91 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.186 -0.946 . . . . 0.0 109.928 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.66 -31.33 2.67 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -56.47 124.69 19.04 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.514 -0.992 . . . . 0.0 110.253 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.61 149.51 49.99 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.342 -0.849 . . . . 0.0 110.702 -179.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.9 m -67.71 157.38 34.76 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.579 -0.701 . . . . 0.0 109.713 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -114.83 -75.42 0.59 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.373 -0.83 . . . . 0.0 110.331 -179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -140.3 -59.48 0.53 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.261 -0.899 . . . . 0.0 110.053 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.91 -33.22 12.27 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.511 -0.743 . . . . 0.0 109.983 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -165.14 -67.26 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.605 -0.685 . . . . 0.0 109.914 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 65.98 35.9 91.31 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.2 m -131.78 172.37 12.37 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.523 -0.986 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.2 m -79.41 176.59 9.55 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.467 -0.77 . . . . 0.0 110.24 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.0 m -67.23 117.13 8.82 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.415 -0.803 . . . . 0.0 110.217 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 102.42 -14.63 56.61 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.279 -1.129 . . . . 0.0 110.279 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -91.6 129.8 37.51 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.078 -1.248 . . . . 0.0 110.484 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.4 t -97.37 168.47 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.609 -0.682 . . . . 0.0 110.178 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.25 118.54 37.04 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.254 -0.904 . . . . 0.0 110.46 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.538 ' HB2' ' CZ3' ' A' ' 25' ' ' TRP . 4.4 m -91.05 151.39 21.05 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.551 -0.718 . . . . 0.0 110.343 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.28 -19.19 24.38 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.313 -0.867 . . . . 0.0 111.527 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 66.4 m -57.11 -73.16 0.07 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.163 -0.96 . . . . 0.0 110.209 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.556 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 40.4 m95 -96.44 0.21 50.09 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 179.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.82 68.77 0.79 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.383 -0.823 . . . . 0.0 110.569 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.556 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -155.25 178.23 10.45 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.296 -0.878 . . . . 0.0 110.786 179.666 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.9 m -85.39 138.07 32.51 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.438 -0.789 . . . . 0.0 111.392 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.467 ' CG1' ' CZ2' ' A' ' 25' ' ' TRP . 2.7 m -127.02 140.3 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.74 -0.6 . . . . 0.0 110.015 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.2 tp -67.67 124.59 23.7 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.314 -0.866 . . . . 0.0 109.856 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.87 101.85 0.13 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.637 -0.665 . . . . 0.0 110.3 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.394 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.852 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.475 ' HB2' ' CG ' ' A' ' 17' ' ' TYR . 85.7 m -95.09 3.71 54.49 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.516 -0.991 . . . . 0.0 110.933 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.6 tp -64.57 114.02 4.1 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.133 -0.979 . . . . 0.0 109.97 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.95 -28.62 5.35 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -57.81 140.73 51.04 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.387 -1.067 . . . . 0.0 109.968 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.9 mmmt -85.75 141.05 29.98 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.432 -0.793 . . . . 0.0 110.838 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.2 t -133.96 142.96 47.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.733 -0.605 . . . . 0.0 109.467 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.65 -51.8 9.35 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.424 -0.798 . . . . 0.0 110.341 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -157.27 -57.05 0.08 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.502 -0.749 . . . . 0.0 110.229 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -146.81 43.35 1.16 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.448 -0.783 . . . . 0.0 110.074 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -54.51 -53.54 52.95 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.467 -0.771 . . . . 0.0 110.272 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.66 84.11 0.54 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.4 t -79.6 173.38 12.64 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.513 -0.992 . . . . 0.0 109.682 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.7 p -59.24 162.15 4.81 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.276 -0.89 . . . . 0.0 110.634 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -55.12 129.87 39.78 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.56 -0.712 . . . . 0.0 110.774 -179.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.98 7.17 56.61 Favored Glycine 0 N--CA 1.494 2.564 0 N-CA-C 110.699 -0.96 . . . . 0.0 110.699 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.475 ' CG ' ' HB2' ' A' ' 2' ' ' CYS . 26.9 m-85 -136.31 138.16 41.41 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.05 -1.265 . . . . 0.0 110.808 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.463 ' O ' HG22 ' A' ' 27' ' ' VAL . 12.5 t -125.18 166.77 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.641 -0.662 . . . . 0.0 109.913 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 72.7 m -90.44 114.42 26.57 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.306 -0.871 . . . . 0.0 110.126 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.492 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 10.8 t -75.17 159.12 31.98 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.452 -0.78 . . . . 0.0 110.616 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.1 ttp85 -90.89 -22.71 20.78 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.471 -0.768 . . . . 0.0 110.954 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.509 HG22 ' CD2' ' A' ' 23' ' ' TRP . 62.7 m -69.48 -82.65 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.201 -0.937 . . . . 0.0 110.928 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.684 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 14.3 m95 -85.08 -0.13 53.49 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.07 -1.019 . . . . 0.0 110.812 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER 56.67 63.95 1.81 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.323 -0.86 . . . . 0.0 110.811 179.772 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.684 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.5 p90 -145.95 176.88 9.36 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.273 -0.892 . . . . 0.0 110.395 179.153 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.7 m -78.59 122.79 26.36 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.261 -0.899 . . . . 0.0 111.117 -178.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.61 HG12 ' CZ2' ' A' ' 25' ' ' TRP . 24.2 m -115.13 151.34 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.686 -0.634 . . . . 0.0 110.06 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.7 mt -68.11 118.47 11.31 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.336 -0.852 . . . . 0.0 110.04 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.32 132.27 47.38 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.498 -0.751 . . . . 0.0 110.375 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.498 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.961 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 109.454 -1.459 . . . . 0.0 109.454 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 67.1 m -98.73 -5.86 30.6 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.501 -0.999 . . . . 0.0 110.878 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.42 119.09 10.38 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.106 -0.997 . . . . 0.0 109.846 179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.39 -23.11 4.9 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.77 132.37 50.72 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.309 -1.112 . . . . 0.0 109.879 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -81.01 149.72 29.18 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.42 -0.8 . . . . 0.0 110.3 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.0 p -149.94 165.19 33.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.476 -0.765 . . . . 0.0 110.601 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -135.45 -57.85 0.79 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.584 -0.698 . . . . 0.0 110.34 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -139.27 -59.21 0.58 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.35 -0.844 . . . . 0.0 110.336 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -120.87 41.63 3.24 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.474 -0.766 . . . . 0.0 110.233 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -62.8 -53.85 47.92 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.355 -0.841 . . . . 0.0 110.008 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 107.9 75.85 0.93 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 98.8 m -79.25 169.93 17.38 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.439 -1.036 . . . . 0.0 109.389 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.0 m -67.68 161.95 24.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.251 -0.906 . . . . 0.0 110.017 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.5 p -58.8 120.41 8.93 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.404 -0.81 . . . . 0.0 109.907 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.99 -17.53 44.68 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.442 ' HA ' ' O ' ' A' ' 27' ' ' VAL . 27.8 m-85 -95.05 147.41 23.44 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.24 -1.153 . . . . 0.0 110.283 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 t -128.59 162.44 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.507 -0.746 . . . . 0.0 110.081 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -88.63 110.7 21.15 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.353 -0.842 . . . . 0.0 110.217 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.438 ' HB3' ' CZ3' ' A' ' 25' ' ' TRP . 0.5 OUTLIER -84.08 153.13 23.95 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.494 -0.754 . . . . 0.0 110.396 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -90.57 -4.05 57.14 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.417 -0.802 . . . . 0.0 111.164 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.482 HG22 ' CE2' ' A' ' 23' ' ' TRP . 9.5 m -77.77 -66.74 0.8 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.97 -1.081 . . . . 0.0 110.224 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.592 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 11.8 m95 -104.36 6.8 35.43 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.467 -0.77 . . . . 0.0 110.152 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.2 mttt 52.32 65.22 1.57 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.482 -0.761 . . . . 0.0 110.725 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.592 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.9 OUTLIER -151.35 172.03 16.56 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.319 -0.863 . . . . 0.0 110.842 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.435 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 72.5 m -79.67 118.61 21.65 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.496 -0.753 . . . . 0.0 109.863 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.568 ' HB ' ' CZ2' ' A' ' 25' ' ' TRP . 1.6 p -121.69 160.72 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.497 -0.752 . . . . 0.0 110.529 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -67.53 127.08 31.4 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.167 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.82 117.79 9.42 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.539 -0.726 . . . . 0.0 110.249 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -113.21 96.08 0.79 Allowed Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -74.38 80.58 2.22 Favored 'Trans proline' 0 C--N 1.314 -1.268 0 O-C-N 123.906 1.477 . . . . 0.0 110.218 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 3.7 m-90 . . . . . 0 N--CA 1.501 2.089 0 CA-C-O 118.474 -0.774 . . . . 0.0 110.642 -179.821 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.464 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 93.2 m -110.35 13.58 22.86 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.473 -1.016 . . . . 0.0 110.893 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 tt -65.95 115.06 5.63 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.068 -1.02 . . . . 0.0 110.382 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.88 -29.77 3.48 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.403 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 35.9 t70 -64.88 156.8 29.76 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.403 -1.057 . . . . 0.0 110.538 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.4 ' HG3' ' HB2' ' A' ' 9' ' ' TYR . 0.0 OUTLIER -89.25 149.95 22.85 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.412 -0.805 . . . . 0.0 110.51 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.456 ' SG ' ' SG ' ' A' ' 13' ' ' CYS . 0.1 OUTLIER -105.28 23.46 13.67 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.412 -0.805 . . . . 0.0 110.669 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -116.99 -44.84 2.78 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.233 -0.917 . . . . 0.0 110.487 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.4 ' HB2' ' HG3' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -66.76 -57.86 6.23 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.439 -0.788 . . . . 0.0 110.499 -179.588 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -108.82 -26.35 10.33 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.481 -0.762 . . . . 0.0 110.782 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.4 t30 53.26 50.14 18.29 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.497 -0.752 . . . . 0.0 110.298 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -141.02 85.08 0.21 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 81.8 m -83.83 -169.85 2.78 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.654 -0.909 . . . . 0.0 110.7 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 0.8 OUTLIER -77.82 175.45 9.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.457 -0.777 . . . . 0.0 110.183 179.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 55.6 p -69.01 114.89 7.7 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.334 -0.854 . . . . 0.0 110.111 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.6 4.39 55.97 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 110.229 -1.149 . . . . 0.0 110.229 -179.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.524 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 3.3 m-85 -100.27 144.12 29.66 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.048 -1.266 . . . . 0.0 109.904 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.6 m -123.44 161.47 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.467 -0.77 . . . . 0.0 110.71 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 m -82.6 114.05 20.72 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.592 -0.693 . . . . 0.0 109.891 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.489 ' OG ' HG21 ' A' ' 27' ' ' VAL . 0.3 OUTLIER -70.89 153.13 42.97 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.401 -0.812 . . . . 0.0 110.604 -179.776 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.45 10.76 23.94 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.581 -0.699 . . . . 0.0 110.88 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.5 m -103.15 -78.71 0.54 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.126 -0.984 . . . . 0.0 110.044 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.63 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 23.9 m95 -89.74 6.62 40.77 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.252 -0.905 . . . . 0.0 110.607 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.9 mptt 53.31 54.85 9.57 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.42 -0.8 . . . . 0.0 110.296 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.7 ' CE2' HG22 ' A' ' 27' ' ' VAL . 0.9 OUTLIER -136.32 173.53 11.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.292 -0.88 . . . . 0.0 110.723 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.403 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 85.8 m -73.68 131.19 41.37 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.476 -0.765 . . . . 0.0 111.1 -178.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.7 HG22 ' CE2' ' A' ' 25' ' ' TRP . 2.9 t -135.63 161.67 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.66 -0.65 . . . . 0.0 109.856 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.3 mt -74.52 134.25 42.24 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.441 -0.787 . . . . 0.0 110.23 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.93 128.05 32.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.515 -0.74 . . . . 0.0 110.21 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 89.43 161.26 37.32 Favored Glycine 0 N--CA 1.495 2.603 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -71.82 131.03 17.71 Favored 'Trans proline' 0 C--N 1.312 -1.351 0 O-C-N 123.905 1.477 . . . . 0.0 110.551 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 43.7 m95 . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 117.836 -1.078 . . . . 0.0 110.104 179.966 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.429 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 13.0 m 59.66 38.04 22.12 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.64 -0.918 . . . . 0.0 110.686 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 tt -96.14 107.58 19.92 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.407 -0.808 . . . . 0.0 109.553 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 143.24 -25.16 2.2 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.04 128.23 35.14 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.364 -1.08 . . . . 0.0 110.151 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 25' ' ' TRP . 13.2 pttp -84.62 149.87 25.56 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.552 -0.717 . . . . 0.0 110.55 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 11' ' ' ASN . 28.5 p -143.05 139.74 30.66 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.575 -0.703 . . . . 0.0 110.226 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -103.55 -33.58 8.97 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.565 -0.71 . . . . 0.0 110.879 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -154.88 -59.11 0.11 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.242 -0.911 . . . . 0.0 110.265 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -132.5 46.39 2.64 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.558 -0.714 . . . . 0.0 110.308 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.405 ' HB2' ' HA ' ' A' ' 7' ' ' CYS . 22.7 t-20 -58.18 -49.75 75.94 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.479 -0.763 . . . . 0.0 110.281 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 107.79 80.94 1.31 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 87.8 m -79.91 171.67 14.8 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.403 -1.057 . . . . 0.0 109.55 179.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.0 OUTLIER -67.27 160.1 27.81 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.111 -0.993 . . . . 0.0 110.255 179.777 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 p -59.13 121.07 10.41 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.441 -0.787 . . . . 0.0 110.452 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 103.15 -8.92 53.99 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.401 ' CE1' ' HG ' ' A' ' 28' ' ' LEU . 2.2 m-85 -103.98 148.34 26.31 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.075 -1.25 . . . . 0.0 110.706 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.7 171.11 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.599 -0.688 . . . . 0.0 110.277 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.3 m -94.43 122.56 37.12 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.257 -0.902 . . . . 0.0 110.487 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.534 ' OG ' HG21 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -88.92 165.64 14.47 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.391 -0.818 . . . . 0.0 110.935 179.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -91.31 -30.78 16.38 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.514 -0.741 . . . . 0.0 111.266 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.1 m -55.32 -73.67 0.05 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.476 -0.765 . . . . 0.0 111.142 -178.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.575 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 34.6 m95 -100.2 5.82 44.74 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.145 -0.972 . . . . 0.0 110.95 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 20' ' ' SER . 0.1 OUTLIER 52.6 59.82 4.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.302 -0.873 . . . . 0.0 110.146 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.727 ' CE2' HG22 ' A' ' 27' ' ' VAL . 1.1 p90 -141.18 175.21 9.83 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.377 -0.827 . . . . 0.0 110.72 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.1 m -76.07 127.15 32.36 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.544 -0.723 . . . . 0.0 110.583 -179.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.727 HG22 ' CE2' ' A' ' 25' ' ' TRP . 2.3 t -127.96 159.93 38.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.571 -0.706 . . . . 0.0 109.809 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.401 ' HG ' ' CE1' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -66.2 142.44 57.71 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.36 -0.837 . . . . 0.0 110.322 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.92 -27.46 68.87 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.57 -0.706 . . . . 0.0 110.924 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.7 168.09 32.47 Favored Glycine 0 N--CA 1.494 2.557 0 N-CA-C 109.927 -1.269 . . . . 0.0 109.927 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.73 136.65 28.39 Favored 'Trans proline' 0 C--N 1.313 -1.306 0 O-C-N 123.829 1.436 . . . . 0.0 110.783 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 117.855 -1.069 . . . . 0.0 110.457 -179.888 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.418 0 N-CA-C 109.958 -1.257 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 84.0 m -103.06 4.7 37.49 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.522 -0.987 . . . . 0.0 110.851 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.04 114.06 6.25 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.963 -1.085 . . . . 0.0 109.621 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 122.64 -18.35 8.15 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.49 116.39 3.07 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.364 -1.08 . . . . 0.0 110.04 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.53 138.7 57.69 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.411 -0.806 . . . . 0.0 110.641 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 p -128.62 116.81 20.18 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.724 -0.61 . . . . 0.0 110.24 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.36 -59.79 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.434 -0.791 . . . . 0.0 110.459 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -79.47 -44.13 21.89 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.427 -0.796 . . . . 0.0 110.182 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -96.09 -35.58 11.3 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.445 -0.784 . . . . 0.0 110.149 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 54.86 68.19 0.9 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.656 -0.653 . . . . 0.0 110.684 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.15 84.8 0.2 Allowed Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.2 m -80.52 169.88 17.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.544 -0.974 . . . . 0.0 110.502 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.5 m -78.45 177.26 8.65 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.403 -0.811 . . . . 0.0 110.099 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 37.8 m -64.34 129.43 39.9 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.325 -0.859 . . . . 0.0 109.957 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.32 17.79 75.46 Favored Glycine 0 N--CA 1.493 2.491 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.417 ' HB3' ' HB3' ' A' ' 26' ' ' CYS . 11.9 m-85 -125.48 132.21 52.7 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.292 -1.122 . . . . 0.0 109.666 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.9 m -117.64 146.85 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.327 -0.858 . . . . 0.0 110.648 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.5 t -67.11 119.13 11.53 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.603 -0.685 . . . . 0.0 110.05 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.447 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -75.11 132.69 41.41 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.438 -0.788 . . . . 0.0 110.732 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -81.31 -15.07 56.52 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.489 -0.757 . . . . 0.0 109.535 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.458 HG22 ' CE3' ' A' ' 23' ' ' TRP . 98.4 m -101.32 -44.58 5.6 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.475 -0.766 . . . . 0.0 110.401 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.776 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.4 m95 -91.81 -16.97 26.02 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.448 -0.782 . . . . 0.0 111.218 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.0 12.77 8.94 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.56 -0.713 . . . . 0.0 112.252 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.776 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -124.13 160.16 28.41 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.889 -1.132 . . . . 0.0 109.671 178.743 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 78.8 m -71.39 109.1 5.17 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.38 -0.825 . . . . 0.0 110.957 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.522 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.8 OUTLIER -106.38 165.33 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.471 -0.768 . . . . 0.0 109.815 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.85 148.07 50.28 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.344 -0.848 . . . . 0.0 110.409 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.71 14.72 8.0 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.432 -0.793 . . . . 0.0 111.168 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.06 178.61 49.6 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.86 162.95 40.4 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.77 1.405 . . . . 0.0 110.382 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.07 0 CA-C-O 117.847 -1.073 . . . . 0.0 111.041 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.8 p -92.22 4.36 53.41 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.604 -0.939 . . . . 0.0 111.155 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.1 tp -74.72 123.7 25.42 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.097 -1.002 . . . . 0.0 109.942 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 108.56 -14.14 35.61 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.62 139.76 47.58 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.18 -1.188 . . . . 0.0 109.496 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.74 139.88 52.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.507 -0.746 . . . . 0.0 110.7 -179.456 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.5 t -132.1 144.54 50.79 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.526 -0.734 . . . . 0.0 110.369 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -123.28 -66.78 0.99 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.629 -0.669 . . . . 0.0 109.818 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -157.66 -58.93 0.08 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.496 -0.752 . . . . 0.0 110.254 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -105.81 45.53 0.97 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.564 -0.71 . . . . 0.0 110.396 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -76.97 -45.74 26.5 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.35 -0.844 . . . . 0.0 110.281 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.19 74.63 1.28 Allowed Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.9 m -89.57 -168.46 2.16 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.495 -1.003 . . . . 0.0 110.233 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.507 ' HB2' ' CD1' ' A' ' 17' ' ' TYR . 85.8 m -63.94 162.8 13.18 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.309 -0.869 . . . . 0.0 110.336 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.9 m -67.19 115.38 6.8 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.364 -0.835 . . . . 0.0 109.962 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 103.33 14.15 26.73 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.507 ' CD1' ' HB2' ' A' ' 14' ' ' CYS . 3.3 m-85 -106.56 121.41 44.25 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.157 -1.202 . . . . 0.0 109.993 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -91.0 163.55 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.504 -0.748 . . . . 0.0 110.142 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t -95.97 114.31 26.01 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.575 -0.703 . . . . 0.0 109.801 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.462 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -90.36 111.0 22.06 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.331 -0.855 . . . . 0.0 110.401 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -26.12 53.32 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.404 -0.81 . . . . 0.0 109.646 179.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.437 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 53.0 m -67.46 -44.51 78.44 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.61 -0.681 . . . . 0.0 110.076 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.697 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.5 m95 -98.01 -12.26 22.12 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.443 -0.785 . . . . 0.0 110.665 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 64.95 34.39 9.04 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.576 -0.703 . . . . 0.0 111.547 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.697 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -147.06 154.88 41.71 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.076 -1.015 . . . . 0.0 109.915 178.793 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.31 115.54 15.06 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.362 -0.836 . . . . 0.0 110.886 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.603 HG22 ' NE1' ' A' ' 25' ' ' TRP . 1.0 OUTLIER -106.83 170.21 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.719 -0.613 . . . . 0.0 109.99 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.85 148.34 31.39 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.348 -0.845 . . . . 0.0 110.039 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.15 90.71 6.59 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.413 -0.804 . . . . 0.0 110.421 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.29 -92.36 1.73 Allowed Glycine 0 N--CA 1.494 2.526 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.46 109.11 2.78 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 O-C-N 124.002 1.527 . . . . 0.0 110.391 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 47.6 t-105 . . . . . 0 N--CA 1.495 1.81 0 CA-C-O 117.927 -1.035 . . . . 0.0 110.5 -179.882 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.415 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.1 p -101.59 60.98 0.9 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.474 -1.016 . . . . 0.0 110.542 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.9 tt -78.12 107.16 10.5 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.356 -0.84 . . . . 0.0 109.902 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.01 -16.84 3.66 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.7 122.69 17.84 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.246 -1.15 . . . . 0.0 109.996 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.59 142.39 22.89 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.651 -0.656 . . . . 0.0 111.263 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.7 t -137.03 144.01 43.01 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.595 -0.69 . . . . 0.0 110.079 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -125.59 -67.85 0.86 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.451 -0.781 . . . . 0.0 110.461 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -150.68 -58.43 0.17 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.261 -0.9 . . . . 0.0 110.332 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -104.79 42.44 1.21 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.491 -0.756 . . . . 0.0 110.106 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -89.07 -49.78 6.56 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.321 -0.862 . . . . 0.0 110.141 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.01 106.34 0.65 Allowed Glycine 0 N--CA 1.493 2.451 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.483 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 74.9 m -83.32 -168.35 2.06 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.56 -0.965 . . . . 0.0 110.262 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.0 m -80.51 179.67 7.62 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.262 -0.899 . . . . 0.0 110.729 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.0 p -68.49 122.25 18.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.474 -0.766 . . . . 0.0 109.859 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.09 14.38 69.41 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.483 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 5.1 m-85 -113.77 156.29 24.1 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.307 -1.114 . . . . 0.0 110.191 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.418 ' CG2' ' N ' ' A' ' 19' ' ' CYS . 1.5 p -128.6 163.43 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.418 -0.801 . . . . 0.0 110.623 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.418 ' N ' ' CG2' ' A' ' 18' ' ' VAL . 14.9 t -89.74 109.97 20.91 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.881 -0.512 . . . . 0.0 110.139 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.509 ' HB2' HG23 ' A' ' 27' ' ' VAL . 1.1 m -90.42 120.39 31.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.427 -0.796 . . . . 0.0 110.744 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -30.88 56.13 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.581 -0.699 . . . . 0.0 110.195 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.464 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 19.6 m -61.24 -48.19 82.63 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.497 -0.752 . . . . 0.0 110.235 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.701 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.5 m95 -100.37 -2.52 33.23 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.445 -0.784 . . . . 0.0 110.847 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 mtmm 54.87 35.19 23.77 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.406 -0.809 . . . . 0.0 111.981 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.701 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -144.55 157.36 44.26 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.057 -1.027 . . . . 0.0 109.882 178.731 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.41 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 56.8 m -71.89 104.8 3.6 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.337 -0.852 . . . . 0.0 110.888 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.571 HG22 ' NE1' ' A' ' 25' ' ' TRP . 12.2 t -95.13 163.41 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.55 -0.719 . . . . 0.0 109.461 179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.6 tt -78.17 129.96 35.76 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.339 -0.851 . . . . 0.0 110.189 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.92 107.22 10.29 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.596 -0.69 . . . . 0.0 110.125 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.22 131.75 12.64 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.07 110.87 3.04 Favored 'Trans proline' 0 C--N 1.314 -1.261 0 O-C-N 123.895 1.471 . . . . 0.0 110.482 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 4.4 t90 . . . . . 0 N--CA 1.495 1.798 0 CA-C-O 117.856 -1.069 . . . . 0.0 110.453 -179.88 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.367 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 72.2 m -119.98 35.05 4.98 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.506 -0.996 . . . . 0.0 110.58 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 tt -86.51 130.33 34.53 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.21 -0.932 . . . . 0.0 109.969 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.16 -22.34 36.88 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.892 -1.283 . . . . 0.0 109.892 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -64.26 125.28 24.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.333 -1.098 . . . . 0.0 110.184 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -59.13 151.93 21.48 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.631 -0.668 . . . . 0.0 110.667 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.0 m -69.87 145.99 51.6 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.482 -0.761 . . . . 0.0 110.222 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -82.11 -55.03 4.81 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.437 -0.79 . . . . 0.0 109.889 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -162.24 -58.4 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.69 -0.631 . . . . 0.0 109.481 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -97.21 -33.36 11.51 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.667 -0.645 . . . . 0.0 109.523 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.58 ' HA ' ' HB2' ' A' ' 19' ' ' CYS . 0.9 OUTLIER -163.58 -62.13 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.63 -0.669 . . . . 0.0 109.849 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 58.49 40.42 94.38 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 109.954 -1.258 . . . . 0.0 109.954 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.4 m -125.98 156.65 39.49 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.519 -0.989 . . . . 0.0 110.489 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.9 m -83.03 175.9 9.66 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.521 -0.737 . . . . 0.0 110.134 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.6 m -60.36 124.49 20.47 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.429 -0.794 . . . . 0.0 110.172 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.58 15.42 37.51 Favored Glycine 0 N--CA 1.494 2.556 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -132.23 143.07 49.67 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.298 -1.119 . . . . 0.0 110.21 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.503 HG13 ' HB2' ' A' ' 29' ' ' ALA . 19.7 m -120.27 147.44 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.483 -0.76 . . . . 0.0 110.26 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HB2' ' HA ' ' A' ' 11' ' ' ASN . 42.5 t -78.98 103.07 8.67 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.468 -0.77 . . . . 0.0 109.987 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.457 ' HB2' HG21 ' A' ' 27' ' ' VAL . 26.1 t -72.11 128.57 36.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.476 -0.765 . . . . 0.0 110.217 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.461 ' HA ' ' HE2' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -80.35 -16.06 55.42 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.419 -0.801 . . . . 0.0 110.132 179.292 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 m -84.67 -46.95 10.97 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.339 -0.85 . . . . 0.0 110.263 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.694 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.9 m95 -99.98 -15.73 18.19 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.384 -0.823 . . . . 0.0 110.926 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 11.5 mmtt 62.92 35.67 13.26 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.72 -0.613 . . . . 0.0 111.844 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.694 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -136.36 158.48 44.32 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.098 -1.001 . . . . 0.0 109.378 178.121 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.4 m -70.56 104.36 2.77 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.334 -0.854 . . . . 0.0 110.744 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.573 HG22 ' NE1' ' A' ' 25' ' ' TRP . 2.0 t -99.09 156.55 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 109.567 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -65.74 128.55 36.41 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.465 -0.772 . . . . 0.0 110.197 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.503 ' HB2' HG13 ' A' ' 18' ' ' VAL . . . -68.79 101.39 1.33 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.587 -0.696 . . . . 0.0 110.338 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -106.51 -152.7 19.61 Favored Glycine 0 N--CA 1.493 2.488 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -72.16 -28.91 15.08 Favored 'Trans proline' 0 C--N 1.313 -1.297 0 O-C-N 123.96 1.505 . . . . 0.0 111.034 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.6 m0 . . . . . 0 N--CA 1.497 1.894 0 CA-C-O 117.887 -1.054 . . . . 0.0 110.274 -179.879 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.368 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 14' ' ' CYS . 14.1 m -90.48 -9.16 48.4 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.503 -0.998 . . . . 0.0 111.167 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 27' ' ' VAL . 4.2 tp -58.81 120.75 9.57 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.19 -0.944 . . . . 0.0 110.01 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.1 -23.23 6.95 Favored Glycine 0 N--CA 1.493 2.498 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.459 ' O ' ' HA ' ' A' ' 25' ' ' TRP . 23.7 t70 -65.3 156.14 33.0 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.264 -1.139 . . . . 0.0 110.069 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -90.3 147.94 23.19 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.404 -0.81 . . . . 0.0 111.102 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.8 p -140.98 155.2 46.27 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.498 -0.751 . . . . 0.0 109.811 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -122.64 -69.37 0.83 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.336 -0.853 . . . . 0.0 110.443 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -160.62 -55.86 0.05 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.407 -0.808 . . . . 0.0 109.903 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -106.62 15.13 26.13 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.656 -0.653 . . . . 0.0 110.414 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -72.34 -48.87 38.55 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.221 -0.925 . . . . 0.0 109.958 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.43 109.69 2.74 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.8 m -79.79 -166.53 1.02 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.549 -0.971 . . . . 0.0 110.033 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 2' ' ' CYS . 0.5 OUTLIER -71.92 170.81 12.96 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.273 -0.892 . . . . 0.0 110.754 -179.883 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.8 m -66.16 115.3 6.02 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.551 -0.718 . . . . 0.0 109.806 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.36 -17.22 59.4 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.836 -1.306 . . . . 0.0 109.836 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -89.58 140.24 29.74 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.281 -1.129 . . . . 0.0 110.159 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 4.2 t -103.53 160.73 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.524 -0.735 . . . . 0.0 109.741 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.9 t -92.56 115.95 28.56 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.482 -0.761 . . . . 0.0 109.903 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.522 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -77.29 115.9 17.45 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.525 -0.734 . . . . 0.0 110.118 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -78.29 -13.82 59.69 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.512 -0.742 . . . . 0.0 109.855 179.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.486 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 49.8 m -91.09 -44.78 9.07 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.458 -0.776 . . . . 0.0 110.187 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.696 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.2 m95 -96.18 -13.62 23.38 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.411 -0.805 . . . . 0.0 110.897 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 3.2 mmmm 66.03 31.34 9.09 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.62 -0.675 . . . . 0.0 111.905 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.696 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -139.02 156.06 47.5 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.062 -1.024 . . . . 0.0 109.673 178.429 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.4 m -73.16 109.97 7.09 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.183 -0.948 . . . . 0.0 110.869 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.689 HG22 ' NE1' ' A' ' 25' ' ' TRP . 1.6 t -104.6 156.38 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.513 -0.742 . . . . 0.0 109.808 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.8 tp -79.09 147.13 32.88 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.407 -0.808 . . . . 0.0 109.949 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.34 88.55 2.58 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.465 -0.772 . . . . 0.0 110.191 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -154.8 -176.11 26.67 Favored Glycine 0 N--CA 1.495 2.627 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.58 -14.49 24.78 Favored 'Trans proline' 0 C--N 1.314 -1.24 0 O-C-N 123.874 1.46 . . . . 0.0 111.541 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 3.6 m0 . . . . . 0 N--CA 1.5 2.059 0 CA-C-O 117.872 -1.061 . . . . 0.0 110.533 -179.996 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.443 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.5 p -109.73 58.52 0.61 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.489 -1.006 . . . . 0.0 110.557 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.425 HD23 ' N ' ' A' ' 4' ' ' GLY . 3.4 tt -81.79 132.3 35.28 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.316 -0.865 . . . . 0.0 109.988 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.425 ' N ' HD23 ' A' ' 3' ' ' LEU . . . 116.26 -30.19 6.63 Favored Glycine 0 N--CA 1.496 2.679 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.67 140.55 57.43 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.369 -1.077 . . . . 0.0 110.144 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -82.08 136.84 35.14 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.337 -0.852 . . . . 0.0 110.519 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.7 p -115.45 106.84 14.43 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.61 -0.681 . . . . 0.0 110.13 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -149.55 -48.84 0.14 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.672 -0.643 . . . . 0.0 110.514 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -70.06 -50.11 44.41 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.489 -0.757 . . . . 0.0 109.978 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -101.7 -30.33 11.39 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.599 -0.688 . . . . 0.0 110.605 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 t30 54.76 50.66 15.28 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.574 -0.704 . . . . 0.0 110.282 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -152.4 90.43 0.13 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.114 -1.594 . . . . 0.0 109.114 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 63.3 m -79.86 -160.6 0.28 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.669 -0.9 . . . . 0.0 110.448 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.6 m -75.74 173.41 11.15 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.429 -0.794 . . . . 0.0 110.358 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 p -64.02 123.94 20.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.36 -0.838 . . . . 0.0 109.918 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.61 -21.86 43.85 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -92.89 120.24 33.02 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.199 -1.177 . . . . 0.0 110.138 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.0 t -100.59 163.77 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.61 -0.681 . . . . 0.0 109.872 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t -91.21 108.76 20.09 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.551 -0.718 . . . . 0.0 110.144 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.446 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -66.32 146.2 54.86 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.52 -0.738 . . . . 0.0 110.174 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.44 -29.54 17.91 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.481 -0.762 . . . . 0.0 110.918 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.464 HG22 ' CE3' ' A' ' 23' ' ' TRP . 41.3 m -78.15 -49.43 13.87 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.287 -0.883 . . . . 0.0 110.927 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.602 ' CB ' ' CE3' ' A' ' 25' ' ' TRP . 6.9 m95 -96.08 -18.1 20.42 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.337 -0.852 . . . . 0.0 110.83 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 15.0 mttt 63.76 31.36 14.27 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.645 -0.66 . . . . 0.0 111.837 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.671 ' NE1' HG22 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -121.65 162.13 21.25 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 120.987 -1.071 . . . . 0.0 109.666 178.339 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.414 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 84.7 m -71.62 104.74 3.42 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.364 -0.835 . . . . 0.0 110.892 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.671 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.9 OUTLIER -106.53 161.08 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.541 -0.724 . . . . 0.0 109.69 179.808 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.33 149.05 50.96 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.367 -0.833 . . . . 0.0 110.285 179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.58 66.72 9.67 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.442 -0.786 . . . . 0.0 110.539 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.94 -78.68 1.23 Allowed Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -75.15 -170.58 0.81 Allowed 'Trans proline' 0 C--N 1.314 -1.279 0 O-C-N 124.022 1.538 . . . . 0.0 110.528 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 . . . . . 0 N--CA 1.498 1.955 0 O-C-N 121.237 -0.915 . . . . 0.0 110.31 179.969 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.404 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.7 p -101.26 57.1 0.85 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.387 -1.066 . . . . 0.0 110.369 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.59 113.64 10.94 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.406 -0.809 . . . . 0.0 110.297 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.51 -21.64 4.25 Favored Glycine 0 N--CA 1.495 2.621 0 N-CA-C 110.319 -1.113 . . . . 0.0 110.319 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.82 123.75 17.51 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.277 -1.131 . . . . 0.0 110.277 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -69.27 135.07 49.95 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.479 -0.763 . . . . 0.0 110.794 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -121.13 146.06 47.16 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.645 -0.659 . . . . 0.0 109.826 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -133.86 -45.57 0.8 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.446 -0.784 . . . . 0.0 110.847 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -169.91 -55.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.327 -0.858 . . . . 0.0 109.826 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -104.63 22.11 15.62 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.675 -0.641 . . . . 0.0 110.584 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.0 t30 -74.49 -59.71 2.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.189 -0.944 . . . . 0.0 110.045 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.25 105.98 0.67 Allowed Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 69.1 m -81.05 179.02 8.05 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.525 -0.985 . . . . 0.0 110.324 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 76.7 m -75.0 174.07 9.84 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.434 -0.791 . . . . 0.0 110.409 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.7 m -66.34 119.32 11.37 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.443 -0.786 . . . . 0.0 109.831 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.97 -22.67 39.19 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -89.59 147.98 23.62 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.284 -1.127 . . . . 0.0 109.942 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.42 ' CG1' ' HB2' ' A' ' 29' ' ' ALA . 27.6 m -130.15 151.46 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.607 -0.683 . . . . 0.0 110.425 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.464 ' SG ' ' SG ' ' A' ' 13' ' ' CYS . 73.8 m -73.45 103.28 4.04 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.464 -0.772 . . . . 0.0 109.985 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.2 t -73.86 137.63 43.88 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.412 -0.805 . . . . 0.0 110.24 -179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.67 -26.68 27.61 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.52 -0.738 . . . . 0.0 110.341 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.9 m -73.39 -45.61 53.75 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.416 -0.802 . . . . 0.0 110.28 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.789 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 5.8 m95 -100.12 -13.43 18.98 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.385 -0.822 . . . . 0.0 111.222 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.6 OUTLIER 62.76 31.66 16.43 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.529 -0.732 . . . . 0.0 111.938 179.78 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.789 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -141.97 160.82 39.44 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.022 -1.049 . . . . 0.0 109.853 178.344 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.401 ' N ' ' HD1' ' A' ' 25' ' ' TRP . 71.0 m -66.49 107.39 2.05 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.349 -0.844 . . . . 0.0 111.473 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.662 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.9 OUTLIER -117.38 172.5 5.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.51 -0.744 . . . . 0.0 109.467 179.268 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.43 ' HA ' HD22 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -73.1 131.27 41.87 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.165 -0.959 . . . . 0.0 110.154 179.669 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.42 ' HB2' ' CG1' ' A' ' 18' ' ' VAL . . . -66.91 124.4 22.88 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.48 -0.762 . . . . 0.0 110.49 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -149.72 159.28 28.02 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -72.92 158.75 49.41 Favored 'Trans proline' 0 C--N 1.313 -1.304 0 O-C-N 123.976 1.514 . . . . 0.0 110.782 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 43.0 m0 . . . . . 0 N--CA 1.502 2.144 0 CA-C-O 118.626 -0.702 . . . . 0.0 110.471 -179.908 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.409 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . 89.7 m -103.58 9.66 37.33 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.473 -1.016 . . . . 0.0 111.077 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.8 97.73 0.85 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.093 -1.004 . . . . 0.0 109.918 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.22 -22.47 3.57 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.56 128.18 34.79 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.256 -1.144 . . . . 0.0 110.084 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.81 159.27 32.16 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.479 -0.763 . . . . 0.0 110.238 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.43 156.05 38.68 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.538 -0.726 . . . . 0.0 110.101 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -130.98 -65.91 0.77 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.475 -0.766 . . . . 0.0 110.393 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -164.46 -51.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.401 -0.812 . . . . 0.0 110.767 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -94.3 9.84 36.53 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.402 -0.812 . . . . 0.0 111.19 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 58.09 70.32 0.66 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.359 -0.838 . . . . 0.0 110.29 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -87.93 59.36 4.25 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 17' ' ' TYR . 87.2 m -89.61 178.6 6.24 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.496 -1.003 . . . . 0.0 109.897 179.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.1 m -75.52 179.81 5.07 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.177 -0.952 . . . . 0.0 110.62 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.5 m -68.56 112.58 5.44 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.549 -0.72 . . . . 0.0 109.996 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.77 -7.07 67.71 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.106 -1.197 . . . . 0.0 110.106 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.486 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 3.6 m-85 -91.21 137.49 32.32 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.192 -1.181 . . . . 0.0 110.1 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.2 t -123.82 164.04 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.43 -0.794 . . . . 0.0 110.412 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' TRP . 11.7 t -85.23 119.45 25.62 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.454 -0.779 . . . . 0.0 110.299 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.47 ' CB ' ' CZ3' ' A' ' 25' ' ' TRP . 0.6 OUTLIER -83.39 166.81 18.1 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.493 -0.754 . . . . 0.0 110.599 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.64 -24.4 20.51 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.533 -0.73 . . . . 0.0 111.194 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.5 m -62.48 -81.6 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.274 -0.891 . . . . 0.0 110.851 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.591 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 37.9 m95 -89.52 4.08 50.39 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.201 -0.937 . . . . 0.0 110.738 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 20' ' ' SER . 18.0 mtpt 52.53 62.69 2.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.333 -0.855 . . . . 0.0 110.114 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.591 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.4 p90 -144.32 175.4 10.12 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.466 -0.771 . . . . 0.0 110.66 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.8 m -81.53 122.51 27.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.465 -0.772 . . . . 0.0 110.281 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.456 HG22 ' N ' ' A' ' 28' ' ' LEU . 2.0 p -134.39 166.83 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.573 -0.704 . . . . 0.0 110.079 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.456 ' N ' HG22 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -73.24 139.02 45.91 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.883 -0.511 . . . . 0.0 110.51 -179.853 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.36 166.98 19.97 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.482 -0.761 . . . . 0.0 110.499 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 140.82 171.44 12.53 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -78.14 171.99 63.87 Favored 'Cis proline' 0 C--N 1.317 -1.13 0 C-N-CA 121.713 -2.203 . . . . 0.0 110.591 -0.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 . . . . . 0 N--CA 1.496 1.85 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.43 179.802 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.593 0 N-CA-C 110.036 -1.225 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 65.2 m -124.83 51.23 1.66 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.399 -1.059 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.64 103.96 16.41 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.272 -0.892 . . . . 0.0 109.829 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.41 -18.33 3.93 Favored Glycine 0 N--CA 1.495 2.584 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.28 121.57 8.52 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.475 -1.014 . . . . 0.0 110.274 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.86 141.54 47.95 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.312 -0.867 . . . . 0.0 110.715 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.62 141.75 58.35 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.608 -0.682 . . . . 0.0 110.129 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -106.84 -66.47 1.01 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.373 -0.829 . . . . 0.0 110.694 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -141.1 -60.45 0.49 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.231 -0.918 . . . . 0.0 110.309 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -98.01 -35.13 10.54 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.523 -0.736 . . . . 0.0 109.947 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -167.35 -65.16 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.644 -0.66 . . . . 0.0 109.916 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 67.88 36.02 85.88 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 109.852 -1.299 . . . . 0.0 109.852 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 48.4 m -120.55 -179.56 4.02 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.527 -0.984 . . . . 0.0 110.162 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 62.1 m -99.5 177.21 5.24 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.427 -0.796 . . . . 0.0 110.047 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.3 m -62.79 124.62 21.5 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.393 -0.817 . . . . 0.0 110.288 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.07 14.32 60.79 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -128.17 125.15 38.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.138 -1.213 . . . . 0.0 110.409 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.759 HG23 ' HB2' ' A' ' 29' ' ' ALA . 3.1 t -103.04 159.68 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.521 -0.737 . . . . 0.0 109.549 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.69 116.51 24.01 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.371 -0.83 . . . . 0.0 109.969 179.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.438 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -75.51 127.46 33.14 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.55 -0.719 . . . . 0.0 110.475 -179.804 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -80.94 -12.7 59.35 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.476 -0.765 . . . . 0.0 110.192 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.8 m -89.99 -45.98 8.82 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.377 -0.827 . . . . 0.0 109.988 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.716 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 8.2 m95 -97.58 -11.53 23.55 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.528 -0.732 . . . . 0.0 110.926 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.88 22.86 11.37 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.446 -0.784 . . . . 0.0 112.032 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.716 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -131.97 155.13 48.51 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.866 -1.146 . . . . 0.0 109.912 178.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 18' ' ' VAL . 68.4 m -72.81 109.36 6.35 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.468 -0.77 . . . . 0.0 110.841 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.686 HG22 ' NE1' ' A' ' 25' ' ' TRP . 2.8 t -99.23 167.58 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.523 -0.736 . . . . 0.0 109.692 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.97 132.44 47.3 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.286 -0.884 . . . . 0.0 110.622 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.759 ' HB2' HG23 ' A' ' 18' ' ' VAL . . . -88.57 170.43 10.86 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.655 -0.653 . . . . 0.0 110.717 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -156.49 -178.44 30.61 Favored Glycine 0 N--CA 1.496 2.663 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -76.4 145.78 82.94 Favored 'Cis proline' 0 C--N 1.315 -1.203 0 C-N-CA 121.759 -2.184 . . . . 0.0 110.613 -0.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 48.2 t-105 . . . . . 0 N--CA 1.494 1.754 0 CA-C-O 117.85 -1.072 . . . . 0.0 110.534 179.86 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.472 0 N-CA-C 109.731 -1.347 . . . . 0.0 109.731 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.7 m -107.76 38.16 2.24 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.481 -1.011 . . . . 0.0 110.379 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' A' ' 27' ' ' VAL . 11.3 tp -72.5 109.43 6.17 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.306 -0.871 . . . . 0.0 110.193 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.87 -22.48 6.82 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 110.108 -1.197 . . . . 0.0 110.108 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.8 118.33 7.57 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.284 -1.127 . . . . 0.0 109.963 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -64.58 146.6 54.39 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.223 -0.923 . . . . 0.0 109.849 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 98.0 m -63.89 161.93 14.67 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.383 -0.823 . . . . 0.0 110.032 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.5 -82.64 0.39 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.207 -0.933 . . . . 0.0 109.941 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -115.74 -55.54 2.42 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.454 -0.779 . . . . 0.0 109.502 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -121.38 -27.21 4.87 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.636 -0.665 . . . . 0.0 110.485 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -176.82 84.19 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.36 -0.837 . . . . 0.0 109.82 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -97.58 64.08 0.92 Allowed Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 67.0 m -126.15 144.84 50.6 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.633 -0.922 . . . . 0.0 110.294 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 28.6 p -69.61 166.17 19.6 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.489 -0.757 . . . . 0.0 110.336 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.87 129.15 38.4 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.466 -0.771 . . . . 0.0 110.524 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.5 -27.65 17.29 Favored Glycine 0 N--CA 1.494 2.538 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -108.28 134.67 50.78 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.275 -1.132 . . . . 0.0 110.361 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 35.3 m -103.98 149.36 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.487 -0.758 . . . . 0.0 110.701 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.3 t -75.37 113.83 13.2 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.524 -0.735 . . . . 0.0 110.329 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.503 ' HB2' ' O ' ' A' ' 25' ' ' TRP . 0.3 OUTLIER -82.4 126.12 31.82 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.416 -0.802 . . . . 0.0 110.044 179.634 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.7 mtt-85 -80.86 -23.4 39.09 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.343 -0.848 . . . . 0.0 110.411 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.455 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 25.4 m -77.02 -46.84 22.41 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.441 -0.787 . . . . 0.0 110.165 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.741 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 7.7 m95 -97.26 -6.18 35.09 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.487 -0.758 . . . . 0.0 110.741 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 4.1 mmmm 58.37 26.06 13.6 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.583 -0.698 . . . . 0.0 111.582 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.741 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -134.12 152.96 52.08 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.1 -1.0 . . . . 0.0 109.855 178.841 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.7 m -71.15 109.62 5.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.366 -0.834 . . . . 0.0 110.729 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.636 ' HA ' HD12 ' A' ' 3' ' ' LEU . 2.1 t -99.97 159.45 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 121.469 -0.77 . . . . 0.0 109.939 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.457 HD23 HD13 ' A' ' 3' ' ' LEU . 1.5 pp -74.11 146.82 43.26 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.382 -0.824 . . . . 0.0 110.563 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -105.87 120.55 42.03 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.594 -0.691 . . . . 0.0 109.852 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.482 ' HA3' ' HA ' ' A' ' 31' ' ' PRO . . . -170.9 -128.36 1.02 Allowed Glycine 0 N--CA 1.494 2.552 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.482 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 46.9 Cg_endo -72.96 161.87 92.81 Favored 'Cis proline' 0 N--CA 1.49 1.274 0 C-N-CA 121.866 -2.139 . . . . 0.0 110.875 0.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.901 0 CA-C-O 117.861 -1.066 . . . . 0.0 110.61 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.462 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 86.4 m -103.18 20.67 17.25 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.44 -1.036 . . . . 0.0 110.915 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.97 111.02 12.07 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.031 -1.043 . . . . 0.0 109.892 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.16 -25.78 3.3 Favored Glycine 0 N--CA 1.494 2.567 0 N-CA-C 109.826 -1.31 . . . . 0.0 109.826 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -66.99 118.2 10.12 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.411 -1.052 . . . . 0.0 110.287 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 25' ' ' TRP . 8.7 mptt -70.27 150.3 46.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.448 -0.783 . . . . 0.0 110.584 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 99.0 m -75.72 179.3 5.5 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.533 -0.729 . . . . 0.0 110.208 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -137.62 -58.32 0.68 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.381 -0.824 . . . . 0.0 110.675 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -154.74 -53.21 0.09 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.402 -0.811 . . . . 0.0 110.731 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -94.29 10.05 35.66 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.445 -0.784 . . . . 0.0 111.417 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 52.46 67.17 1.02 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.344 -0.847 . . . . 0.0 109.938 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -93.5 62.15 2.04 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 16.7 m -79.42 163.62 24.65 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.502 -0.999 . . . . 0.0 109.681 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 40.0 m -61.9 166.59 4.4 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.309 -0.869 . . . . 0.0 110.783 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.8 p -64.71 128.23 34.91 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.359 -0.838 . . . . 0.0 109.98 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.5 6.82 62.31 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -120.42 153.73 36.15 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.196 -1.179 . . . . 0.0 110.01 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.22 147.02 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.39 -0.819 . . . . 0.0 110.328 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.8 t -81.13 119.43 23.56 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.445 -0.784 . . . . 0.0 110.154 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.483 ' HB3' ' CZ3' ' A' ' 25' ' ' TRP . 0.4 OUTLIER -89.42 154.44 20.05 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.487 -0.758 . . . . 0.0 110.333 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -11.7 39.25 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.428 -0.795 . . . . 0.0 111.199 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.461 HG22 ' CE2' ' A' ' 23' ' ' TRP . 6.2 m -69.29 -65.17 0.74 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.259 -0.901 . . . . 0.0 110.267 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.582 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 9.0 m95 -106.93 5.33 28.17 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.414 -0.804 . . . . 0.0 110.423 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.2 mttm 54.37 62.83 2.39 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.436 -0.79 . . . . 0.0 110.801 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.71 ' CE2' HG22 ' A' ' 27' ' ' VAL . 0.8 OUTLIER -148.83 171.31 16.49 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.331 -0.856 . . . . 0.0 110.579 179.664 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.9 m -77.51 129.98 36.38 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.51 -0.744 . . . . 0.0 110.716 -179.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.71 HG22 ' CE2' ' A' ' 25' ' ' TRP . 1.8 t -126.44 167.93 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.557 -0.714 . . . . 0.0 109.829 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -66.85 141.95 57.5 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.301 -0.874 . . . . 0.0 110.102 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.79 97.86 6.81 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.508 -0.745 . . . . 0.0 110.254 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.4 ' HA3' ' C ' ' A' ' 31' ' ' PRO . . . -133.66 -92.61 0.48 Allowed Glycine 0 N--CA 1.493 2.485 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.4 ' C ' ' HA3' ' A' ' 30' ' ' GLY . 50.8 Cg_endo -77.51 158.76 95.15 Favored 'Cis proline' 0 N--CA 1.487 1.099 0 C-N-CA 121.778 -2.176 . . . . 0.0 110.563 -0.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.797 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.569 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.354 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 56.4 m -92.82 -17.35 24.23 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.398 -1.06 . . . . 0.0 110.896 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.509 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 0.5 OUTLIER -61.79 112.56 2.33 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.17 -0.956 . . . . 0.0 110.119 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.14 -27.43 4.81 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.15 113.08 3.31 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.446 -1.032 . . . . 0.0 110.105 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -66.39 130.73 44.2 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.514 -0.741 . . . . 0.0 110.598 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 t -110.47 140.47 44.7 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.529 -0.732 . . . . 0.0 109.988 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -151.04 -58.76 0.17 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.553 -0.717 . . . . 0.0 110.979 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -104.99 -75.05 0.63 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.359 -0.838 . . . . 0.0 110.685 -179.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -137.38 56.65 1.77 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.279 -0.888 . . . . 0.0 110.247 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.44 -51.62 49.32 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.447 -0.783 . . . . 0.0 110.196 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 74.78 92.47 0.16 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 179.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.7 m -83.63 164.43 19.71 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.515 -0.991 . . . . 0.0 109.941 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 26.3 p -77.3 177.02 8.25 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.371 -0.831 . . . . 0.0 110.701 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 73.3 p -58.38 140.3 53.87 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.378 -0.826 . . . . 0.0 110.697 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.3 1.98 89.29 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 -179.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -133.09 137.75 46.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.162 -1.199 . . . . 0.0 110.23 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 30.2 m -139.78 160.08 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.475 -0.765 . . . . 0.0 110.544 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -72.26 112.17 8.1 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.46 -0.775 . . . . 0.0 109.924 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.565 ' HB3' ' HB2' ' A' ' 23' ' ' TRP . 8.7 t -89.56 158.1 17.79 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.347 -0.846 . . . . 0.0 110.819 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -88.73 -47.84 7.95 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.54 -0.725 . . . . 0.0 109.686 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 50.9 m -65.72 -38.68 89.84 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.642 -0.661 . . . . 0.0 110.005 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.565 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 6.8 m95 -90.47 -32.03 16.54 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.614 -0.679 . . . . 0.0 110.593 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 66.44 27.87 9.74 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.525 -0.734 . . . . 0.0 111.384 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.586 ' NE1' HG22 ' A' ' 27' ' ' VAL . 1.2 p90 -150.5 175.21 12.1 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.188 -0.945 . . . . 0.0 109.738 178.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.509 ' O ' ' HA ' ' A' ' 3' ' ' LEU . 77.8 m -71.63 100.32 2.27 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.094 -1.004 . . . . 0.0 109.525 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.586 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.6 OUTLIER -106.53 157.04 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.479 -0.763 . . . . 0.0 110.186 -179.287 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.27 135.94 57.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.658 -0.651 . . . . 0.0 110.166 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -93.63 59.59 2.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.458 -0.776 . . . . 0.0 110.411 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -92.18 178.94 40.6 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.427 ' O ' ' CB ' ' A' ' 32' ' ' TRP . 46.9 Cg_endo -73.72 162.51 91.93 Favored 'Cis proline' 0 N--CA 1.488 1.204 0 C-N-CA 121.616 -2.243 . . . . 0.0 110.57 0.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.427 ' CB ' ' O ' ' A' ' 31' ' ' PRO . 1.0 OUTLIER . . . . . 0 N--CA 1.503 2.211 0 CA-C-O 117.726 -1.13 . . . . 0.0 110.695 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.361 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 59.2 m -105.44 29.11 6.76 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.471 -1.017 . . . . 0.0 110.606 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.475 HD12 ' HE1' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -84.76 109.64 18.21 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.345 -0.847 . . . . 0.0 109.77 179.658 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 136.09 -21.43 3.51 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.871 -1.292 . . . . 0.0 109.871 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -66.66 110.68 3.31 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.236 -1.155 . . . . 0.0 109.753 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -65.35 149.36 50.11 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.439 -0.788 . . . . 0.0 110.642 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.533 ' HB2' ' HB3' ' A' ' 11' ' ' ASN . 29.7 p -149.06 157.62 43.55 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.537 -0.727 . . . . 0.0 110.325 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -118.55 -60.06 1.81 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.424 -0.797 . . . . 0.0 110.638 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -146.5 -57.51 0.28 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.33 -0.856 . . . . 0.0 110.687 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -106.33 38.78 1.96 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.42 -0.8 . . . . 0.0 110.592 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.533 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 28.4 t-20 -73.26 -57.7 3.83 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.232 -0.918 . . . . 0.0 109.965 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 92.66 95.77 1.42 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 71.4 m -90.9 -176.99 4.83 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.494 -1.004 . . . . 0.0 110.262 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.0 m -73.58 158.21 35.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.387 -0.821 . . . . 0.0 109.765 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 71.1 p -56.65 121.98 11.0 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.388 -0.82 . . . . 0.0 110.166 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.62 -23.19 30.45 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.475 ' HE1' HD12 ' A' ' 3' ' ' LEU . 15.9 m-85 -93.63 143.7 26.06 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.271 -1.135 . . . . 0.0 110.358 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 32.8 m -130.89 160.3 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.452 -0.78 . . . . 0.0 110.304 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -77.48 119.19 20.73 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.391 -0.818 . . . . 0.0 110.226 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.6 ' HB3' ' HB2' ' A' ' 23' ' ' TRP . 28.7 t -90.79 153.43 20.25 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.529 -0.732 . . . . 0.0 110.404 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.79 -49.66 9.49 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.348 -0.845 . . . . 0.0 109.57 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.2 m -66.61 -44.46 82.06 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.505 -0.747 . . . . 0.0 109.912 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.62 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 5.8 m95 -81.7 -31.02 32.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.67 -0.644 . . . . 0.0 110.73 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.3 OUTLIER 62.06 25.21 15.09 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.344 -0.847 . . . . 0.0 111.226 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.701 ' NE1' HG22 ' A' ' 27' ' ' VAL . 1.3 p90 -144.45 176.65 9.22 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.105 -0.997 . . . . 0.0 109.913 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.2 m -70.84 101.0 2.03 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.246 -0.909 . . . . 0.0 110.338 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.701 HG22 ' NE1' ' A' ' 25' ' ' TRP . 0.8 OUTLIER -113.11 158.28 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.621 -0.674 . . . . 0.0 109.517 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.2 128.01 34.79 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.07 139.96 57.6 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.462 -0.774 . . . . 0.0 110.429 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -145.78 -167.05 12.28 Favored Glycine 0 N--CA 1.495 2.608 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -75.68 174.9 50.42 Favored 'Cis proline' 0 N--CA 1.489 1.246 0 C-N-CA 121.645 -2.231 . . . . 0.0 110.833 -0.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 2.9 m95 . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.427 179.979 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.57 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 95.5 m -99.62 0.53 42.29 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.275 -1.132 . . . . 0.0 110.966 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 tt -72.98 101.17 3.15 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.138 -0.976 . . . . 0.0 110.043 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 134.13 -16.75 4.39 Favored Glycine 0 N--CA 1.494 2.505 0 N-CA-C 110.021 -1.231 . . . . 0.0 110.021 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -61.51 123.66 18.47 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.367 -1.078 . . . . 0.0 110.441 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -66.97 149.22 50.93 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.54 -0.725 . . . . 0.0 111.097 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.53 154.92 31.0 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.541 -0.724 . . . . 0.0 110.137 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.3 -65.27 1.19 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.441 -0.787 . . . . 0.0 110.257 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -129.7 -67.76 0.74 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.506 -0.746 . . . . 0.0 109.821 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -118.76 -17.16 9.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.548 -0.72 . . . . 0.0 110.644 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -149.45 -66.58 0.22 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.157 -0.964 . . . . 0.0 110.173 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 55.58 37.68 68.49 Favored Glycine 0 N--CA 1.495 2.585 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 95.5 m -128.48 170.58 12.99 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.475 -1.015 . . . . 0.0 110.669 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 86.4 m -87.06 176.02 7.82 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.532 -0.73 . . . . 0.0 109.862 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.05 116.29 6.31 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.329 -0.857 . . . . 0.0 109.917 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 102.51 7.52 45.37 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -125.08 137.84 54.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.228 -1.16 . . . . 0.0 110.096 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.4 t -118.27 162.64 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.364 -0.835 . . . . 0.0 110.22 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 11.2 t -77.11 117.31 18.54 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.452 -0.78 . . . . 0.0 109.967 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 t -71.6 133.57 45.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.605 -0.685 . . . . 0.0 110.453 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -15.06 53.63 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.367 -0.833 . . . . 0.0 110.178 179.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.465 HG22 ' CZ3' ' A' ' 23' ' ' TRP . 21.1 m -94.81 -46.02 7.07 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.402 -0.811 . . . . 0.0 110.491 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.615 ' CB ' ' CE3' ' A' ' 25' ' ' TRP . 6.8 m95 -101.03 -13.11 18.37 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.411 -0.806 . . . . 0.0 111.093 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 8.3 mmtt 66.5 15.48 10.12 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.582 -0.698 . . . . 0.0 111.916 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.653 ' CE2' HG12 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -117.54 157.66 25.95 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.893 -1.13 . . . . 0.0 109.633 178.773 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.5 m -62.59 101.41 0.25 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.467 -0.771 . . . . 0.0 111.076 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.653 HG12 ' CE2' ' A' ' 25' ' ' TRP . 11.4 m -102.53 153.85 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.581 -0.699 . . . . 0.0 109.829 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 tp -68.0 138.87 56.22 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.519 -0.738 . . . . 0.0 110.582 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.21 121.87 13.64 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.64 -0.662 . . . . 0.0 110.519 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' A' ' 31' ' ' PRO . . . -134.53 -155.81 7.61 Favored Glycine 0 N--CA 1.497 2.736 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.456 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 51.8 Cg_endo -78.42 -165.3 4.5 Favored 'Cis proline' 0 N--CA 1.489 1.237 0 C-N-CA 122.073 -2.053 . . . . 0.0 110.798 -0.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 . . . . . 0 N--CA 1.5 2.027 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.694 -179.938 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.484 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.472 ' HB2' ' CG ' ' A' ' 17' ' ' TYR . 61.5 m -109.21 8.04 25.65 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.557 -0.967 . . . . 0.0 110.986 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.534 HD12 ' HE2' ' A' ' 17' ' ' TYR . 0.9 OUTLIER -69.36 131.74 45.29 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.037 -1.04 . . . . 0.0 110.116 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 112.24 -24.58 13.92 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -61.49 118.82 7.49 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.404 -1.056 . . . . 0.0 110.158 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -70.58 139.48 51.46 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.433 -0.792 . . . . 0.0 110.754 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.451 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 69.8 m -121.06 177.32 5.17 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.628 -0.67 . . . . 0.0 110.226 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -131.18 -57.81 1.01 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.466 -0.771 . . . . 0.0 110.172 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -148.64 -60.66 0.24 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.533 -0.73 . . . . 0.0 109.976 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -129.93 38.15 3.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 0.0 110.098 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -54.18 -51.27 64.9 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.554 -0.716 . . . . 0.0 110.107 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.45 94.74 0.54 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.53 -175.2 5.07 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.447 -1.031 . . . . 0.0 109.884 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.0 p -60.72 157.41 14.8 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.262 -0.899 . . . . 0.0 110.297 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 m -55.77 125.34 20.84 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.486 -0.759 . . . . 0.0 110.301 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 113.33 -20.52 18.66 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.534 ' HE2' HD12 ' A' ' 3' ' ' LEU . 6.6 m-85 -113.37 152.72 29.62 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.286 -1.126 . . . . 0.0 110.58 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.15 138.59 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.606 -0.684 . . . . 0.0 110.405 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.1 m -74.92 119.6 19.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.446 -0.784 . . . . 0.0 109.889 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 89.9 p -81.36 132.59 35.34 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.461 -0.775 . . . . 0.0 110.772 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -80.32 -13.66 59.0 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.507 -0.746 . . . . 0.0 110.304 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.521 HG22 ' CE3' ' A' ' 23' ' ' TRP . 53.1 m -90.82 -49.21 6.57 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.338 -0.851 . . . . 0.0 110.181 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.747 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 6.7 m95 -92.27 -15.99 26.71 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.408 -0.808 . . . . 0.0 110.81 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 6.3 mtmm 65.6 31.16 10.13 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.695 -0.628 . . . . 0.0 111.681 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.747 ' CE3' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -139.05 155.12 48.18 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.13 -0.981 . . . . 0.0 109.348 178.164 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 3' ' ' LEU . 58.5 m -70.12 112.38 6.44 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.34 -0.85 . . . . 0.0 110.933 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.617 HG22 ' NE1' ' A' ' 25' ' ' TRP . 1.3 t -108.94 167.48 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.37 -0.831 . . . . 0.0 109.764 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 tp -70.62 141.38 51.73 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.39 -0.818 . . . . 0.0 110.176 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.97 130.94 44.99 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.506 -0.746 . . . . 0.0 110.358 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.05 -173.05 35.87 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -75.61 154.03 98.59 Favored 'Cis proline' 0 C--N 1.315 -1.192 0 C-N-CA 121.549 -2.271 . . . . 0.0 110.721 -0.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.801 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.174 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 87.3 m -100.65 28.77 4.88 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.341 -1.093 . . . . 0.0 110.632 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.7 tt -80.42 113.86 18.91 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.186 -0.946 . . . . 0.0 109.928 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 135.66 -31.33 2.67 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -56.47 124.69 19.04 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.514 -0.992 . . . . 0.0 110.253 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.61 149.51 49.99 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.342 -0.849 . . . . 0.0 110.702 -179.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.9 m -67.71 157.38 34.76 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.579 -0.701 . . . . 0.0 109.713 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -114.83 -75.42 0.59 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.373 -0.83 . . . . 0.0 110.331 -179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -140.3 -59.48 0.53 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.261 -0.899 . . . . 0.0 110.053 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.91 -33.22 12.27 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.511 -0.743 . . . . 0.0 109.983 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -165.14 -67.26 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.605 -0.685 . . . . 0.0 109.914 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 65.98 35.9 91.31 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.2 m -131.78 172.37 12.37 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.523 -0.986 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.2 m -79.41 176.59 9.55 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.467 -0.77 . . . . 0.0 110.24 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.0 m -67.23 117.13 8.82 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.415 -0.803 . . . . 0.0 110.217 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 102.42 -14.63 56.61 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.279 -1.129 . . . . 0.0 110.279 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -91.6 129.8 37.51 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.078 -1.248 . . . . 0.0 110.484 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.4 t -97.37 168.47 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.609 -0.682 . . . . 0.0 110.178 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.25 118.54 37.04 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.254 -0.904 . . . . 0.0 110.46 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.538 ' HB2' ' CZ3' ' A' ' 25' ' ' TRP . 4.4 m -91.05 151.39 21.05 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.551 -0.718 . . . . 0.0 110.343 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.28 -19.19 24.38 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.313 -0.867 . . . . 0.0 111.527 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 66.4 m -57.11 -73.16 0.07 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.163 -0.96 . . . . 0.0 110.209 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.556 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 40.4 m95 -96.44 0.21 50.09 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 179.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.82 68.77 0.79 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.383 -0.823 . . . . 0.0 110.569 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.556 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -155.25 178.23 10.45 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.296 -0.878 . . . . 0.0 110.786 179.666 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.9 m -85.39 138.07 32.51 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.438 -0.789 . . . . 0.0 111.392 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.467 ' CG1' ' CZ2' ' A' ' 25' ' ' TRP . 2.7 m -127.02 140.3 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.74 -0.6 . . . . 0.0 110.015 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.2 tp -67.67 124.59 23.7 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.314 -0.866 . . . . 0.0 109.856 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.87 101.85 0.13 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.637 -0.665 . . . . 0.0 110.3 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.466 ' HA2' ' C ' ' A' ' 31' ' ' PRO . . . -127.73 161.28 21.74 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.466 ' C ' ' HA2' ' A' ' 30' ' ' GLY . 47.8 Cg_endo -73.36 157.47 99.13 Favored 'Cis proline' 0 N--CA 1.49 1.314 0 C-N-CA 121.774 -2.177 . . . . 0.0 110.794 -0.13 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.498 1.947 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.477 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.475 ' HB2' ' CG ' ' A' ' 17' ' ' TYR . 85.7 m -95.09 3.71 54.49 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.516 -0.991 . . . . 0.0 110.933 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.6 tp -64.57 114.02 4.1 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.133 -0.979 . . . . 0.0 109.97 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.95 -28.62 5.35 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -57.81 140.73 51.04 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.387 -1.067 . . . . 0.0 109.968 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.9 mmmt -85.75 141.05 29.98 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.432 -0.793 . . . . 0.0 110.838 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.2 t -133.96 142.96 47.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.733 -0.605 . . . . 0.0 109.467 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.65 -51.8 9.35 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.424 -0.798 . . . . 0.0 110.341 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -157.27 -57.05 0.08 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.502 -0.749 . . . . 0.0 110.229 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -146.81 43.35 1.16 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.448 -0.783 . . . . 0.0 110.074 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -54.51 -53.54 52.95 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.467 -0.771 . . . . 0.0 110.272 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.66 84.11 0.54 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.4 t -79.6 173.38 12.64 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.513 -0.992 . . . . 0.0 109.682 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 31.7 p -59.24 162.15 4.81 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.276 -0.89 . . . . 0.0 110.634 -179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -55.12 129.87 39.78 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.56 -0.712 . . . . 0.0 110.774 -179.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.98 7.17 56.61 Favored Glycine 0 N--CA 1.494 2.564 0 N-CA-C 110.699 -0.96 . . . . 0.0 110.699 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.475 ' CG ' ' HB2' ' A' ' 2' ' ' CYS . 26.9 m-85 -136.31 138.16 41.41 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.05 -1.265 . . . . 0.0 110.808 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.463 ' O ' HG22 ' A' ' 27' ' ' VAL . 12.5 t -125.18 166.77 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.641 -0.662 . . . . 0.0 109.913 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 72.7 m -90.44 114.42 26.57 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.306 -0.871 . . . . 0.0 110.126 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.492 ' HB3' ' CE3' ' A' ' 25' ' ' TRP . 10.8 t -75.17 159.12 31.98 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.452 -0.78 . . . . 0.0 110.616 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.1 ttp85 -90.89 -22.71 20.78 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.471 -0.768 . . . . 0.0 110.954 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.509 HG22 ' CD2' ' A' ' 23' ' ' TRP . 62.7 m -69.48 -82.65 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.201 -0.937 . . . . 0.0 110.928 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.684 ' HB2' ' CE3' ' A' ' 25' ' ' TRP . 14.3 m95 -85.08 -0.13 53.49 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.07 -1.019 . . . . 0.0 110.812 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER 56.67 63.95 1.81 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.323 -0.86 . . . . 0.0 110.811 179.772 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.684 ' CE3' ' HB2' ' A' ' 23' ' ' TRP . 1.5 p90 -145.95 176.88 9.36 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.273 -0.892 . . . . 0.0 110.395 179.153 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.7 m -78.59 122.79 26.36 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.261 -0.899 . . . . 0.0 111.117 -178.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.61 HG12 ' CZ2' ' A' ' 25' ' ' TRP . 24.2 m -115.13 151.34 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.686 -0.634 . . . . 0.0 110.06 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.7 mt -68.11 118.47 11.31 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.336 -0.852 . . . . 0.0 110.04 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.32 132.27 47.38 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.498 -0.751 . . . . 0.0 110.375 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.423 ' HA3' ' HA ' ' A' ' 31' ' ' PRO . . . 139.59 -150.84 21.63 Favored Glycine 0 N--CA 1.493 2.498 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.423 ' HA ' ' HA3' ' A' ' 30' ' ' GLY . 47.7 Cg_endo -74.53 149.89 94.64 Favored 'Cis proline' 0 N--CA 1.49 1.274 0 C-N-CA 121.912 -2.12 . . . . 0.0 110.73 -0.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 29.9 t-105 . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.339 179.871 . . . . . . . . 0 0 . 1 stop_ save_