data_1k36_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 1k36 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.48 ' HB2' HG13 ' A' ' 23' ' ' VAL . 94.0 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.265 0.555 . . . . 0.0 110.084 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.529 HG12 ' CG2' ' A' ' 20' ' ' ILE . 9.4 tt -141.23 169.58 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.349 -0.844 . . . . 0.0 110.066 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.474 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 4.0 m -141.35 167.27 22.56 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.303 -0.873 . . . . 0.0 110.423 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -80.98 -170.43 2.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.2 -0.937 . . . . 0.0 110.151 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 99.5 m -116.08 172.67 7.02 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.206 -0.934 . . . . 0.0 110.255 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 t -110.91 -151.28 0.48 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.339 -0.851 . . . . 0.0 110.32 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.8 m -84.62 172.76 11.32 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.336 -0.853 . . . . 0.0 110.318 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 45.29 24.84 0.17 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.36 -0.838 . . . . 0.0 110.296 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.5 2.17 10.16 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.187 -0.945 . . . . 0.0 110.211 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.67 76.47 1.4 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 110.126 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -135.02 27.83 3.12 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -135.64 -60.49 0.74 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.236 -1.155 . . . . 0.0 110.199 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -91.47 120.28 32.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.323 -0.861 . . . . 0.0 110.145 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.573 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.8 mt -90.08 -41.88 11.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.19 -0.944 . . . . 0.0 110.493 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.583 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 8.8 m80 -114.4 85.09 2.17 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.258 -0.901 . . . . 0.0 110.098 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.483 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.03 178.18 42.11 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -99.75 140.61 33.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.311 -1.111 . . . . 0.0 110.143 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -85.43 134.32 34.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.311 -0.868 . . . . 0.0 110.278 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.529 ' CG2' HG12 ' A' ' 3' ' ' ILE . 0.4 OUTLIER -139.4 -174.34 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.825 0 O-C-N 121.204 -0.935 . . . . 0.0 109.58 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.467 ' O ' HG13 ' A' ' 3' ' ' ILE . 11.3 t80 -149.31 123.46 9.5 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.919 -1.113 . . . . 0.0 110.504 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.541 ' HG ' ' HB2' ' A' ' 29' ' ' TYR . 21.0 mt -79.52 132.11 36.23 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.236 -0.915 . . . . 0.0 110.947 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.52 HG11 ' N ' ' A' ' 24' ' ' ASP . 8.7 p -90.09 -33.36 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.244 -0.91 . . . . 0.0 109.864 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.52 ' N ' HG11 ' A' ' 23' ' ' VAL . 5.7 p-10 -78.29 -20.92 50.53 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.231 -0.918 . . . . 0.0 108.58 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.523 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.1 tpt -133.06 60.27 1.71 Allowed 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.479 ' C ' ' O ' ' A' ' 25' ' ' MET . 3.6 p -29.21 89.45 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.667 0.746 . . . . 0.0 111.611 -178.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.523 ' N ' ' O ' ' A' ' 25' ' ' MET . 2.6 pt20 -159.85 170.44 21.43 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.712 -0.617 . . . . 0.0 109.431 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -81.15 116.23 20.96 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.261 -0.899 . . . . 0.0 110.508 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.541 ' HB2' ' HG ' ' A' ' 22' ' ' LEU . 4.3 t80 -109.96 103.92 12.76 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.394 -0.816 . . . . 0.0 109.475 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 65.9 m -108.26 114.67 28.72 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.191 -0.943 . . . . 0.0 110.395 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.483 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.8 tpp85 -79.54 120.73 24.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.896 . . . . 0.0 109.401 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 95.5 m -78.98 171.84 14.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.138 -0.976 . . . . 0.0 110.471 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -79.38 121.24 24.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.391 -0.818 . . . . 0.0 110.037 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 32.6 t -52.51 104.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.222 -0.924 . . . . 0.0 109.73 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.457 ' O ' HD13 ' A' ' 46' ' ' LEU . . . 144.56 -10.77 1.94 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.34 172.02 14.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.214 -1.168 . . . . 0.0 109.843 179.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.58 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -113.39 31.67 6.31 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.891 -1.13 . . . . 0.0 111.066 -179.253 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.43 155.44 26.59 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.5 p -85.69 43.5 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.308 -1.113 . . . . 0.0 109.475 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.552 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.1 OUTLIER -156.64 20.14 0.33 Allowed 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.565 -0.709 . . . . 0.0 109.787 -179.353 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 5.2 p 27.57 90.73 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.685 -0.634 . . . . 0.0 111.614 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.547 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 10.4 tm-20 -154.89 -36.51 0.09 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.469 -0.769 . . . . 0.0 110.197 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.58 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.9 p80 -120.42 119.51 33.26 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.016 -1.053 . . . . 0.0 110.626 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.578 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 41.3 t80 -82.78 114.79 21.35 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.332 0.587 . . . . 0.0 110.045 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.52 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -77.98 -35.07 50.59 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.315 -0.866 . . . . 0.0 110.105 -179.69 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.578 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.6 mt . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.338 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.527 ' HB2' ' CG1' ' A' ' 23' ' ' VAL . 1.4 p . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.291 0.567 . . . . 0.0 110.121 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.537 HG12 ' CG2' ' A' ' 20' ' ' ILE . 1.0 OUTLIER -155.93 166.58 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.363 -0.836 . . . . 0.0 110.464 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.484 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.4 m -149.11 172.22 15.15 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.365 -0.835 . . . . 0.0 110.142 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.67 175.54 5.41 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.229 -0.92 . . . . 0.0 110.227 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 93.7 m -117.09 176.63 5.04 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.291 -0.881 . . . . 0.0 110.26 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -155.96 17.22 0.36 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 0.0 110.672 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.0 m -151.79 -70.39 0.16 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.187 -0.946 . . . . 0.0 110.246 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -80.25 12.9 2.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.161 -0.962 . . . . 0.0 110.552 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.518 ' HB3' ' CB ' ' A' ' 6' ' ' CYS . 22.2 ptm -78.89 -27.69 43.98 Favored 'General case' 0 C--N 1.308 -1.232 0 O-C-N 121.106 -0.996 . . . . 0.0 110.186 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.5 p30 -100.69 44.89 0.99 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.213 -0.929 . . . . 0.0 110.184 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -129.16 -39.11 0.31 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.8 t80 -94.08 -65.04 1.01 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.194 -1.18 . . . . 0.0 110.403 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.2 p -91.24 119.73 31.56 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.162 -0.961 . . . . 0.0 110.269 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.575 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.8 mt -87.59 -40.96 13.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.195 -0.94 . . . . 0.0 110.254 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.575 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.8 m80 -113.53 88.03 2.75 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.16 -0.963 . . . . 0.0 110.091 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.83 -168.43 41.27 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -117.24 134.62 54.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -1.117 . . . . 0.0 110.052 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 3.8 t -79.84 146.8 32.04 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.228 -0.92 . . . . 0.0 109.94 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.537 ' CG2' HG12 ' A' ' 3' ' ' ILE . 1.2 mt -152.35 -176.83 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.152 -0.967 . . . . 0.0 109.841 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.484 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 20.6 t80 -147.99 117.88 7.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.111 -0.993 . . . . 0.0 109.971 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.572 HD22 ' CD2' ' A' ' 29' ' ' TYR . 1.2 mm? -79.93 130.15 35.06 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.098 -1.001 . . . . 0.0 110.195 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.527 ' CG1' ' HB2' ' A' ' 2' ' ' SER . 7.2 p -89.34 -26.05 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.245 -0.909 . . . . 0.0 110.153 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -78.39 -13.77 59.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.163 -0.96 . . . . 0.0 108.683 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.534 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -148.1 66.91 1.09 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 178.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.489 ' C ' ' O ' ' A' ' 25' ' ' MET . 80.7 p -29.15 89.14 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 121.761 0.791 . . . . 0.0 111.743 -178.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.534 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -156.8 144.36 19.08 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.607 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.446 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 9.1 t30 -62.85 108.04 1.11 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.194 -0.941 . . . . 0.0 110.455 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.572 ' CD2' HD22 ' A' ' 22' ' ' LEU . 5.7 t80 -94.31 106.06 18.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.327 -0.858 . . . . 0.0 110.017 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -111.74 110.07 20.24 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 110.344 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.2 tpp180 -80.05 103.62 10.06 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.169 -0.957 . . . . 0.0 109.668 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 79.3 m -79.54 171.69 14.81 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.305 -0.872 . . . . 0.0 110.247 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -79.33 126.66 31.09 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.234 -0.916 . . . . 0.0 109.836 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 12.7 t -65.99 -15.15 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 110.114 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.27 -15.62 68.05 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.529 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.5 m-85 -79.75 169.86 17.34 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.219 -1.165 . . . . 0.0 109.955 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.668 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 15.2 t -101.43 26.48 7.19 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 118.874 -1.131 . . . . 0.0 110.655 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.08 160.64 31.81 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.7 p -85.04 43.76 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.1 -1.235 . . . . 0.0 109.716 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.635 ' NH2' ' CD2' ' A' ' 43' ' ' HIS . 1.1 ttp180 -150.29 13.8 0.77 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.464 -0.772 . . . . 0.0 110.224 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.3 p 29.56 88.52 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.494 -0.754 . . . . 0.0 110.886 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 3.4 tt0 -154.85 -36.9 0.09 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.267 -0.895 . . . . 0.0 110.385 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.668 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 6.6 p80 -127.88 124.05 36.53 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.025 -1.047 . . . . 0.0 111.327 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.543 ' CE2' ' C ' ' A' ' 46' ' ' LEU . 87.3 t80 -90.63 89.78 7.68 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.577 ' HB3' ' CB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -64.51 -21.67 66.75 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.365 -0.834 . . . . 0.0 110.322 -179.094 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.543 ' C ' ' CE2' ' A' ' 44' ' ' PHE . 7.2 mt . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.211 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.468 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 6.6 m . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.24 0.543 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.527 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.3 tt -112.21 150.79 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.23 161.53 18.85 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.272 -0.893 . . . . 0.0 110.204 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.0 tptt -85.09 158.62 20.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.172 -0.955 . . . . 0.0 110.186 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 75.6 m -90.13 -173.46 3.85 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.326 -0.859 . . . . 0.0 110.252 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.7 t -124.96 -152.2 0.51 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.869 . . . . 0.0 110.203 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.34 170.73 10.31 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.297 -0.877 . . . . 0.0 110.1 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.2 t70 52.68 19.57 1.29 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.244 -0.91 . . . . 0.0 110.232 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -118.15 5.33 11.98 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.333 -0.855 . . . . 0.0 110.276 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -105.84 76.21 1.17 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.203 -0.935 . . . . 0.0 110.215 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -125.87 -27.19 1.17 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.834 -1.307 . . . . 0.0 109.834 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -81.43 -52.77 6.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -1.179 . . . . 0.0 110.469 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 28.0 p -99.61 119.77 38.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.259 -0.901 . . . . 0.0 110.511 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.55 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.8 mt -90.49 -43.49 10.21 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.191 -0.943 . . . . 0.0 110.367 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 7.1 m80 -110.98 86.28 2.28 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.223 -0.923 . . . . 0.0 110.219 -179.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.48 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 173.83 177.41 43.01 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -97.6 148.27 23.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.24 -1.153 . . . . 0.0 110.059 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -97.75 134.65 40.63 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.25 -0.906 . . . . 0.0 110.231 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.534 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -148.85 -172.36 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 110.048 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.474 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 17.7 t80 -142.19 133.38 26.18 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.174 -0.954 . . . . 0.0 110.067 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.576 HD21 ' CD2' ' A' ' 29' ' ' TYR . 1.1 mm? -86.26 130.88 34.37 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.08 -1.012 . . . . 0.0 110.604 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.468 ' HB ' ' O ' ' A' ' 2' ' ' SER . 7.5 p -90.51 -25.7 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.265 -0.897 . . . . 0.0 110.47 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.433 ' N ' HG13 ' A' ' 23' ' ' VAL . 22.1 m-20 -78.37 -11.69 59.96 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.106 -0.996 . . . . 0.0 108.792 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -151.18 67.9 0.92 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.017 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 25' ' ' MET . 67.2 p -29.3 90.1 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.673 0.749 . . . . 0.0 111.282 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -159.42 148.6 18.23 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.515 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 2.8 p-10 -64.04 116.71 6.15 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.247 -0.908 . . . . 0.0 110.284 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.576 ' CD2' HD21 ' A' ' 22' ' ' LEU . 5.8 t80 -105.86 138.45 42.03 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.26 -0.9 . . . . 0.0 109.775 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 6.8 m -135.55 120.64 18.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.022 -1.049 . . . . 0.0 110.702 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.48 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -94.28 119.21 32.72 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.213 -0.929 . . . . 0.0 109.524 179.303 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 91.7 m -79.45 173.82 12.2 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.304 -0.873 . . . . 0.0 110.514 -179.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.54 117.57 20.6 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.354 -0.841 . . . . 0.0 109.927 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.1 t -49.09 102.07 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.242 -0.911 . . . . 0.0 109.761 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.16 -12.24 1.41 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.3 167.18 21.27 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.176 -1.191 . . . . 0.0 109.698 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.584 HG21 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.95 35.0 3.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.959 -1.088 . . . . 0.0 110.91 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.25 158.99 30.39 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 6.5 p -88.04 29.43 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.224 -1.162 . . . . 0.0 109.866 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.541 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -145.91 20.31 1.45 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.444 -0.785 . . . . 0.0 109.749 -179.607 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 6.4 p 30.55 94.56 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 CA-C-O 121.529 0.681 . . . . 0.0 111.308 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -155.07 -37.0 0.09 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.514 -0.741 . . . . 0.0 110.097 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.584 ' CE1' HG21 ' A' ' 37' ' ' THR . 5.6 p80 -121.72 117.63 27.11 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.14 -0.975 . . . . 0.0 110.295 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.582 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 39.9 t80 -80.32 111.46 16.72 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.36 0.6 . . . . 0.0 109.991 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.518 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -74.05 -31.94 63.1 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.435 -0.791 . . . . 0.0 110.133 -179.659 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.582 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.247 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.479 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 29.2 t . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.233 0.54 . . . . 0.0 110.219 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.533 ' CD1' ' HB ' ' A' ' 20' ' ' ILE . 5.7 tt -79.56 156.04 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.232 -0.917 . . . . 0.0 110.386 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.449 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.2 OUTLIER -124.29 -171.45 2.34 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.356 -0.84 . . . . 0.0 110.162 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 20' ' ' ILE . 14.1 mtpt -125.94 158.42 35.24 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.296 -0.877 . . . . 0.0 110.231 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 23.2 m -86.7 -150.62 0.16 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.878 . . . . 0.0 110.146 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -149.96 -155.35 0.62 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.218 -0.926 . . . . 0.0 110.125 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.9 m -90.32 27.92 1.56 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.245 -0.91 . . . . 0.0 110.124 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.444 ' O ' ' OD1' ' A' ' 9' ' ' ASP . 56.2 t0 -144.87 31.42 1.15 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.28 -0.888 . . . . 0.0 110.201 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.2 tpp -152.39 17.51 0.63 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.331 -0.856 . . . . 0.0 110.208 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -106.54 81.92 1.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -133.69 4.4 4.72 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -115.22 -56.63 2.34 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.254 -1.145 . . . . 0.0 110.113 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -96.55 116.48 29.16 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.167 -0.958 . . . . 0.0 110.516 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.59 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.3 mt -87.37 -40.36 14.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.389 -0.819 . . . . 0.0 110.129 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.9 m80 -118.0 87.22 2.67 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.317 -0.864 . . . . 0.0 110.325 -179.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.448 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -178.31 -169.28 38.92 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.445 ' O ' ' CD1' ' A' ' 20' ' ' ILE . 8.6 mm-40 -106.85 134.82 49.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.304 -1.115 . . . . 0.0 110.306 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -92.14 126.82 37.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.28 -0.887 . . . . 0.0 110.116 179.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.536 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -147.67 -169.64 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.233 -0.917 . . . . 0.0 110.511 -179.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.495 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 10.2 t80 -145.7 133.13 20.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.38 -0.825 . . . . 0.0 109.705 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.566 HD22 ' CD2' ' A' ' 29' ' ' TYR . 1.5 mm? -86.75 131.85 34.02 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.737 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.479 ' HB ' ' O ' ' A' ' 2' ' ' SER . 4.5 p -90.7 -22.76 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.235 -0.915 . . . . 0.0 110.741 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.471 ' N ' HG12 ' A' ' 23' ' ' VAL . 15.3 m-20 -78.14 -9.51 59.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.069 -1.019 . . . . 0.0 108.893 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -157.11 71.02 0.64 Allowed 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.061 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.495 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 40.6 p -29.26 89.89 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.689 0.757 . . . . 0.0 111.227 -178.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -157.37 147.78 21.03 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.769 -0.582 . . . . 0.0 109.517 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.519 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.0 m120 -64.01 122.98 17.83 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.325 -0.86 . . . . 0.0 110.433 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.566 ' CD2' HD22 ' A' ' 22' ' ' LEU . 5.8 t80 -112.52 131.24 55.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.359 -0.838 . . . . 0.0 109.762 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.4 m -131.64 112.14 12.31 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.159 -0.963 . . . . 0.0 110.624 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.448 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 16.7 tpp85 -84.86 134.58 34.28 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.265 -0.897 . . . . 0.0 110.03 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.631 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 6.1 t -79.71 164.07 24.02 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.252 -0.905 . . . . 0.0 110.066 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 14.9 tt0 -79.58 110.69 15.14 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.285 -0.884 . . . . 0.0 109.495 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.427 ' C ' ' O ' ' A' ' 33' ' ' GLU . 37.6 t -43.36 96.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.503 -0.748 . . . . 0.0 109.719 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 151.52 -14.73 0.82 Allowed Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.581 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.4 m-85 -79.04 -178.33 6.06 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.109 -1.23 . . . . 0.0 109.826 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.583 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.3 OUTLIER -106.03 -57.37 2.05 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.036 -1.04 . . . . 0.0 110.662 -179.683 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.421 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -85.41 152.86 26.99 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.433 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 44.1 t -76.23 2.17 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.237 -1.155 . . . . 0.0 109.96 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.593 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 4.5 tmm_? -80.28 -10.0 59.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.336 -0.852 . . . . 0.0 109.878 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.631 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 11.2 m 59.95 66.9 0.92 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.392 -0.817 . . . . 0.0 110.476 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.593 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER -152.59 -28.25 0.16 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.067 -1.021 . . . . 0.0 111.965 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.583 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.1 p80 -122.78 121.21 35.74 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.56 -1.338 . . . . 0.0 111.659 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.613 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.8 t80 -80.14 110.46 15.57 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.869 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.547 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -74.93 -14.66 60.67 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.104 -0.998 . . . . 0.0 109.958 -179.72 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.613 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 6.0 mt . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.275 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.527 ' CB ' HG13 ' A' ' 23' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.257 0.551 . . . . 0.0 110.076 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.534 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -160.19 167.88 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.291 -0.881 . . . . 0.0 110.403 -179.656 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.488 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.2 m -144.98 162.4 37.01 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.427 -0.796 . . . . 0.0 110.039 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -119.08 157.73 27.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.252 -0.905 . . . . 0.0 110.133 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 86.3 m -91.91 -124.55 0.08 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.294 -0.879 . . . . 0.0 109.976 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.2 t -146.77 -154.38 0.55 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.972 -1.08 . . . . 0.0 110.122 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -85.04 -59.04 2.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.233 -0.917 . . . . 0.0 110.338 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -83.44 11.89 6.31 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.269 -0.895 . . . . 0.0 110.356 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 8.5 tpt -100.0 -4.42 30.07 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.264 -0.898 . . . . 0.0 110.202 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.441 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 39.4 t-20 -120.89 67.87 0.87 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.232 -0.918 . . . . 0.0 110.144 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.67 24.72 16.03 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.469 ' O ' ' NH1' ' A' ' 40' ' ' ARG . 7.5 t80 -110.19 -50.04 3.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.239 -1.154 . . . . 0.0 110.231 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 1.9 m -89.04 138.16 31.66 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.428 -0.795 . . . . 0.0 110.392 -179.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.555 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 13.6 mt -91.44 -46.96 7.71 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.564 -0.71 . . . . 0.0 110.2 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.577 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 5.4 m80 -119.44 91.66 3.6 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.332 -0.855 . . . . 0.0 110.217 -179.02 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.13 -167.13 39.64 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -127.19 164.02 22.58 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.283 -1.127 . . . . 0.0 110.272 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -96.23 135.2 38.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.282 -0.886 . . . . 0.0 110.315 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.534 ' CG2' HG12 ' A' ' 3' ' ' ILE . 17.2 mm -134.58 173.35 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.351 -0.843 . . . . 0.0 109.825 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.488 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 19.7 t80 -144.51 127.84 16.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.923 -1.111 . . . . 0.0 110.399 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.539 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.5 mm? -89.78 133.76 34.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.258 -0.901 . . . . 0.0 110.485 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.53 HG11 ' N ' ' A' ' 24' ' ' ASP . 12.6 p -90.42 -30.55 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.171 -0.955 . . . . 0.0 110.462 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.53 ' N ' HG11 ' A' ' 23' ' ' VAL . 3.4 p30 -78.3 -18.18 55.58 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.115 -0.991 . . . . 0.0 108.814 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.503 ' O ' ' N ' ' A' ' 27' ' ' GLN . 18.0 ttt -138.13 62.27 1.57 Allowed 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.493 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.56 92.0 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 122.119 0.961 . . . . 0.0 111.148 -178.532 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.505 ' HG3' ' N ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER -159.95 147.63 16.73 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.366 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.505 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 6.5 m120 -67.52 105.85 1.97 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.263 -0.898 . . . . 0.0 110.121 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.539 ' HB2' HD23 ' A' ' 22' ' ' LEU . 5.7 t80 -87.61 90.62 8.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.424 -0.797 . . . . 0.0 110.233 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 7.5 m -82.05 115.25 21.11 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 110.553 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -94.75 111.2 22.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.205 -0.934 . . . . 0.0 110.108 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 79.4 m -79.93 178.07 8.47 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.243 -0.911 . . . . 0.0 110.376 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -80.15 146.27 31.9 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.324 -0.86 . . . . 0.0 109.854 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.1 t -76.28 29.59 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.143 -0.973 . . . . 0.0 111.818 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -126.52 -5.06 6.12 Favored Glycine 0 N--CA 1.487 2.044 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.577 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 15.9 m-85 -95.4 157.51 15.86 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.354 -1.086 . . . . 0.0 109.57 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.583 HG23 ' CE1' ' A' ' 43' ' ' HIS . 10.2 t -108.85 43.47 1.25 Allowed 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 118.468 -1.293 . . . . 0.0 110.633 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.84 161.5 32.84 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -87.55 35.64 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.081 -1.247 . . . . 0.0 109.568 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.576 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 0.5 OUTLIER -143.1 8.11 1.63 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.472 -0.767 . . . . 0.0 110.279 -179.428 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 2.5 p 34.02 78.8 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.379 -0.826 . . . . 0.0 111.012 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.576 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 33.5 tt0 -142.24 -33.65 0.47 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.406 -0.809 . . . . 0.0 110.159 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.583 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.5 p80 -118.76 114.61 22.95 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.995 -1.065 . . . . 0.0 109.485 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.574 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 27.0 t80 -78.68 98.07 6.08 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 121.776 0.798 . . . . 0.0 109.323 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.571 ' CE2' HD11 ' A' ' 46' ' ' LEU . 0.2 OUTLIER -64.57 -9.15 17.19 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 121.751 -0.593 . . . . 0.0 110.537 -179.015 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.574 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 8.1 mt . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.452 ' HB3' HG12 ' A' ' 23' ' ' VAL . 3.0 t . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.277 0.561 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.528 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.79 152.22 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.278 -0.889 . . . . 0.0 110.146 179.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.451 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -124.03 -165.14 1.31 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.245 -0.909 . . . . 0.0 110.187 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -106.58 -175.33 2.76 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.232 -0.917 . . . . 0.0 110.207 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 80.5 m -105.23 -155.83 0.55 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 110.356 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -147.42 -138.31 0.09 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.278 -0.889 . . . . 0.0 110.006 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.3 4.82 14.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.054 -1.028 . . . . 0.0 110.059 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -107.19 17.55 22.79 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.324 -0.86 . . . . 0.0 109.823 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.46 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 7.0 ptm -79.49 -26.61 41.58 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.359 -0.838 . . . . 0.0 110.639 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.16 58.19 1.81 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.144 -0.972 . . . . 0.0 110.307 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -146.89 13.17 1.49 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.559 ' CE1' ' HA ' ' A' ' 40' ' ' ARG . 8.4 t80 -157.28 -57.8 0.08 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.168 -1.196 . . . . 0.0 110.312 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.3 p -107.97 114.75 28.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.192 -0.943 . . . . 0.0 110.933 -179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.589 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.2 mt -90.13 -42.48 11.05 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.435 -0.791 . . . . 0.0 109.886 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -111.26 76.91 1.0 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.231 -0.918 . . . . 0.0 110.134 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -172.46 179.5 43.97 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.463 ' HB2' ' HB3' ' A' ' 31' ' ' ARG . 1.0 OUTLIER -93.39 148.07 22.39 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.3 -1.118 . . . . 0.0 110.186 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -109.07 121.02 44.26 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.271 -0.893 . . . . 0.0 110.371 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.544 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -144.3 179.52 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.385 -0.822 . . . . 0.0 110.087 -179.819 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.451 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 20.9 t80 -127.48 133.68 49.87 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.146 -0.971 . . . . 0.0 110.124 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.608 HD23 ' CD2' ' A' ' 29' ' ' TYR . 0.6 OUTLIER -89.17 133.58 34.35 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.243 -0.911 . . . . 0.0 110.545 -179.967 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.452 HG12 ' HB3' ' A' ' 2' ' ' SER . 8.8 p -90.24 -26.34 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.238 -0.914 . . . . 0.0 110.44 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.442 ' N ' HG11 ' A' ' 23' ' ' VAL . 33.0 t0 -78.56 -15.72 58.24 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.056 -1.028 . . . . 0.0 108.821 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -145.47 65.93 1.23 Allowed 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.829 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.494 ' C ' ' O ' ' A' ' 25' ' ' MET . 32.5 p -29.02 89.21 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 CA-C-O 121.648 0.737 . . . . 0.0 111.464 -178.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.3 OUTLIER -159.8 170.14 22.11 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.671 -0.643 . . . . 0.0 109.552 179.731 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.52 100.85 8.78 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.306 -0.871 . . . . 0.0 110.351 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.608 ' CD2' HD23 ' A' ' 22' ' ' LEU . 12.2 t80 -86.99 130.14 34.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.327 -0.858 . . . . 0.0 109.453 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 7.6 m -130.55 116.75 18.58 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.875 -1.14 . . . . 0.0 110.855 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.463 ' HB3' ' HB2' ' A' ' 18' ' ' GLN . 8.0 tpp85 -79.23 128.68 33.61 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.132 -0.98 . . . . 0.0 109.113 179.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.623 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 5.7 m -79.67 159.0 26.87 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.15 -0.969 . . . . 0.0 110.133 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 34' ' ' VAL . 31.3 tt0 -78.36 107.85 11.29 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.258 -0.901 . . . . 0.0 109.166 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.431 ' C ' ' O ' ' A' ' 33' ' ' GLU . 39.6 t -40.99 101.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 121.697 -0.627 . . . . 0.0 110.436 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.526 ' O ' ' CD2' ' A' ' 46' ' ' LEU . . . 140.76 -8.42 2.79 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.565 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -84.79 173.01 11.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.029 -1.277 . . . . 0.0 110.486 -179.798 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.599 HG22 ' CE1' ' A' ' 43' ' ' HIS . 3.9 t -127.57 38.37 4.06 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 118.895 -1.122 . . . . 0.0 111.155 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.516 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -151.35 155.16 25.99 Favored Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.417 -1.373 . . . . 0.0 109.976 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.536 ' N ' ' HD3' ' A' ' 40' ' ' ARG . 79.6 t -83.55 12.68 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.379 -1.071 . . . . 0.0 109.844 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.589 ' HD3' ' N ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -123.26 -7.74 8.19 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.412 -0.805 . . . . 0.0 109.431 179.638 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.623 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 26.8 m 58.77 65.73 1.18 Allowed 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -178.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -135.32 -30.83 1.01 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.561 -0.712 . . . . 0.0 110.868 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.599 ' CE1' HG22 ' A' ' 37' ' ' THR . 5.1 p80 -120.2 123.75 44.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.756 -1.215 . . . . 0.0 111.349 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.597 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 43.9 t80 -86.7 104.25 15.92 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.382 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.595 ' CD2' HD11 ' A' ' 46' ' ' LEU . 0.2 OUTLIER -71.82 -3.19 20.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.396 -0.815 . . . . 0.0 110.163 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.597 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.1 mm? . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.344 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.473 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 3.2 m . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.325 0.583 . . . . 0.0 110.356 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.532 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.5 OUTLIER -141.56 122.66 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.138 -0.976 . . . . 0.0 110.659 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.524 ' HB ' ' CB ' ' A' ' 21' ' ' TYR . 4.2 m -90.96 167.28 12.52 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.387 -0.821 . . . . 0.0 109.765 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -122.34 169.29 11.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.274 -0.891 . . . . 0.0 110.13 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 62.8 m -110.61 -144.33 0.39 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.31 -0.869 . . . . 0.0 110.18 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 t -139.84 -166.27 2.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.229 -0.919 . . . . 0.0 110.111 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.18 7.48 13.53 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.208 -0.933 . . . . 0.0 110.283 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.12 25.81 10.07 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.213 -0.929 . . . . 0.0 110.224 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.436 ' SD ' ' SG ' ' A' ' 6' ' ' CYS . 31.8 ttm -144.67 28.11 1.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.225 -0.922 . . . . 0.0 110.196 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -110.42 27.6 9.47 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.243 -0.91 . . . . 0.0 110.167 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.15 -17.28 79.53 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -83.63 -50.08 8.55 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.251 -1.146 . . . . 0.0 110.327 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -105.79 120.9 42.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.254 -0.904 . . . . 0.0 110.408 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.567 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.6 mt -90.31 -42.29 11.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.336 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.567 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.1 m80 -111.17 86.45 2.32 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.173 -0.955 . . . . 0.0 110.1 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.437 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 168.93 -163.0 36.8 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -123.62 152.87 41.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.306 -1.114 . . . . 0.0 110.06 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 6.8 t -92.16 146.88 23.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.0 110.282 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.532 ' CG2' HG12 ' A' ' 3' ' ' ILE . 1.0 OUTLIER -153.43 -174.08 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.278 -0.889 . . . . 0.0 109.803 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.524 ' CB ' ' HB ' ' A' ' 4' ' ' THR . 27.0 t80 -148.7 130.49 15.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.077 -1.015 . . . . 0.0 109.835 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.566 HD21 ' CD2' ' A' ' 29' ' ' TYR . 1.6 mm? -92.14 132.52 36.55 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.036 -1.04 . . . . 0.0 111.041 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.473 ' HB ' ' O ' ' A' ' 2' ' ' SER . 6.1 t -90.74 -27.22 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.33 -0.856 . . . . 0.0 110.382 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -77.52 -19.9 55.06 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.986 -1.072 . . . . 0.0 108.393 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.529 ' O ' ' N ' ' A' ' 27' ' ' GLN . 19.9 mtm -141.99 62.04 1.44 Allowed 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.487 ' C ' ' O ' ' A' ' 25' ' ' MET . 2.6 p -29.18 89.76 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.803 0.811 . . . . 0.0 111.494 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.529 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.32 147.85 17.91 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.734 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.506 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 5.9 m-80 -57.13 129.55 42.25 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.152 -0.967 . . . . 0.0 110.379 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.566 ' CD2' HD21 ' A' ' 22' ' ' LEU . 6.6 t80 -120.75 107.97 13.4 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.523 -0.736 . . . . 0.0 109.831 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 4.5 m -113.03 112.71 24.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.118 -0.988 . . . . 0.0 110.409 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.437 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 7.2 tpm_? -79.66 116.78 20.05 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.216 -0.928 . . . . 0.0 109.69 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 96.8 m -79.26 175.61 10.43 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.226 -0.921 . . . . 0.0 110.021 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -79.25 110.93 14.98 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.229 -0.919 . . . . 0.0 109.724 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.1 t -44.77 101.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.396 -0.815 . . . . 0.0 109.672 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 146.2 -8.66 1.46 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.478 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.02 176.67 9.44 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.915 -1.344 . . . . 0.0 109.895 -179.967 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.607 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -113.99 28.69 8.56 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.897 -1.127 . . . . 0.0 110.472 -179.724 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -158.15 156.27 27.22 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.0 p -84.63 42.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.326 -1.102 . . . . 0.0 109.839 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.553 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.27 22.93 0.16 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.341 -0.849 . . . . 0.0 109.849 -179.476 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 5.4 p 28.33 93.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.664 -0.647 . . . . 0.0 111.676 179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.553 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 13.4 tm-20 -154.81 -42.1 0.09 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.39 -0.819 . . . . 0.0 110.067 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.607 ' CE1' HG23 ' A' ' 37' ' ' THR . 1.9 p-80 -118.53 128.35 54.49 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.099 -1.001 . . . . 0.0 110.419 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.59 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 36.8 t80 -87.78 128.08 35.32 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.422 0.63 . . . . 0.0 110.16 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.573 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -89.43 -37.33 14.89 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.387 -0.82 . . . . 0.0 110.087 -179.477 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.59 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.001 -0.999 . . . . 0.0 110.151 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.457 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 6.5 m . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.238 0.542 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.576 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -107.67 140.85 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 110.098 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.455 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -107.35 170.64 7.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 110.151 179.892 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -104.99 171.82 7.11 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.186 -0.947 . . . . 0.0 110.232 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 62.5 m -90.6 -143.62 0.17 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.287 -0.883 . . . . 0.0 110.106 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.5 p -158.17 -72.72 0.09 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.235 -0.916 . . . . 0.0 110.328 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.0 m -154.39 -75.14 0.11 Allowed 'General case' 0 C--N 1.292 -1.9 0 O-C-N 121.666 -0.646 . . . . 0.0 110.162 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -62.26 -12.1 18.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.881 . . . . 0.0 110.231 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.1 tpt -91.38 19.41 6.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.202 -0.936 . . . . 0.0 110.185 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.403 ' OD1' ' HB3' ' A' ' 6' ' ' CYS . 4.4 m-20 -126.39 81.09 1.97 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.285 -0.884 . . . . 0.0 110.221 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.09 59.92 0.43 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.516 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 63.8 t80 -160.11 -55.43 0.06 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.283 -1.128 . . . . 0.0 110.253 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.4 p -96.46 118.92 33.98 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.3 -0.875 . . . . 0.0 110.567 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.521 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 6.1 mt -90.66 -47.37 7.7 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.259 -0.901 . . . . 0.0 110.215 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 10.1 m80 -106.78 82.28 1.68 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.37 -0.831 . . . . 0.0 110.201 -179.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 178.08 -171.02 43.44 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.4 mm-40 -109.36 133.48 53.01 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.198 -1.177 . . . . 0.0 110.168 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -87.61 135.18 33.46 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.315 -0.865 . . . . 0.0 110.184 179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.641 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 26.9 pt -157.46 -168.07 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.214 -0.929 . . . . 0.0 110.235 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.558 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 8.4 t80 -141.3 139.44 33.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.209 -0.932 . . . . 0.0 110.004 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.604 HD22 ' CD2' ' A' ' 29' ' ' TYR . 0.7 OUTLIER -94.92 137.39 34.05 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.229 -0.919 . . . . 0.0 110.979 -179.525 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.457 ' HB ' ' O ' ' A' ' 2' ' ' SER . 8.3 p -90.14 -27.23 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.346 -0.846 . . . . 0.0 110.371 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.409 ' O ' ' SD ' ' A' ' 25' ' ' MET . 42.1 t0 -78.36 -15.42 58.72 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.165 -0.959 . . . . 0.0 108.814 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.2 OUTLIER -145.08 65.03 1.27 Allowed 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 179.01 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.558 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 49.7 p -29.41 87.72 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 121.623 0.725 . . . . 0.0 111.753 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 25' ' ' MET . 4.1 pt20 -160.89 175.79 12.14 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.584 -0.698 . . . . 0.0 109.544 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -82.18 111.24 18.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 110.339 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.641 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 10.0 t80 -100.11 118.75 37.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.343 -0.848 . . . . 0.0 109.706 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 20.7 m -119.66 111.51 18.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.06 -1.025 . . . . 0.0 110.641 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.465 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 13.5 tpp180 -81.03 117.88 22.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.195 -0.94 . . . . 0.0 109.485 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 98.0 m -79.37 170.47 16.55 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 110.349 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -79.61 114.0 18.2 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.322 -0.861 . . . . 0.0 110.183 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 44.2 t -47.21 100.86 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.328 -0.858 . . . . 0.0 109.802 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 149.47 -13.37 1.05 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.711 -1.356 . . . . 0.0 109.711 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.2 m-85 -79.19 170.43 16.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.2 -1.177 . . . . 0.0 109.631 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.584 HG21 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -109.98 32.79 4.83 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.829 -1.169 . . . . 0.0 110.886 -179.67 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.65 159.9 31.37 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.0 p -88.8 33.59 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.234 -1.156 . . . . 0.0 109.482 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.555 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.6 OUTLIER -142.91 17.89 1.96 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.461 -0.774 . . . . 0.0 109.595 -179.602 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 2.2 p 27.83 86.81 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.123 0 CA-C-O 121.442 0.639 . . . . 0.0 111.131 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.555 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 12.4 tm-20 -151.81 -34.79 0.13 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.451 -0.781 . . . . 0.0 110.4 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.584 ' CE1' HG21 ' A' ' 37' ' ' THR . 6.2 p80 -120.91 117.64 27.85 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.034 -1.041 . . . . 0.0 110.364 179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.595 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 28.0 t80 -80.23 109.38 14.65 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.313 0.578 . . . . 0.0 109.991 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.567 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -70.45 -16.69 62.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.91 . . . . 0.0 109.682 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.595 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.7 mt . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.279 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.443 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 121.358 0.599 . . . . 0.0 109.91 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.52 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.0 OUTLIER -155.78 165.13 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.347 -0.846 . . . . 0.0 110.209 -179.887 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.471 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 2.8 m -142.13 166.02 25.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.938 . . . . 0.0 110.027 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -85.72 163.21 18.37 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -0.875 . . . . 0.0 110.265 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 21.3 m -93.92 -145.17 0.24 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.231 -0.918 . . . . 0.0 110.209 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.0 t -151.94 -150.2 0.33 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 110.092 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.436 ' O ' ' N ' ' A' ' 10' ' ' MET . 0.3 OUTLIER -84.37 168.71 15.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.291 -0.88 . . . . 0.0 110.209 179.881 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 8' ' ' SER . 0.4 OUTLIER 42.12 27.15 0.07 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.267 -0.896 . . . . 0.0 110.231 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.453 ' SD ' ' HB3' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -122.68 -4.15 8.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.176 -0.953 . . . . 0.0 110.229 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -116.84 69.73 0.76 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.276 -0.89 . . . . 0.0 110.209 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -129.82 29.56 3.73 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.515 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 47.0 t80 -124.47 -57.25 1.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.333 -1.098 . . . . 0.0 110.295 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.7 p -91.45 122.75 34.32 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.283 -0.885 . . . . 0.0 110.34 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.536 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 5.6 mt -90.44 -45.46 8.97 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.259 -0.901 . . . . 0.0 110.238 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.536 ' ND1' ' HB2' ' A' ' 15' ' ' LEU . 7.1 m80 -109.07 87.44 2.49 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.309 -0.869 . . . . 0.0 110.159 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.468 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 177.98 -175.58 47.57 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -107.99 137.83 45.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.204 -1.174 . . . . 0.0 110.253 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.5 t -86.72 139.6 30.59 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.0 110.225 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.644 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 24.2 pt -157.33 -173.19 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.249 -0.907 . . . . 0.0 109.96 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.471 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 5.7 t80 -144.64 128.54 17.41 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.141 -0.975 . . . . 0.0 110.306 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.539 ' HG ' ' HB2' ' A' ' 29' ' ' TYR . 15.9 mt -79.54 133.55 36.47 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.339 -0.851 . . . . 0.0 110.779 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.482 HG12 ' N ' ' A' ' 24' ' ' ASP . 12.4 p -89.5 -30.91 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.889 . . . . 0.0 109.916 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.482 ' N ' HG12 ' A' ' 23' ' ' VAL . 50.5 m-20 -78.49 -20.07 51.65 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.136 -0.978 . . . . 0.0 108.684 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.558 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.0 mtm -136.78 61.72 1.62 Allowed 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 25' ' ' MET . 35.0 p -29.37 87.68 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 CA-C-O 121.7 0.762 . . . . 0.0 111.508 -178.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -160.64 148.17 15.89 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.473 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.7 t30 -62.62 114.97 3.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.196 -0.94 . . . . 0.0 110.304 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.644 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 4.1 t80 -106.54 121.78 44.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.408 -0.808 . . . . 0.0 109.687 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 19.9 m -117.52 112.12 20.17 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.078 -1.014 . . . . 0.0 110.478 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.468 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 1.9 tpp180 -81.89 117.52 22.21 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.207 -0.933 . . . . 0.0 109.635 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 65.8 m -79.36 170.85 15.99 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.229 -0.919 . . . . 0.0 110.488 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -79.46 113.16 17.38 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.335 -0.853 . . . . 0.0 110.194 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.5 t -48.67 106.71 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.44 -0.787 . . . . 0.0 109.955 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.26 -10.92 2.26 Favored Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -79.53 177.14 9.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.177 -1.19 . . . . 0.0 109.975 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.652 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -110.12 -43.26 3.99 Favored 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 118.732 -1.187 . . . . 0.0 111.21 -179.524 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.59 158.79 43.68 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.269 -1.532 . . . . 0.0 109.269 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.491 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 80.9 t -84.7 44.45 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.247 -1.149 . . . . 0.0 109.513 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.564 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -160.28 26.65 0.17 Allowed 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.481 -0.762 . . . . 0.0 109.61 -179.372 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 10.9 p 30.78 93.12 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.512 -0.743 . . . . 0.0 111.335 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.549 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 6.6 tm-20 -160.17 -42.7 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 110.388 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.652 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 0.2 OUTLIER -120.1 136.73 54.49 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 122.177 0.989 . . . . 0.0 110.8 -179.76 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.586 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 69.4 t80 -97.32 137.09 36.85 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.142 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.586 ' O ' ' CG ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -121.77 13.11 10.69 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 110.605 -179.431 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.586 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.6 mt . . . . . 0 N--CA 1.492 1.639 0 O-C-N 120.938 -1.101 . . . . 0.0 110.303 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.471 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 4.9 t . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.269 0.557 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.531 ' CG1' ' CG2' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.73 150.8 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.91 . . . . 0.0 110.34 -179.78 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.3 m -131.41 170.74 14.25 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.388 -0.82 . . . . 0.0 110.205 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -109.26 179.6 4.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.214 -0.929 . . . . 0.0 110.185 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.3 m -106.92 -154.58 0.52 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 110.355 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.0 t -136.23 -145.72 0.22 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.095 -1.003 . . . . 0.0 110.647 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 41.2 t -79.79 -70.67 0.5 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.31 -0.869 . . . . 0.0 110.421 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -76.33 2.96 11.96 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.264 -0.897 . . . . 0.0 110.366 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.18 14.95 25.88 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.13 -0.981 . . . . 0.0 110.191 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -140.95 120.08 12.87 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.31 -0.869 . . . . 0.0 110.245 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.48 62.57 0.19 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.572 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 52.1 t80 -151.45 -57.11 0.15 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.273 -1.134 . . . . 0.0 110.145 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 23.5 p -85.66 124.85 32.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.263 -0.898 . . . . 0.0 110.319 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.573 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.6 mt -89.99 -42.53 11.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.273 -0.892 . . . . 0.0 110.256 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.579 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 8.7 m80 -113.91 92.85 4.12 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.281 -0.887 . . . . 0.0 110.147 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.459 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 167.53 -132.6 2.64 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 0.8 OUTLIER -158.81 149.49 19.98 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -1.103 . . . . 0.0 110.285 -179.945 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -89.68 146.2 24.69 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.297 -0.877 . . . . 0.0 110.364 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.531 ' CG2' ' CG1' ' A' ' 3' ' ' ILE . 1.1 mt -153.03 -166.54 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.296 -0.877 . . . . 0.0 109.579 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.473 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 16.7 t80 -152.65 125.7 8.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.088 -1.007 . . . . 0.0 110.135 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.576 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.3 mm? -88.44 132.22 34.56 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.2 -0.937 . . . . 0.0 110.611 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 2' ' ' SER . 9.4 p -90.38 -24.11 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.243 -0.911 . . . . 0.0 110.462 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.51 -13.69 59.71 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.107 -0.996 . . . . 0.0 108.703 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.537 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.0 tpp -150.0 67.88 0.99 Allowed 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 25' ' ' MET . 12.5 p -29.28 89.44 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.715 0.769 . . . . 0.0 111.536 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.11 147.85 16.58 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.725 -0.609 . . . . 0.0 109.377 179.9 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.507 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 10.8 m-20 -59.79 127.92 34.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.157 -0.964 . . . . 0.0 110.248 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.576 ' CD2' HD23 ' A' ' 22' ' ' LEU . 8.7 t80 -117.82 109.94 17.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.269 -0.894 . . . . 0.0 110.207 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -112.76 110.23 20.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.23 -0.919 . . . . 0.0 110.163 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.459 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -81.4 123.76 28.84 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.23 -0.919 . . . . 0.0 109.817 179.585 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 78.7 m -79.73 178.58 8.06 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.324 -0.86 . . . . 0.0 110.251 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -80.69 114.74 19.79 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.25 -0.906 . . . . 0.0 110.176 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.4 t -47.33 103.0 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.334 -0.854 . . . . 0.0 109.796 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 145.4 -11.46 1.77 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.579 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.9 OUTLIER -79.54 167.38 20.84 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.127 -1.219 . . . . 0.0 109.923 179.994 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.591 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -108.21 33.96 3.86 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.048 -1.032 . . . . 0.0 110.555 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.5 156.32 27.6 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.6 p -87.51 33.27 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.2 -1.176 . . . . 0.0 109.834 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.572 ' HG3' ' CE1' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -148.68 20.02 1.03 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.349 -0.845 . . . . 0.0 109.677 -179.65 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.1 p 30.77 94.42 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.65 0.738 . . . . 0.0 111.603 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.562 ' CB ' ' CZ ' ' A' ' 40' ' ' ARG . 6.2 tm-20 -153.8 -36.69 0.1 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.551 -0.718 . . . . 0.0 109.96 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.591 ' CE1' HG23 ' A' ' 37' ' ' THR . 4.8 p80 -122.82 116.28 23.41 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.233 -0.917 . . . . 0.0 109.624 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.604 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 23.9 t80 -79.62 107.94 12.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.763 -0.586 . . . . 0.0 110.486 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.552 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -67.43 -30.55 70.32 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.397 -0.814 . . . . 0.0 109.428 179.663 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.604 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.5 mt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.188 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.537 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.363 0.601 . . . . 0.0 110.225 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.543 HG12 ' CG2' ' A' ' 20' ' ' ILE . 1.1 tp -144.18 154.47 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.305 -0.872 . . . . 0.0 110.16 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.506 ' O ' ' N ' ' A' ' 21' ' ' TYR . 3.1 m -140.47 168.19 20.37 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.262 -0.898 . . . . 0.0 110.119 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.44 179.55 6.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.176 -0.953 . . . . 0.0 110.302 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 86.4 m -105.22 164.76 11.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.262 -0.898 . . . . 0.0 110.276 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.8 t -102.34 -152.38 0.44 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.326 -0.859 . . . . 0.0 110.141 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.414 ' O ' ' N ' ' A' ' 10' ' ' MET . 0.8 OUTLIER -83.81 171.55 13.02 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.34 -0.85 . . . . 0.0 110.076 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 8' ' ' SER . 3.0 t0 42.42 27.87 0.1 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.185 -0.947 . . . . 0.0 110.191 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.414 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -126.21 3.99 7.1 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.276 -0.89 . . . . 0.0 110.15 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -110.35 86.73 2.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.263 -0.898 . . . . 0.0 110.265 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.01 64.64 0.39 Allowed Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -154.19 -60.62 0.13 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.263 -1.139 . . . . 0.0 110.165 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.4 p -96.28 117.18 30.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.278 -0.889 . . . . 0.0 110.43 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.562 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.3 mt -69.22 -42.66 75.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.49 -0.756 . . . . 0.0 109.784 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.565 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 4.3 m80 -117.25 80.63 1.52 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.439 -0.788 . . . . 0.0 110.388 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.416 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -177.33 152.76 12.39 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.211 -1.556 . . . . 0.0 109.211 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.53 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -80.85 169.81 17.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.125 -1.22 . . . . 0.0 110.563 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -107.22 130.12 54.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.241 -0.912 . . . . 0.0 110.798 -179.579 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.592 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -132.79 -165.89 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.363 -0.836 . . . . 0.0 109.494 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.506 ' N ' ' O ' ' A' ' 4' ' ' THR . 12.5 t80 -149.57 135.16 18.49 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.054 -1.029 . . . . 0.0 109.871 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.566 HD21 ' CD1' ' A' ' 29' ' ' TYR . 1.2 mm? -95.77 134.05 39.16 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.15 -0.969 . . . . 0.0 111.234 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.537 HG11 ' CB ' ' A' ' 2' ' ' SER . 7.0 p -90.73 -25.16 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.434 -0.791 . . . . 0.0 110.385 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.528 ' N ' HG13 ' A' ' 23' ' ' VAL . 5.1 m-20 -78.88 -14.53 59.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.096 -1.003 . . . . 0.0 108.82 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.548 ' O ' ' N ' ' A' ' 27' ' ' GLN . 5.5 ttm -147.31 67.38 1.14 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 25' ' ' MET . 17.2 p -29.81 87.68 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.599 0.714 . . . . 0.0 111.922 -178.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.0 OUTLIER -157.83 170.67 21.81 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.67 -0.644 . . . . 0.0 109.782 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -79.4 125.18 29.2 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.413 -0.804 . . . . 0.0 110.582 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.566 ' CD1' HD21 ' A' ' 22' ' ' LEU . 30.1 t80 -105.7 167.49 9.73 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.392 -0.817 . . . . 0.0 109.46 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.4 m -152.13 117.66 5.35 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.028 -1.045 . . . . 0.0 110.683 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.53 ' HB3' ' CG ' ' A' ' 18' ' ' GLN . 4.8 tpp85 -84.89 125.79 32.93 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.104 -0.998 . . . . 0.0 108.896 179.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.3 m -79.69 163.62 24.39 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.129 -0.982 . . . . 0.0 110.334 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.508 ' O ' ' N ' ' A' ' 35' ' ' GLY . 10.2 tt0 -78.19 111.91 14.62 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.754 -0.779 . . . . 0.0 109.287 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.434 ' C ' ' O ' ' A' ' 33' ' ' GLU . 35.3 t -41.86 94.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.578 -0.701 . . . . 0.0 109.985 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 153.73 -17.2 0.65 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.565 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.6 m-85 -79.37 167.92 20.2 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.081 -1.247 . . . . 0.0 109.92 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.593 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -113.86 37.01 3.41 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.139 -1.025 . . . . 0.0 110.924 -179.491 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.91 157.38 28.87 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.7 p -88.99 27.56 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.277 -1.131 . . . . 0.0 109.551 179.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.539 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 12.1 ttp180 -127.16 -18.87 4.46 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.539 -0.726 . . . . 0.0 110.276 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.7 m 68.45 78.83 0.22 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.156 -0.965 . . . . 0.0 109.829 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.539 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -152.18 -32.56 0.14 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.473 -0.767 . . . . 0.0 110.984 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.593 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.6 p80 -123.17 118.95 28.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.894 -1.129 . . . . 0.0 110.922 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.596 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 40.6 t80 -81.64 105.18 12.58 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.322 0.582 . . . . 0.0 109.798 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.539 ' CB ' HG21 ' A' ' 37' ' ' THR . 0.0 OUTLIER -64.78 -27.37 68.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.288 -0.883 . . . . 0.0 110.095 -179.567 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.596 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.7 mt . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.348 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.242 0.544 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.533 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.9 tt -121.19 152.79 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.315 -0.865 . . . . 0.0 110.063 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.468 ' CB ' ' HB3' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -110.01 169.69 8.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.902 . . . . 0.0 110.271 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -117.87 159.69 22.67 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.285 -0.884 . . . . 0.0 110.103 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 61.4 m -110.65 -151.26 0.47 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.113 -0.992 . . . . 0.0 110.34 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.7 t -152.99 -151.07 0.36 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.291 -0.88 . . . . 0.0 110.086 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.42 ' O ' ' C ' ' A' ' 9' ' ' ASP . 79.2 p -86.99 165.38 15.89 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.182 -0.949 . . . . 0.0 110.119 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.42 ' C ' ' O ' ' A' ' 8' ' ' SER . 2.2 m-20 41.48 31.01 0.16 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.214 -0.929 . . . . 0.0 110.301 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.78 -14.38 9.01 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.344 -0.847 . . . . 0.0 110.362 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -148.65 107.4 3.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.0 110.428 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -104.44 52.82 0.72 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.336 -1.506 . . . . 0.0 109.336 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -126.58 -55.37 1.42 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -1.106 . . . . 0.0 110.447 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.3 p -96.59 117.23 30.52 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.132 -0.98 . . . . 0.0 110.619 -179.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.59 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 14.4 mt -82.26 -39.52 22.89 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.365 -0.835 . . . . 0.0 109.839 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.6 m80 -121.41 84.35 2.23 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.443 -0.786 . . . . 0.0 110.243 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -177.02 175.8 47.82 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -93.22 141.49 28.37 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.269 -1.136 . . . . 0.0 110.276 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 7.9 t -98.79 124.12 43.46 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.353 -0.842 . . . . 0.0 110.144 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.59 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.55 -173.7 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.389 -0.82 . . . . 0.0 110.141 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.469 ' O ' HG13 ' A' ' 3' ' ' ILE . 10.8 t80 -138.99 136.53 35.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.832 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.601 HD21 ' CD2' ' A' ' 29' ' ' TYR . 1.3 mm? -92.41 133.94 35.41 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.02 -1.05 . . . . 0.0 111.009 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.1 p -90.46 -27.7 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.356 -0.84 . . . . 0.0 110.563 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -78.36 -17.79 56.0 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.082 -1.011 . . . . 0.0 108.964 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.548 ' O ' ' N ' ' A' ' 27' ' ' GLN . 14.8 mtt -142.62 64.9 1.36 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.48 ' C ' ' O ' ' A' ' 25' ' ' MET . 11.8 p -29.18 88.69 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.716 0.769 . . . . 0.0 111.553 -178.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.7 pt20 -160.32 171.8 18.48 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.655 -0.653 . . . . 0.0 109.636 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -80.08 122.7 27.1 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.385 -0.822 . . . . 0.0 110.478 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.601 ' CD2' HD21 ' A' ' 22' ' ' LEU . 5.3 t80 -113.07 129.75 56.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.507 -0.746 . . . . 0.0 109.429 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.7 m -129.84 113.32 14.52 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.99 -1.069 . . . . 0.0 110.874 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -79.57 133.38 36.45 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.282 -0.886 . . . . 0.0 109.097 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 10.8 m -78.99 160.26 27.27 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.235 -0.916 . . . . 0.0 109.985 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.516 ' O ' ' N ' ' A' ' 35' ' ' GLY . 12.1 tt0 -78.54 112.99 16.17 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.294 -0.879 . . . . 0.0 109.023 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.436 ' C ' ' O ' ' A' ' 33' ' ' GLU . 24.0 t -40.76 94.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.586 -0.696 . . . . 0.0 110.3 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 153.41 -18.89 0.7 Allowed Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 3.6 m-85 -82.2 166.19 19.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -1.162 . . . . 0.0 109.902 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.583 HG23 ' CE1' ' A' ' 43' ' ' HIS . 9.1 t -121.38 47.81 1.78 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.973 -1.079 . . . . 0.0 111.158 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.63 157.62 29.07 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.7 p -88.59 23.83 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.345 -1.091 . . . . 0.0 109.421 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.558 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 11.2 ttp180 -126.51 -19.66 4.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.578 -0.701 . . . . 0.0 110.291 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.8 m 68.18 68.54 0.33 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.12 -0.987 . . . . 0.0 110.263 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.558 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 5.3 tm-20 -137.99 -27.87 0.89 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.367 -0.833 . . . . 0.0 110.992 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.583 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.4 p80 -126.95 121.82 32.81 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.762 -1.211 . . . . 0.0 111.111 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.603 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.3 t80 -83.16 101.18 11.03 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.528 ' CB ' HG21 ' A' ' 37' ' ' THR . 0.1 OUTLIER -64.31 -14.33 55.4 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.208 -0.933 . . . . 0.0 110.149 -179.362 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.603 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 6.9 mt . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.228 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.498 ' N ' HG12 ' A' ' 23' ' ' VAL . 2.8 m . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.312 0.577 . . . . 0.0 110.646 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.588 ' CD1' ' CG2' ' A' ' 20' ' ' ILE . 0.9 OUTLIER -80.11 164.6 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.245 -0.91 . . . . 0.0 109.873 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.512 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 2.3 m -148.7 166.34 28.67 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.11 -0.994 . . . . 0.0 110.259 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.65 162.02 13.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.234 -0.916 . . . . 0.0 110.163 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.8 m -93.19 -150.25 0.28 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.266 -0.896 . . . . 0.0 110.194 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 t -147.37 -155.42 0.62 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.264 -0.898 . . . . 0.0 110.22 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.34 172.11 14.19 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.29 -0.881 . . . . 0.0 110.205 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.5 t0 47.83 23.71 0.49 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.218 -0.926 . . . . 0.0 110.276 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.14 9.65 6.26 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.255 -0.903 . . . . 0.0 110.234 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.403 ' OD1' ' SG ' ' A' ' 14' ' ' CYS . 0.9 OUTLIER -119.52 76.84 1.16 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -0.912 . . . . 0.0 110.402 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -121.74 -8.95 7.21 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -91.67 -49.19 6.42 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.252 -1.146 . . . . 0.0 110.165 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.0 p -101.46 121.13 41.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.405 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.573 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.4 mt -90.03 -40.18 12.47 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -0.927 . . . . 0.0 110.402 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.573 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.6 m80 -114.19 89.93 3.22 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.204 -0.935 . . . . 0.0 110.12 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.46 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 171.1 -167.1 40.27 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -117.68 162.85 17.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.368 -1.078 . . . . 0.0 110.298 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -98.16 137.97 36.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.262 -0.899 . . . . 0.0 110.185 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.588 ' CG2' ' CD1' ' A' ' 3' ' ' ILE . 15.9 mm -142.38 172.71 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.319 -0.863 . . . . 0.0 110.169 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.512 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 32.1 t80 -134.4 136.02 43.02 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.103 -0.998 . . . . 0.0 109.849 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.562 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 3.4 mm? -99.54 132.37 44.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.019 -1.051 . . . . 0.0 111.043 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.498 HG12 ' N ' ' A' ' 2' ' ' SER . 11.5 p -90.77 -24.58 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.6 -0.688 . . . . 0.0 110.722 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.498 ' N ' HG11 ' A' ' 23' ' ' VAL . 13.3 m-20 -78.05 -15.14 59.17 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.027 -1.046 . . . . 0.0 108.801 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.544 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -147.17 67.17 1.14 Allowed 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.641 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.492 ' C ' ' O ' ' A' ' 25' ' ' MET . 61.9 p -28.97 88.63 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.762 0.792 . . . . 0.0 111.403 -178.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.65 149.0 16.36 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.974 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.517 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.5 t30 -59.3 157.33 11.02 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.303 -0.873 . . . . 0.0 109.886 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.582 ' CD1' ' N ' ' A' ' 30' ' ' CYS . 12.9 t80 -138.87 159.77 41.34 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.312 -0.867 . . . . 0.0 109.699 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 28.6 m -153.47 107.61 3.06 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.07 -1.019 . . . . 0.0 110.595 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.468 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 1.3 tpp180 -82.43 121.35 26.62 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.252 -0.905 . . . . 0.0 109.468 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 75.8 m -79.46 170.75 16.12 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.219 -0.926 . . . . 0.0 110.549 -179.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -79.51 114.47 18.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.399 -0.813 . . . . 0.0 110.052 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 47.2 t -47.54 103.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.392 -0.818 . . . . 0.0 109.75 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 145.93 -10.66 1.62 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.477 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.39 176.16 9.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.112 -1.228 . . . . 0.0 109.84 179.905 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.625 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -115.03 31.56 6.61 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.98 -1.075 . . . . 0.0 110.878 -179.432 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.26 159.84 31.17 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.7 p -86.98 37.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -1.122 . . . . 0.0 109.545 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.579 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -150.7 15.06 0.76 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.463 -0.773 . . . . 0.0 110.005 -179.441 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 9.4 p 32.67 87.19 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.67 -0.644 . . . . 0.0 110.6 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.579 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 1.5 tt0 -151.2 -38.76 0.12 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.403 -0.81 . . . . 0.0 110.286 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.625 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.6 p-80 -120.53 128.5 53.16 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.04 -1.038 . . . . 0.0 110.703 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 25.0 t80 -86.76 128.3 35.02 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.424 0.63 . . . . 0.0 110.155 -178.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.593 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -95.38 6.26 49.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.429 -0.794 . . . . 0.0 110.118 -179.391 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 C--N 1.302 -1.48 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.443 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.453 ' HB3' HG12 ' A' ' 23' ' ' VAL . 1.3 t . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.296 0.57 . . . . 0.0 110.287 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.535 HD11 ' CD1' ' A' ' 20' ' ' ILE . 0.9 OUTLIER -122.56 152.91 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.308 -0.87 . . . . 0.0 110.139 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.513 ' N ' HG13 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -125.97 172.78 9.65 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.229 -0.919 . . . . 0.0 110.267 -179.972 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.91 166.25 12.27 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.244 -0.91 . . . . 0.0 110.19 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 21.6 m -92.8 -143.76 0.22 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.211 -0.931 . . . . 0.0 110.186 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 t -137.12 -178.85 5.39 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 110.131 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.6 m -81.76 8.56 9.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.25 -0.906 . . . . 0.0 110.171 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -125.84 21.49 7.59 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.243 -0.911 . . . . 0.0 110.238 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.67 21.86 2.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.226 -0.922 . . . . 0.0 110.188 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.428 ' OD1' ' SG ' ' A' ' 19' ' ' CYS . 72.1 m-20 -113.58 91.33 3.6 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.224 -0.922 . . . . 0.0 110.163 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -158.99 49.4 0.41 Allowed Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -144.98 -65.75 0.33 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -1.145 . . . . 0.0 110.191 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.601 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.6 p -83.64 125.68 32.08 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.224 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.575 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -89.48 -41.4 12.08 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.19 -0.944 . . . . 0.0 110.369 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.575 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.7 m80 -112.5 77.21 1.03 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.117 -0.989 . . . . 0.0 110.209 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -170.08 178.5 42.87 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -107.19 140.08 40.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.295 -1.121 . . . . 0.0 110.36 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -82.28 139.85 33.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.218 -0.927 . . . . 0.0 109.965 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.637 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 26.3 pt -156.21 -163.58 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.199 -0.938 . . . . 0.0 110.205 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.576 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 5.3 t80 -153.48 141.61 20.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.156 -0.965 . . . . 0.0 109.882 -179.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.598 HD21 ' CD2' ' A' ' 29' ' ' TYR . 1.7 mm? -92.48 136.02 33.57 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.187 -0.946 . . . . 0.0 110.875 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.453 HG12 ' HB3' ' A' ' 2' ' ' SER . 7.7 p -90.94 -27.81 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.387 -0.821 . . . . 0.0 110.706 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' A' ' 25' ' ' MET . 58.3 p30 -78.46 -12.85 60.03 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.91 -1.118 . . . . 0.0 109.002 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 51.2 mtt -147.98 65.82 1.1 Allowed 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.576 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 69.0 p -29.68 89.25 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.703 0.763 . . . . 0.0 111.51 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.26 147.88 16.36 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.864 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.516 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 20.4 p30 -58.36 132.92 55.11 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.127 -0.983 . . . . 0.0 110.141 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.637 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 10.3 t80 -128.27 123.25 33.66 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.316 -0.865 . . . . 0.0 110.276 -179.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.601 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.7 m -113.74 115.2 27.44 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.09 -1.006 . . . . 0.0 110.172 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -86.18 100.6 12.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.13 -0.981 . . . . 0.0 109.569 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 86.6 m -79.52 172.68 13.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.319 -0.863 . . . . 0.0 110.239 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -79.53 127.64 32.38 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.324 -0.86 . . . . 0.0 109.859 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.9 t -71.49 -13.64 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.353 -0.842 . . . . 0.0 110.236 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -74.85 -7.45 80.86 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.535 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -79.78 177.5 8.85 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.183 -1.187 . . . . 0.0 110.091 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.615 HG22 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.59 27.57 9.52 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.922 -1.112 . . . . 0.0 110.13 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -159.07 157.76 28.81 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.321 -1.512 . . . . 0.0 109.321 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.531 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 67.1 t -84.84 43.52 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.186 -1.185 . . . . 0.0 109.705 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.533 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -155.85 16.26 0.36 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.274 -0.891 . . . . 0.0 110.258 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 9.0 p 32.17 89.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.59 -0.694 . . . . 0.0 110.639 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.533 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 1.8 tt0 -155.95 -41.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.326 -0.859 . . . . 0.0 110.121 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.615 ' CE1' HG22 ' A' ' 37' ' ' THR . 1.4 p-80 -118.37 126.36 51.94 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.066 -1.022 . . . . 0.0 110.512 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.591 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.4 t80 -87.5 129.02 35.22 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.553 -0.717 . . . . 0.0 109.986 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.549 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -92.64 -32.43 14.77 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.432 -0.793 . . . . 0.0 110.091 -179.412 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.591 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.8 mt . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.313 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.456 ' HB3' HG13 ' A' ' 23' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.197 0.523 . . . . 0.0 110.221 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.524 ' CD1' ' HB ' ' A' ' 20' ' ' ILE . 0.9 OUTLIER -109.86 149.94 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.254 -0.904 . . . . 0.0 110.247 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.454 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -115.53 179.46 3.96 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.256 -0.903 . . . . 0.0 110.215 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.62 170.81 8.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.242 -0.911 . . . . 0.0 110.199 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 97.8 m -108.48 -167.98 1.3 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.249 -0.907 . . . . 0.0 110.352 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.4 t -130.12 -138.97 0.22 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.058 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 33.0 t -79.71 5.61 12.95 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.09 -1.006 . . . . 0.0 110.133 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -97.33 8.7 44.06 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.283 -0.886 . . . . 0.0 110.018 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.453 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 22.3 ptt? -79.59 -14.06 59.08 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.323 -0.86 . . . . 0.0 110.455 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -107.96 90.15 3.21 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.21 -0.931 . . . . 0.0 110.087 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -171.4 -35.43 0.03 OUTLIER Glycine 0 N--CA 1.487 2.096 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -107.99 -62.82 1.39 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.219 -1.165 . . . . 0.0 110.418 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.601 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.1 p -87.31 117.93 26.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.196 -0.94 . . . . 0.0 110.483 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.577 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.3 mt -78.88 -42.8 26.4 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.293 -0.88 . . . . 0.0 109.985 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.579 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 4.4 m80 -119.32 86.75 2.61 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.416 -0.803 . . . . 0.0 110.368 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.46 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -179.47 171.1 42.83 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -96.86 162.7 13.29 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.239 -1.153 . . . . 0.0 110.495 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -109.78 132.15 54.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.368 -0.833 . . . . 0.0 110.532 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.524 ' HB ' ' CD1' ' A' ' 3' ' ' ILE . 0.1 OUTLIER -147.3 167.91 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.4 -0.812 . . . . 0.0 109.932 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.493 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 7.0 t80 -120.04 120.44 36.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.131 -0.981 . . . . 0.0 110.178 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.577 HD12 ' CD2' ' A' ' 29' ' ' TYR . 11.1 mt -83.7 136.1 34.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.154 -0.966 . . . . 0.0 110.862 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.503 HG11 ' N ' ' A' ' 24' ' ' ASP . 14.8 p -88.66 -29.5 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.466 -0.771 . . . . 0.0 110.1 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.503 ' N ' HG11 ' A' ' 23' ' ' VAL . 44.3 t0 -78.63 -21.86 47.81 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.178 -0.951 . . . . 0.0 108.752 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.574 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -134.34 61.13 1.68 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 178.65 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.47 ' C ' ' O ' ' A' ' 25' ' ' MET . 7.3 p -28.89 85.53 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.523 0.678 . . . . 0.0 111.906 -178.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.574 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -161.35 164.74 29.84 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.613 -0.679 . . . . 0.0 109.633 179.522 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -79.51 91.95 5.22 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.407 -0.808 . . . . 0.0 109.701 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.577 ' CD2' HD12 ' A' ' 22' ' ' LEU . 5.9 t80 -79.8 135.6 36.52 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.414 -0.804 . . . . 0.0 109.826 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.601 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -122.23 117.11 25.38 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.092 -1.005 . . . . 0.0 110.591 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.46 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -80.41 136.74 36.41 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.177 -0.952 . . . . 0.0 109.413 179.16 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.632 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 6.3 m -80.38 166.25 21.46 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.178 -0.951 . . . . 0.0 109.764 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.521 ' O ' ' N ' ' A' ' 35' ' ' GLY . 17.9 tt0 -78.41 110.06 13.14 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.122 -0.986 . . . . 0.0 108.772 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' A' ' 33' ' ' GLU . 26.0 t -37.49 93.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 CA-C-O 121.422 0.63 . . . . 0.0 110.412 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 149.87 -15.17 1.04 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.579 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.5 m-85 -80.51 173.95 12.09 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.177 -1.19 . . . . 0.0 110.198 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.592 ' CG2' ' CB ' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -125.47 45.68 2.54 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.055 -1.028 . . . . 0.0 110.835 -179.745 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.03 153.42 24.39 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.3 p -88.23 20.03 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.269 -1.136 . . . . 0.0 109.761 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.594 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 3.1 tmm_? -125.25 -16.78 5.85 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.442 -0.787 . . . . 0.0 110.073 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.632 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.8 m 69.79 83.76 0.15 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.312 -0.868 . . . . 0.0 109.919 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.594 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -156.72 -31.11 0.09 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.388 -0.82 . . . . 0.0 111.247 -179.738 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.589 ' CE1' HG21 ' A' ' 37' ' ' THR . 4.2 p80 -123.89 123.65 40.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.634 -1.291 . . . . 0.0 111.084 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.605 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 28.1 t80 -82.9 105.82 14.21 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.129 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -65.03 -16.16 63.14 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.187 -0.945 . . . . 0.0 109.778 -179.781 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.605 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.7 mt . . . . . 0 N--CA 1.488 1.459 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.28 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.503 ' CB ' HG13 ' A' ' 23' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.209 0.528 . . . . 0.0 110.239 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.532 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 2.5 tt -133.44 161.16 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.296 -0.877 . . . . 0.0 110.194 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.449 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.2 OUTLIER -126.94 -177.99 4.24 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.209 -0.932 . . . . 0.0 110.326 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.77 171.24 7.61 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.226 -0.921 . . . . 0.0 110.275 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 64.4 m -107.25 -163.08 0.88 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.286 -0.884 . . . . 0.0 110.223 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.56 -167.08 1.67 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.322 -0.861 . . . . 0.0 110.207 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.6 t -83.61 9.27 11.89 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.164 -0.96 . . . . 0.0 110.31 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -134.36 26.09 3.8 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.226 -0.921 . . . . 0.0 110.334 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 ttm -143.94 16.03 1.74 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.262 -0.899 . . . . 0.0 110.217 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.1 p-10 -111.75 57.87 0.63 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -0.906 . . . . 0.0 110.279 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -110.81 62.12 0.29 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.428 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 64.2 t80 -160.18 -50.27 0.05 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.381 -1.07 . . . . 0.0 110.196 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -104.39 119.89 39.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.346 -0.846 . . . . 0.0 110.324 -179.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.521 HD21 ' N ' ' A' ' 15' ' ' LEU . 5.6 mt -90.49 -48.29 7.19 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.228 -0.92 . . . . 0.0 110.127 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.577 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 11.2 m80 -103.73 69.39 0.97 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.368 -0.833 . . . . 0.0 110.25 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -174.14 -170.59 37.62 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -114.84 137.59 51.78 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.199 -1.177 . . . . 0.0 110.337 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -85.31 146.91 26.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.262 -0.899 . . . . 0.0 110.045 179.801 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.537 ' CG2' ' O ' ' A' ' 19' ' ' CYS . 8.1 pt -159.46 -174.57 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.282 -0.886 . . . . 0.0 110.272 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 5.9 t80 -135.97 120.54 18.24 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.283 -0.885 . . . . 0.0 109.825 179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.522 HD12 ' CD2' ' A' ' 29' ' ' TYR . 13.2 mt -79.71 131.69 36.01 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.242 -0.911 . . . . 0.0 110.975 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.503 HG13 ' CB ' ' A' ' 2' ' ' SER . 7.7 p -87.49 -27.98 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 109.839 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.461 ' N ' HG11 ' A' ' 23' ' ' VAL . 3.9 m-20 -78.65 -20.63 49.84 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 108.739 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.562 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -140.18 63.69 1.47 Allowed 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.79 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.485 ' C ' ' O ' ' A' ' 25' ' ' MET . 20.1 p -29.12 87.55 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 121.682 0.753 . . . . 0.0 111.503 -178.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.562 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.97 148.85 15.71 Favored 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.652 -0.655 . . . . 0.0 109.371 179.937 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.504 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 7.7 p30 -64.44 105.05 0.86 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.316 -0.865 . . . . 0.0 109.762 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.522 ' CD2' HD12 ' A' ' 22' ' ' LEU . 4.9 t80 -99.75 144.66 28.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.343 -0.848 . . . . 0.0 110.018 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 42.9 m -137.44 115.33 11.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.011 -1.056 . . . . 0.0 110.581 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -80.87 114.94 20.09 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.221 -0.925 . . . . 0.0 109.683 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 91.2 m -79.6 172.99 13.03 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.21 -0.932 . . . . 0.0 110.44 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -79.44 118.41 21.3 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.371 -0.831 . . . . 0.0 109.964 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.2 t -50.87 106.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.301 -0.874 . . . . 0.0 109.763 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.455 ' O ' HD11 ' A' ' 46' ' ' LEU . . . 143.97 -10.76 2.08 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.577 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.37 168.45 19.49 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.159 -1.2 . . . . 0.0 109.829 179.855 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.589 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.71 30.58 6.18 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.952 -1.093 . . . . 0.0 110.791 -179.742 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.12 154.61 25.66 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 11.6 p -84.87 44.22 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.297 -1.119 . . . . 0.0 109.759 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.549 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.55 22.58 0.18 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.461 -0.774 . . . . 0.0 109.759 -179.571 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 2.9 p 27.78 92.05 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 CA-C-O 121.387 0.613 . . . . 0.0 111.452 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.549 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -153.29 -37.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.442 -0.786 . . . . 0.0 110.278 179.833 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.589 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.9 p80 -121.92 116.48 24.45 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.194 -0.941 . . . . 0.0 110.451 179.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.557 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 38.0 t80 -79.89 115.47 19.5 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.477 0.656 . . . . 0.0 109.882 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.528 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -82.93 -26.24 31.62 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.295 -0.878 . . . . 0.0 110.038 -179.557 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.557 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.5 mt . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.172 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.52 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.209 0.528 . . . . 0.0 110.222 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.522 ' CD1' ' CG2' ' A' ' 20' ' ' ILE . 1.8 tt -121.42 156.3 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.266 -0.896 . . . . 0.0 110.248 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.533 ' O ' ' CG2' ' A' ' 20' ' ' ILE . 4.9 t -141.56 -150.59 0.32 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.334 -0.854 . . . . 0.0 110.087 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.434 ' N ' ' CG2' ' A' ' 4' ' ' THR . 7.6 mttt -118.18 -174.82 2.73 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.502 -0.749 . . . . 0.0 110.446 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 67.4 m -109.97 -150.04 0.45 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.344 -0.848 . . . . 0.0 110.201 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.12 -170.69 1.93 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.27 -0.893 . . . . 0.0 110.17 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.78 15.54 11.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.238 -0.913 . . . . 0.0 110.224 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -128.9 31.36 4.94 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.215 -0.928 . . . . 0.0 110.181 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.4 ttt -148.21 20.03 1.09 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.267 -0.896 . . . . 0.0 110.337 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -101.82 75.02 1.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.897 . . . . 0.0 110.145 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -136.15 20.54 3.57 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -119.49 -58.56 1.9 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.12 -1.223 . . . . 0.0 110.297 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.0 p -97.06 121.71 39.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.321 -0.862 . . . . 0.0 110.349 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.54 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.8 mt -90.79 -45.55 8.75 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.222 -0.924 . . . . 0.0 110.382 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.57 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 6.3 m80 -108.81 77.03 1.05 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.257 -0.902 . . . . 0.0 110.148 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -173.09 -163.61 27.1 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -123.32 135.49 54.22 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.218 -1.166 . . . . 0.0 110.209 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t -79.9 144.94 32.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -0.887 . . . . 0.0 110.11 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.533 ' CG2' ' O ' ' A' ' 4' ' ' THR . 0.0 OUTLIER -158.18 -179.86 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.22 -0.925 . . . . 0.0 109.565 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.487 ' O ' HG13 ' A' ' 3' ' ' ILE . 17.9 t80 -144.22 128.58 17.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.886 -1.134 . . . . 0.0 110.449 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.552 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.7 mm? -85.14 130.63 34.57 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.15 -0.969 . . . . 0.0 110.789 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.52 HG11 ' CB ' ' A' ' 2' ' ' SER . 6.0 p -90.86 -25.74 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.345 -0.847 . . . . 0.0 110.564 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -78.08 -3.62 43.21 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.008 -1.057 . . . . 0.0 108.925 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.522 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -159.81 68.41 0.4 Allowed 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 179.18 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.509 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.58 91.76 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.981 0.896 . . . . 0.0 111.2 -178.409 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -160.18 147.95 16.53 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.504 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 23.1 t30 -63.21 128.71 37.09 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.373 -0.83 . . . . 0.0 110.235 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.552 ' CD2' HD23 ' A' ' 22' ' ' LEU . 6.5 t80 -122.16 116.58 24.43 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.357 -0.839 . . . . 0.0 110.108 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -122.57 112.69 18.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.223 -0.923 . . . . 0.0 110.142 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -80.13 102.06 9.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.173 -0.954 . . . . 0.0 109.842 179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 74.4 m -79.54 170.42 16.59 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.875 . . . . 0.0 110.041 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 32.2 tt0 -79.45 125.45 29.57 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.221 -0.924 . . . . 0.0 109.807 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.5 t -66.43 -20.72 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.398 -0.814 . . . . 0.0 110.182 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.93 -10.6 56.35 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.57 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.79 176.52 9.65 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -1.185 . . . . 0.0 109.912 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.583 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -108.64 27.48 9.37 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.907 -1.121 . . . . 0.0 110.343 179.573 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -159.29 155.59 26.68 Favored Glycine 0 N--CA 1.488 2.137 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.5 p -84.63 43.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.289 -1.124 . . . . 0.0 109.815 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.552 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -157.02 20.11 0.31 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.32 -0.862 . . . . 0.0 110.051 -179.557 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 8.9 p 29.22 91.42 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.495 0.664 . . . . 0.0 111.614 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.552 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.3 tt0 -155.56 -36.96 0.09 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.339 -0.851 . . . . 0.0 110.158 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.583 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.4 p80 -121.13 121.07 37.05 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.143 -0.973 . . . . 0.0 110.462 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.579 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 33.8 t80 -83.88 121.94 28.03 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.378 0.609 . . . . 0.0 109.839 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.554 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.2 OUTLIER -92.22 -19.83 21.8 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.28 -0.888 . . . . 0.0 110.069 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.579 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.0 mt . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.327 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 121.216 0.531 . . . . 0.0 110.469 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.523 ' CD1' HG21 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -79.93 153.97 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.242 -0.911 . . . . 0.0 109.913 179.675 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.4 m -136.05 162.19 33.59 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.281 -0.887 . . . . 0.0 110.252 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -93.6 -178.8 4.82 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.433 -0.792 . . . . 0.0 110.099 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 15.5 m -110.97 -163.42 0.85 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.219 -0.926 . . . . 0.0 110.274 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.55 -158.84 0.9 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.271 -0.893 . . . . 0.0 110.159 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.0 p -81.77 168.65 17.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.234 -0.917 . . . . 0.0 110.121 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 46.5 23.68 0.25 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.141 -0.974 . . . . 0.0 110.345 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -120.75 -0.77 10.1 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 110.163 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -120.56 101.41 7.74 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.237 -0.914 . . . . 0.0 110.257 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -138.65 16.44 3.32 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -114.74 -53.4 2.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.313 -1.11 . . . . 0.0 110.284 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -93.62 123.11 36.72 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.295 -0.878 . . . . 0.0 110.632 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.543 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.5 mt -90.31 -42.85 10.73 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.267 -0.896 . . . . 0.0 110.315 179.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.543 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.9 m80 -109.8 88.27 2.71 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.302 -0.874 . . . . 0.0 110.165 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.13 -167.61 40.6 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -123.23 159.43 28.73 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.227 -1.16 . . . . 0.0 110.357 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.3 OUTLIER -99.94 149.21 23.66 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.231 -0.918 . . . . 0.0 110.504 -179.807 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.523 HG21 ' CD1' ' A' ' 3' ' ' ILE . 1.4 mt -155.0 -171.64 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.364 -0.835 . . . . 0.0 109.531 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.486 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 18.7 t80 -145.55 133.56 21.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.042 -1.036 . . . . 0.0 109.644 179.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.587 HD23 ' CD2' ' A' ' 29' ' ' TYR . 2.1 mm? -99.4 137.96 37.16 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.129 -0.982 . . . . 0.0 111.076 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.518 HG13 ' N ' ' A' ' 24' ' ' ASP . 7.2 p -90.38 -26.01 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.38 -0.825 . . . . 0.0 110.52 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.518 ' N ' HG13 ' A' ' 23' ' ' VAL . 49.0 p30 -77.9 -4.73 48.24 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.119 -0.988 . . . . 0.0 109.095 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.556 ' O ' ' N ' ' A' ' 27' ' ' GLN . 8.8 mtm -157.95 65.57 0.46 Allowed 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 179.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.474 ' C ' ' O ' ' A' ' 25' ' ' MET . 68.4 p -29.28 86.93 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 CA-C-O 121.614 0.721 . . . . 0.0 111.831 -178.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.556 ' N ' ' O ' ' A' ' 25' ' ' MET . 2.9 pt20 -160.9 174.91 13.13 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.707 -0.621 . . . . 0.0 109.405 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -79.28 146.85 32.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.345 -0.847 . . . . 0.0 110.549 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.587 ' CD2' HD23 ' A' ' 22' ' ' LEU . 8.1 t80 -129.88 108.54 10.21 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.53 -0.732 . . . . 0.0 109.592 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 5.8 m -111.72 107.77 16.97 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.104 -0.998 . . . . 0.0 110.74 -179.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.465 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -79.57 121.63 25.48 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.182 -0.948 . . . . 0.0 109.218 179.182 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 89.9 m -79.38 173.67 12.34 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.221 -0.925 . . . . 0.0 110.137 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -78.94 115.1 18.4 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.229 -0.919 . . . . 0.0 109.8 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.0 t -51.93 100.89 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.498 -0.751 . . . . 0.0 109.883 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 151.69 -13.64 0.78 Allowed Glycine 0 N--CA 1.493 2.449 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.428 ' CZ ' ' HD1' ' A' ' 44' ' ' PHE . 1.2 m-85 -79.13 170.54 16.5 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.012 -1.287 . . . . 0.0 110.049 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.556 HG22 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -112.38 35.72 3.69 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.937 -1.102 . . . . 0.0 110.544 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.406 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -160.29 154.9 25.97 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.0 p -85.18 45.43 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.21 -1.171 . . . . 0.0 109.47 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.559 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -158.76 20.01 0.21 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.518 -0.739 . . . . 0.0 109.979 -179.179 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 2.8 p 27.12 93.56 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.577 -0.702 . . . . 0.0 111.541 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.548 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 4.4 tt0 -160.73 -35.65 0.05 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.549 -0.719 . . . . 0.0 110.323 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.556 ' CE1' HG22 ' A' ' 37' ' ' THR . 7.4 p80 -124.15 112.55 17.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.111 -0.993 . . . . 0.0 110.652 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.428 ' HD1' ' CZ ' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -79.89 134.25 36.28 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.297 -0.877 . . . . 0.0 109.508 179.309 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.55 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -91.14 -24.05 20.08 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.362 -0.836 . . . . 0.0 110.212 -179.303 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.54 ' HG ' ' CD2' ' A' ' 45' ' ' PHE . 1.9 mt . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.277 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.189 0.518 . . . . 0.0 110.255 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.569 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 6.4 tt -79.93 157.29 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.513 HG23 ' N ' ' A' ' 5' ' ' LYS . 6.4 t -142.58 -153.85 0.49 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.296 -0.877 . . . . 0.0 110.006 179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.513 ' N ' HG23 ' A' ' 4' ' ' THR . 11.7 mtpt -102.73 178.61 4.52 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.394 -0.816 . . . . 0.0 110.258 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 59.6 m -105.69 -150.87 0.44 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.175 -0.953 . . . . 0.0 110.247 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.5 m -111.2 -170.03 1.57 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.209 -0.932 . . . . 0.0 110.203 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.68 13.34 8.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -0.888 . . . . 0.0 110.185 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.63 21.78 5.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.293 -0.88 . . . . 0.0 110.214 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -127.04 3.53 6.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.255 -0.903 . . . . 0.0 110.136 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.428 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 21.5 p30 -86.07 48.65 1.64 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.287 -0.883 . . . . 0.0 110.103 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -126.06 3.55 7.88 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -101.22 -48.49 4.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.15 -1.206 . . . . 0.0 110.27 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 22.1 p -105.16 116.18 31.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.291 -0.881 . . . . 0.0 110.63 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.575 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.6 mt -90.43 -39.05 12.87 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.301 -0.875 . . . . 0.0 110.506 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.595 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 21.3 m80 -110.73 63.11 0.61 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.109 -0.995 . . . . 0.0 110.555 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.474 ' HA3' ' SG ' ' A' ' 32' ' ' CYS . . . -173.51 -160.32 21.69 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -122.66 136.25 54.82 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.292 -1.122 . . . . 0.0 110.177 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t -84.64 146.73 27.33 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.326 -0.859 . . . . 0.0 110.449 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.569 ' CD1' ' CD1' ' A' ' 3' ' ' ILE . 5.0 pt -157.78 -170.61 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.379 -0.826 . . . . 0.0 110.104 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.478 ' O ' HG13 ' A' ' 3' ' ' ILE . 4.6 t80 -140.9 133.7 28.94 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.112 -0.993 . . . . 0.0 110.097 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.605 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.2 mm? -86.7 133.74 33.65 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.122 -0.986 . . . . 0.0 111.113 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.496 HG11 ' N ' ' A' ' 24' ' ' ASP . 7.2 p -90.83 -25.23 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.412 -0.805 . . . . 0.0 110.67 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.522 ' OD2' ' CD1' ' A' ' 22' ' ' LEU . 2.9 p30 -78.64 -15.52 58.41 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.047 -1.033 . . . . 0.0 108.9 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.6 mtt -147.43 67.0 1.13 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.1 p -29.11 88.76 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.693 0.758 . . . . 0.0 111.661 -178.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.3 OUTLIER -160.28 173.44 15.7 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.673 -0.642 . . . . 0.0 109.561 179.643 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -77.18 136.89 38.6 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.368 -0.832 . . . . 0.0 110.522 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.617 ' CD1' ' N ' ' A' ' 30' ' ' CYS . 8.6 t80 -135.82 154.42 51.19 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.461 -0.774 . . . . 0.0 109.653 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.617 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 3.0 m -153.64 123.51 6.83 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.926 -1.109 . . . . 0.0 110.94 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.3 tpp85 -103.04 106.72 17.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.175 -0.953 . . . . 0.0 109.093 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 27.0 m -111.27 -164.82 0.94 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.293 -0.88 . . . . 0.0 110.592 -178.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -78.24 123.05 26.49 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.244 -0.91 . . . . 0.0 109.615 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.4 t -64.5 -10.59 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.447 -0.783 . . . . 0.0 109.707 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.72 -7.09 53.86 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.595 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.6 m-85 -79.46 165.13 23.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.18 -1.188 . . . . 0.0 109.407 179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.58 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.61 34.0 4.22 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.878 -1.139 . . . . 0.0 111.478 -178.823 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.7 159.5 31.02 Favored Glycine 0 N--CA 1.491 2.336 0 C-N-CA 119.351 -1.404 . . . . 0.0 110.075 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -84.33 13.04 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -1.119 . . . . 0.0 109.362 178.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.543 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 28.0 ttp180 -109.08 -17.62 13.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.569 -0.707 . . . . 0.0 110.116 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 21.9 m 61.11 58.65 2.18 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.315 -0.866 . . . . 0.0 110.607 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.543 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER -136.35 -19.53 1.44 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.482 -0.761 . . . . 0.0 111.278 179.93 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.58 ' CE1' HG23 ' A' ' 37' ' ' THR . 4.9 p80 -127.52 119.93 27.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.736 -1.227 . . . . 0.0 110.7 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.603 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 21.1 t80 -81.75 108.22 15.12 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.327 0.584 . . . . 0.0 109.964 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.564 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -64.61 -15.9 61.87 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.222 -0.924 . . . . 0.0 109.912 -179.773 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.603 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.0 mt . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.27 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.593 ' CB ' ' CG1' ' A' ' 23' ' ' VAL . 48.3 m . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.433 0.635 . . . . 0.0 110.147 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.541 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -139.18 153.0 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.297 -0.877 . . . . 0.0 110.043 -179.954 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.48 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -132.83 162.23 32.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.261 -0.899 . . . . 0.0 110.425 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -101.93 168.16 9.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.335 -0.853 . . . . 0.0 110.129 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 58.4 m -108.83 -145.66 0.4 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.227 -0.92 . . . . 0.0 110.253 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.495 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.3 OUTLIER -153.79 -158.27 0.85 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.311 -0.868 . . . . 0.0 110.062 179.877 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.495 ' N ' ' OG ' ' A' ' 7' ' ' SER . 3.0 t -80.5 168.62 18.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.154 -0.966 . . . . 0.0 110.231 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.6 t0 47.88 22.86 0.4 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.097 -1.002 . . . . 0.0 110.286 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.19 8.17 8.53 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.326 -0.859 . . . . 0.0 110.176 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -114.75 -142.72 0.38 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.285 -0.885 . . . . 0.0 110.04 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 116.94 -0.17 19.62 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.415 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 65.2 t80 -110.48 -51.35 2.88 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.222 -1.163 . . . . 0.0 110.132 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.2 p -96.67 120.74 37.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.307 -0.871 . . . . 0.0 110.163 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.571 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 10.8 mt -88.17 -40.96 13.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.201 -0.937 . . . . 0.0 110.377 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.571 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.1 m80 -114.2 80.3 1.37 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.216 -0.928 . . . . 0.0 110.037 -179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.484 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -179.74 -168.25 38.25 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.473 ' O ' HD11 ' A' ' 20' ' ' ILE . 87.1 mt-30 -115.04 167.55 10.71 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.298 -1.119 . . . . 0.0 110.283 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.3 t -103.68 126.36 50.77 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.394 -0.816 . . . . 0.0 110.378 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.585 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -130.25 -172.9 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.322 -0.861 . . . . 0.0 109.555 -179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.48 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 14.5 t80 -145.82 142.85 29.23 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.894 -1.129 . . . . 0.0 110.19 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.551 HD23 ' CD1' ' A' ' 29' ' ' TYR . 1.2 mm? -104.14 136.64 43.38 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.108 -0.995 . . . . 0.0 111.37 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.593 ' CG1' ' CB ' ' A' ' 2' ' ' SER . 14.7 p -90.78 -27.69 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.352 -0.842 . . . . 0.0 110.556 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.549 ' N ' HG13 ' A' ' 23' ' ' VAL . 34.2 m-20 -78.77 -19.04 53.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.035 -1.041 . . . . 0.0 108.839 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.542 ' HB3' ' NE2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -138.84 63.6 1.51 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.735 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.486 ' C ' ' O ' ' A' ' 25' ' ' MET . 11.5 p -28.75 89.03 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.679 0.752 . . . . 0.0 111.543 -178.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.542 ' NE2' ' HB3' ' A' ' 25' ' ' MET . 0.6 OUTLIER -159.73 176.74 11.61 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.609 -0.682 . . . . 0.0 109.73 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -88.09 115.94 25.92 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.495 -0.753 . . . . 0.0 110.352 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.551 ' CD1' HD23 ' A' ' 22' ' ' LEU . 28.7 t80 -91.08 157.03 17.47 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.493 -0.755 . . . . 0.0 109.73 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -141.15 112.85 7.64 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.067 -1.02 . . . . 0.0 110.403 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.484 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 11.1 tpp180 -88.66 115.77 26.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.262 -0.898 . . . . 0.0 109.479 179.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 91.4 m -79.05 170.12 17.15 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.281 -0.887 . . . . 0.0 110.391 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -79.44 113.97 18.0 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.316 -0.865 . . . . 0.0 110.143 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 47.4 t -48.12 104.62 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.362 -0.836 . . . . 0.0 109.786 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.92 -9.18 2.27 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.525 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.41 175.58 10.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.13 -1.217 . . . . 0.0 109.832 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -116.95 13.14 14.85 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.025 -1.047 . . . . 0.0 110.818 -179.583 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -128.74 161.73 22.36 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 39' ' ' VAL . 11.3 p -87.67 31.55 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.298 -1.119 . . . . 0.0 109.743 179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.562 ' CG ' ' O ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -160.37 29.62 0.16 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.332 -0.855 . . . . 0.0 109.962 -179.655 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 8.1 p 31.76 90.8 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.616 -0.677 . . . . 0.0 111.13 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.539 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 4.0 tm-20 -154.02 -39.88 0.09 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.295 -0.878 . . . . 0.0 110.098 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.2 p-80 -117.21 128.49 55.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.093 -1.004 . . . . 0.0 110.202 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.574 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 34.9 t80 -88.62 130.49 35.27 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.436 0.636 . . . . 0.0 110.528 -178.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -93.48 -36.8 12.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.409 -0.807 . . . . 0.0 110.001 -179.741 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.574 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.379 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.454 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 3.7 t . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.335 0.588 . . . . 0.0 110.376 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.524 HG12 ' CG2' ' A' ' 20' ' ' ILE . 5.5 tt -80.03 -178.25 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.209 -0.932 . . . . 0.0 110.003 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.475 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -155.19 160.74 41.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.238 -0.914 . . . . 0.0 110.246 -179.896 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.5 mtmm -110.36 161.93 15.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.297 -0.877 . . . . 0.0 110.218 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.61 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.1 m -103.73 -144.64 0.37 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.269 -0.895 . . . . 0.0 110.101 179.991 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.413 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 0.5 OUTLIER -127.61 -154.43 0.63 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.183 -0.948 . . . . 0.0 110.214 179.943 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.3 m -82.35 -61.1 1.99 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.245 -0.909 . . . . 0.0 110.18 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -91.51 27.65 1.93 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.227 -0.92 . . . . 0.0 110.182 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.97 -11.83 14.93 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.274 -0.891 . . . . 0.0 110.217 -180.0 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 11' ' ' ASN . 7.7 p-10 -132.77 96.85 3.9 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.307 -0.87 . . . . 0.0 110.202 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.17 52.73 0.67 Allowed Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -121.79 -59.36 1.68 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -1.151 . . . . 0.0 110.184 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -87.75 118.75 27.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 110.296 -179.877 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.567 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.2 mt -78.72 -43.01 26.81 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.303 -0.873 . . . . 0.0 110.288 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 9.1 m80 -116.99 77.54 1.13 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.329 -0.857 . . . . 0.0 110.496 -178.919 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.441 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -175.85 167.71 39.64 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.832 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -89.96 145.55 25.03 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -1.209 . . . . 0.0 110.27 179.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.61 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 15.9 t -88.9 142.6 27.51 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.331 -0.856 . . . . 0.0 110.349 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.524 ' CG2' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -158.74 -175.44 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.314 -0.866 . . . . 0.0 109.697 179.979 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.491 ' O ' HG13 ' A' ' 3' ' ' ILE . 9.4 t80 -152.68 123.27 7.29 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.037 -1.039 . . . . 0.0 109.963 -179.852 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.546 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 1.9 mm? -82.16 130.98 35.23 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.214 -0.929 . . . . 0.0 111.048 -179.366 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.513 HG12 ' N ' ' A' ' 24' ' ' ASP . 7.7 p -90.39 -23.81 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.298 -0.876 . . . . 0.0 110.42 179.518 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.513 ' N ' HG12 ' A' ' 23' ' ' VAL . 4.2 m-20 -78.39 -10.23 59.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.067 -1.021 . . . . 0.0 108.771 178.9 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.547 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.5 mpp? -150.86 69.0 0.96 Allowed 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.466 ' C ' ' O ' ' A' ' 25' ' ' MET . 6.9 p -29.49 87.64 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 121.575 0.702 . . . . 0.0 111.91 -178.183 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 tt0 -158.67 154.1 25.86 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.703 -0.623 . . . . 0.0 109.85 179.595 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.97 127.35 32.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.468 -0.77 . . . . 0.0 110.232 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.546 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 15.5 t80 -116.57 123.6 47.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.313 -0.867 . . . . 0.0 109.965 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 5.8 m -125.67 118.58 25.93 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.154 -0.966 . . . . 0.0 110.38 -179.78 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.448 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 5.1 tpp85 -79.43 124.85 28.84 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.218 -0.926 . . . . 0.0 109.421 179.551 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.8 m -79.4 160.4 26.68 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.214 -0.929 . . . . 0.0 109.528 -179.782 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' GLY . 16.2 tt0 -78.79 110.34 13.87 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.072 -1.017 . . . . 0.0 109.411 179.764 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.433 ' C ' ' O ' ' A' ' 33' ' ' GLU . 40.3 t -41.61 94.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.541 -0.724 . . . . 0.0 110.244 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 152.9 -17.67 0.73 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.868 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.589 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.1 m-85 -79.92 165.97 22.11 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.192 -1.181 . . . . 0.0 110.216 -179.937 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.639 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 6.1 t -120.28 35.21 4.94 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 119.103 -1.039 . . . . 0.0 110.902 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -140.6 153.87 23.87 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 179.721 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.519 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 43.1 t -85.2 14.05 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.356 -1.085 . . . . 0.0 109.782 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.574 ' CZ ' ' CB ' ' A' ' 42' ' ' GLU . 2.1 tmm_? -127.9 -15.14 4.91 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.455 -0.778 . . . . 0.0 110.399 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.1 m 71.75 85.59 0.12 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.389 -0.819 . . . . 0.0 109.719 -179.679 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.574 ' CB ' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -152.42 -31.33 0.14 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.638 -0.664 . . . . 0.0 110.715 -179.805 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.639 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 6.2 p80 -123.64 118.79 28.09 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.891 -1.131 . . . . 0.0 110.729 179.522 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.59 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 24.6 t80 -80.62 104.06 10.89 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.307 0.575 . . . . 0.0 109.9 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.557 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -64.85 -22.21 66.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.206 -0.934 . . . . 0.0 109.95 -179.774 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.59 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.4 mt . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.139 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.534 ' HB3' ' CG1' ' A' ' 23' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.343 0.592 . . . . 0.0 110.116 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.541 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.5 OUTLIER -143.97 153.62 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.325 -0.86 . . . . 0.0 110.342 -179.769 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.462 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -131.15 173.97 10.5 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.238 -0.914 . . . . 0.0 110.251 179.906 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -106.75 165.14 11.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.234 -0.916 . . . . 0.0 110.149 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.7 m -102.11 -141.17 0.35 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.254 -0.904 . . . . 0.0 110.216 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.5 t -141.25 -160.91 1.13 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.28 -0.888 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.2 28.5 1.41 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.26 -0.9 . . . . 0.0 110.241 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.34 30.85 1.54 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.228 -0.92 . . . . 0.0 110.177 179.962 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -145.44 14.56 1.43 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.97 . . . . 0.0 110.245 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -109.83 75.28 0.93 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.177 -0.952 . . . . 0.0 110.234 -179.967 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.32 -7.47 6.38 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -95.57 -60.28 1.69 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.281 -1.129 . . . . 0.0 110.076 -179.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.1 p -83.89 126.66 33.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.334 -0.854 . . . . 0.0 110.136 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.537 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.5 mt -90.58 -45.72 8.74 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.138 -0.976 . . . . 0.0 110.333 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.537 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.1 m80 -109.33 77.49 1.07 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.257 -0.902 . . . . 0.0 110.233 -179.573 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -174.5 -163.49 27.86 Favored Glycine 0 N--CA 1.488 2.16 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -128.73 153.15 47.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.328 -1.101 . . . . 0.0 110.285 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -83.07 152.45 25.35 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.305 -0.872 . . . . 0.0 110.124 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.541 ' CG2' HG12 ' A' ' 3' ' ' ILE . 1.0 OUTLIER -153.62 -173.99 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.144 -0.973 . . . . 0.0 109.603 -179.894 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.462 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 23.0 t80 -147.41 133.0 18.76 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.038 -1.039 . . . . 0.0 110.162 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.585 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.4 mm? -94.7 134.64 37.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.254 -0.904 . . . . 0.0 110.468 -179.882 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.534 ' CG1' ' HB3' ' A' ' 2' ' ' SER . 8.1 p -90.38 -27.16 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.344 -0.848 . . . . 0.0 110.599 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' A' ' 25' ' ' MET . 11.2 p30 -78.16 -15.13 59.12 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.106 -0.996 . . . . 0.0 108.757 179.362 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.3 ttm -144.74 65.56 1.27 Allowed 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.852 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 19.8 p -29.05 88.7 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 121.629 0.728 . . . . 0.0 111.751 -178.321 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 7.1 pt20 -160.38 176.15 12.0 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.627 -0.671 . . . . 0.0 109.601 179.488 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -81.68 138.82 35.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.452 -179.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.585 ' CD2' HD23 ' A' ' 22' ' ' LEU . 17.7 t80 -128.15 117.32 21.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.372 -0.83 . . . . 0.0 109.838 179.861 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -114.06 117.39 31.14 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.08 -1.013 . . . . 0.0 110.621 -179.671 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.465 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.0 ttm180 -91.78 129.8 37.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.945 . . . . 0.0 109.749 179.433 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 71.9 m -79.4 175.12 10.89 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.279 -0.888 . . . . 0.0 110.241 -179.869 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -79.81 112.85 17.49 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -0.891 . . . . 0.0 109.854 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 43.4 t -47.27 105.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.361 -0.837 . . . . 0.0 109.887 -179.94 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.47 -8.89 2.37 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.743 -1.343 . . . . 0.0 109.743 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.477 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.33 176.07 10.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.116 -1.226 . . . . 0.0 110.056 179.963 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.615 HG22 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -115.12 31.31 6.78 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.119 -0.988 . . . . 0.0 110.378 -179.49 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.06 155.31 26.43 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.5 p -84.76 43.07 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.275 -1.133 . . . . 0.0 109.789 179.61 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.555 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -160.27 22.21 0.16 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.412 -0.805 . . . . 0.0 109.918 -179.537 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 6.6 p 28.95 92.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.697 -0.627 . . . . 0.0 111.472 179.767 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.4 OUTLIER -154.2 -42.85 0.09 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.378 -0.826 . . . . 0.0 110.139 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.615 ' CE1' HG22 ' A' ' 37' ' ' THR . 1.4 p-80 -118.24 127.75 54.03 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.09 -1.006 . . . . 0.0 110.364 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.588 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 37.6 t80 -86.86 128.07 35.04 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.387 0.613 . . . . 0.0 110.508 -178.65 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -92.59 -35.2 13.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.385 -0.822 . . . . 0.0 109.964 -179.758 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.588 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.22 -179.713 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.461 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.38 0.61 . . . . 0.0 110.173 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.588 ' CG1' ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -147.8 156.73 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.28 -0.887 . . . . 0.0 110.161 -179.948 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.8 m -133.43 164.32 27.4 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.294 -0.879 . . . . 0.0 110.158 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 19' ' ' CYS . 10.6 tttt -126.41 155.05 42.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.205 -0.935 . . . . 0.0 110.181 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.2 m -99.91 -146.14 0.34 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.255 -0.903 . . . . 0.0 110.227 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.5 t -122.23 -164.42 1.16 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.294 -0.879 . . . . 0.0 110.221 179.912 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -87.13 11.52 13.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.227 -0.92 . . . . 0.0 110.321 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -121.98 26.35 8.63 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.24 -0.913 . . . . 0.0 110.188 179.938 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.4 14.16 4.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.297 -0.877 . . . . 0.0 110.138 179.935 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -102.47 66.5 0.98 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.931 . . . . 0.0 110.269 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.26 26.26 10.62 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -145.86 -55.8 0.29 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -1.133 . . . . 0.0 110.249 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.4 p -90.51 127.34 36.21 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.26 -0.9 . . . . 0.0 110.354 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.536 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 3.5 mt -90.52 -44.88 9.29 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.231 -0.918 . . . . 0.0 110.344 179.885 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 18.0 m80 -110.51 89.38 3.01 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.318 -0.864 . . . . 0.0 110.487 -179.168 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.451 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.23 -161.46 31.55 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 179.931 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -134.14 149.3 51.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.292 -1.122 . . . . 0.0 110.229 179.881 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.3 t -79.9 120.29 23.93 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.216 -0.928 . . . . 0.0 110.027 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.588 ' CG2' ' CG1' ' A' ' 3' ' ' ILE . 21.2 mm -122.32 168.64 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 110.224 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.469 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 18.3 t80 -139.47 129.94 25.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 109.994 -179.988 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.608 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 3.6 mm? -90.06 134.42 34.26 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.214 -0.929 . . . . 0.0 110.638 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.461 HG11 ' HB3' ' A' ' 2' ' ' SER . 11.3 p -90.48 -25.58 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.269 -0.894 . . . . 0.0 110.541 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.438 ' N ' HG12 ' A' ' 23' ' ' VAL . 20.2 m-20 -78.34 -14.45 59.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.086 -1.009 . . . . 0.0 108.82 179.323 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.3 ttm -147.47 66.66 1.13 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.992 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 58.8 p -29.21 88.57 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.675 0.75 . . . . 0.0 111.467 -178.437 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.39 146.38 15.26 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.481 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -55.81 161.55 2.15 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.132 -0.98 . . . . 0.0 110.388 -179.711 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.608 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 5.9 t80 -154.59 86.31 1.14 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.402 -0.811 . . . . 0.0 109.906 -179.908 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.2 m -82.8 104.71 13.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.188 -0.945 . . . . 0.0 110.53 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.483 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 11.5 tpp85 -81.7 123.17 28.5 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.212 -0.93 . . . . 0.0 110.118 179.698 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 97.7 m -79.79 172.78 13.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.328 -0.858 . . . . 0.0 110.145 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -79.81 128.81 33.88 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.891 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.3 t -58.54 105.84 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.249 -0.907 . . . . 0.0 110.084 -179.937 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.525 ' O ' ' CD1' ' A' ' 46' ' ' LEU . . . 145.17 -14.16 1.88 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.716 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.589 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.2 m-85 -79.75 154.24 28.67 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.344 -1.092 . . . . 0.0 109.903 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.632 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 5.1 t -109.42 46.58 0.99 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.954 -1.092 . . . . 0.0 110.782 -179.762 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.2 156.18 27.4 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.404 ' O ' ' CG2' ' A' ' 39' ' ' VAL . 10.6 p -87.11 37.2 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.261 -1.141 . . . . 0.0 109.753 179.609 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.57 ' CZ ' ' CB ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.09 22.36 0.16 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.418 -0.801 . . . . 0.0 109.839 -179.483 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.2 p 29.74 91.5 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.609 -0.682 . . . . 0.0 111.645 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.57 ' CB ' ' CZ ' ' A' ' 40' ' ' ARG . 0.7 OUTLIER -144.92 -36.91 0.3 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.552 -0.717 . . . . 0.0 109.906 179.382 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.632 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 6.0 p80 -124.21 117.78 25.35 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.164 -0.96 . . . . 0.0 109.9 178.798 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.592 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 46.2 t80 -79.58 103.09 9.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.73 -0.606 . . . . 0.0 110.218 -179.365 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.575 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -65.85 -28.47 69.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.43 -0.794 . . . . 0.0 110.15 -179.763 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.592 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.6 mt . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.342 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.191 0.519 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.533 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.7 tt -122.95 155.52 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.34 -0.85 . . . . 0.0 110.167 -179.997 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.52 ' CB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -119.77 -167.8 1.49 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.128 -0.983 . . . . 0.0 110.32 -179.959 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.4 mttp -126.36 -179.89 4.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.214 -0.929 . . . . 0.0 110.468 -179.825 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 1.9 m -114.95 -161.25 0.77 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.288 -0.882 . . . . 0.0 110.18 179.972 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.7 t -132.29 -144.84 0.25 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.121 -0.987 . . . . 0.0 110.442 -179.826 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 79.4 p -79.61 2.74 21.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.308 -0.87 . . . . 0.0 110.392 -179.821 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -96.93 28.41 3.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 109.868 179.849 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.484 ' CG ' ' O ' ' A' ' 10' ' ' MET . 8.9 tmm? -116.75 5.4 13.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.395 -0.816 . . . . 0.0 110.323 -179.676 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -90.02 60.74 4.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.207 -0.933 . . . . 0.0 109.923 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -157.17 -36.06 0.02 OUTLIER Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.561 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 43.4 t80 -93.86 -54.99 3.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.149 -1.206 . . . . 0.0 110.698 -179.692 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 19.2 p -117.83 117.07 28.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.081 -1.012 . . . . 0.0 110.607 -179.641 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.572 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 17.5 mt -91.33 -50.28 5.9 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.391 -0.818 . . . . 0.0 110.449 179.725 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 6.8 m80 -98.45 79.03 2.46 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.498 -0.751 . . . . 0.0 110.342 -178.813 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.474 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.46 163.85 26.98 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -94.33 143.87 26.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.282 -1.128 . . . . 0.0 109.916 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 8.1 t -98.68 153.01 19.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.2 -0.938 . . . . 0.0 110.571 -179.747 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.574 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -159.88 -174.51 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.491 -0.755 . . . . 0.0 109.9 -179.932 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.52 ' HB3' ' CB ' ' A' ' 4' ' ' THR . 15.1 t80 -133.21 129.46 37.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.198 -0.938 . . . . 0.0 110.1 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.597 HD21 ' CD2' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -87.52 131.38 34.39 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.153 -0.967 . . . . 0.0 110.782 -179.714 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.9 p -90.7 -26.74 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.24 -0.913 . . . . 0.0 110.602 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -78.12 -14.52 59.45 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.111 -0.993 . . . . 0.0 108.927 179.264 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.537 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.3 mtt -148.19 67.32 1.09 Allowed 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.862 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.456 ' C ' ' O ' ' A' ' 25' ' ' MET . 64.1 p -29.87 87.83 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.59 0.71 . . . . 0.0 111.968 -178.446 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -158.18 165.43 34.93 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.583 -0.698 . . . . 0.0 109.843 179.497 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.43 113.48 14.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.485 -0.76 . . . . 0.0 110.441 -179.738 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.597 ' CD2' HD21 ' A' ' 22' ' ' LEU . 5.0 t80 -101.53 117.34 34.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.397 -0.815 . . . . 0.0 109.53 179.642 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.1 m -117.47 112.76 21.08 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.122 -0.986 . . . . 0.0 110.852 -179.181 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.474 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.4 tpp85 -86.97 110.17 19.86 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.309 -0.87 . . . . 0.0 109.629 179.267 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 84.9 m -79.53 -179.84 7.07 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.171 -0.956 . . . . 0.0 110.382 -179.602 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -82.72 115.85 21.83 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.28 -0.888 . . . . 0.0 110.291 -179.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.7 t -52.21 105.9 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.299 -0.876 . . . . 0.0 109.611 179.701 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 139.42 -4.7 2.84 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.782 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.605 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.27 163.92 24.54 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.019 -1.283 . . . . 0.0 109.567 179.756 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.582 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -97.71 27.22 4.51 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.832 -1.167 . . . . 0.0 110.077 -179.834 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.09 152.94 23.85 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 179.545 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.15 44.0 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.198 -1.178 . . . . 0.0 109.952 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.587 ' NH1' ' CG ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -160.14 20.29 0.16 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.307 -0.871 . . . . 0.0 110.531 -179.537 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.8 p 33.54 93.66 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.576 -0.702 . . . . 0.0 111.792 179.926 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.587 ' CG ' ' NH1' ' A' ' 40' ' ' ARG . 1.7 tm-20 -151.13 -40.32 0.12 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.531 -0.73 . . . . 0.0 109.655 179.127 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.582 ' CE1' HG23 ' A' ' 37' ' ' THR . 3.8 p80 -122.82 112.43 17.88 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.911 0.862 . . . . 0.0 108.714 178.622 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.593 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 20.4 t80 -78.54 108.7 12.11 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.674 0.75 . . . . 0.0 110.126 -178.441 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.536 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -66.15 -9.75 34.52 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.431 0.634 . . . . 0.0 109.982 -179.492 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.593 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.9 mt . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.203 -179.718 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.45 ' HB3' ' CG1' ' A' ' 23' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.3 0.572 . . . . 0.0 110.172 . . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.501 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.1 tt -138.8 154.69 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.277 -0.89 . . . . 0.0 110.146 -179.95 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.2 m -127.73 161.52 28.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 -179.991 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.03 178.79 7.71 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.272 -0.892 . . . . 0.0 110.31 -179.903 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 68.7 m -109.66 -147.53 0.42 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.253 -0.905 . . . . 0.0 110.075 179.936 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 t -133.99 -167.64 1.99 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.255 -0.903 . . . . 0.0 110.119 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.6 t -83.96 12.69 5.84 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.267 -0.896 . . . . 0.0 110.274 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -132.25 23.98 4.49 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.299 -0.876 . . . . 0.0 110.253 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -121.82 -5.27 9.11 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.246 -0.909 . . . . 0.0 110.213 -179.976 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -90.88 54.16 2.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.277 -0.89 . . . . 0.0 110.272 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -119.43 0.44 14.16 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -106.92 -64.92 1.13 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.197 -1.178 . . . . 0.0 110.26 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.2 p -84.53 124.54 31.51 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.209 -0.932 . . . . 0.0 110.351 -179.926 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.571 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.5 mt -90.07 -44.36 9.87 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.269 -0.895 . . . . 0.0 110.273 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.571 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 3.6 m80 -114.62 92.04 3.82 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.29 -0.881 . . . . 0.0 110.159 -179.719 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.448 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.53 -169.43 42.4 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.997 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -110.49 143.91 40.11 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.28 -1.129 . . . . 0.0 110.165 179.853 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.0 OUTLIER -95.92 128.69 43.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.316 -0.865 . . . . 0.0 110.419 -179.903 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.562 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -146.46 -171.82 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.305 -0.872 . . . . 0.0 110.008 179.878 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.448 ' O ' HG13 ' A' ' 3' ' ' ILE . 17.5 t80 -142.83 135.13 27.46 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.334 -0.854 . . . . 0.0 109.811 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.564 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.4 mm? -87.62 129.61 35.06 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.046 -1.034 . . . . 0.0 110.839 -179.589 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.45 ' CG1' ' HB3' ' A' ' 2' ' ' SER . 8.9 p -90.71 -24.98 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.247 -0.908 . . . . 0.0 110.454 179.746 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -78.31 -12.13 59.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.994 -1.066 . . . . 0.0 108.802 179.206 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.0 OUTLIER -151.78 68.83 0.9 Allowed 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 178.915 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 56.0 p -29.19 89.78 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.791 0.805 . . . . 0.0 111.412 -178.545 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.5 tt0 -159.88 148.13 17.16 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.621 -0.674 . . . . 0.0 109.562 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.52 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 15.9 p30 -61.46 126.46 27.43 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.253 -0.904 . . . . 0.0 110.42 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.564 ' CD2' HD23 ' A' ' 22' ' ' LEU . 9.8 t80 -118.85 133.82 55.58 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.35 -0.844 . . . . 0.0 109.705 179.696 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -135.95 113.92 11.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.096 -1.002 . . . . 0.0 110.594 -179.561 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.448 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.2 tpp180 -81.78 106.07 13.42 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.215 -0.928 . . . . 0.0 109.587 179.373 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.61 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 94.1 m -79.49 171.34 15.29 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.255 -0.903 . . . . 0.0 110.186 -179.763 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -78.91 129.45 34.53 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.222 -0.924 . . . . 0.0 109.662 179.873 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.8 t -66.12 -14.72 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.332 -0.855 . . . . 0.0 110.287 -179.542 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -69.17 -17.42 72.01 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.491 ' CE1' ' N ' ' A' ' 43' ' ' HIS . 1.5 m-85 -79.92 166.39 21.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.326 -1.102 . . . . 0.0 110.065 179.828 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.658 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 14.2 t -102.39 29.22 5.33 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.979 -1.076 . . . . 0.0 110.516 -179.788 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.42 160.28 31.63 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 179.778 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.8 p -84.7 43.73 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.121 -1.223 . . . . 0.0 109.897 179.649 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.567 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -148.99 12.18 0.85 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.381 -0.825 . . . . 0.0 110.279 -179.384 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.61 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 6.9 p 32.05 87.85 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.608 -0.683 . . . . 0.0 110.493 -179.67 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.567 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 2.1 tt0 -160.32 -33.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.214 -0.929 . . . . 0.0 111.023 -179.515 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.658 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 5.4 p80 -126.72 119.25 26.49 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.708 -1.245 . . . . 0.0 111.937 -179.677 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.546 ' CE2' ' C ' ' A' ' 46' ' ' LEU . 44.4 t80 -87.24 92.15 8.96 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.091 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.596 ' CE2' ' CD1' ' A' ' 46' ' ' LEU . 0.4 OUTLIER -66.85 -5.39 12.17 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.443 -0.786 . . . . 0.0 110.72 -179.012 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.596 ' CD1' ' CE2' ' A' ' 45' ' ' PHE . 2.2 mm? . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.072 -1.018 . . . . 0.0 110.192 -179.865 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.484 ' HA ' ' CB ' ' A' ' 23' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.192 0.52 . . . . 0.0 110.145 . . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 2.2 tt -79.56 148.6 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.266 -0.896 . . . . 0.0 110.341 179.975 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -160.98 -178.32 6.72 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.297 -0.877 . . . . 0.0 110.636 179.68 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -97.8 -178.71 4.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.465 -0.772 . . . . 0.0 110.27 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 49.0 m -98.13 -93.98 0.23 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.274 -0.891 . . . . 0.0 110.287 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.45 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 172.45 -167.2 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.097 -1.002 . . . . 0.0 110.122 -179.927 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.426 ' O ' ' N ' ' A' ' 10' ' ' MET . 6.6 t -80.1 169.63 17.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -0.904 . . . . 0.0 110.096 179.927 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 8' ' ' SER . 25.7 t70 43.13 26.25 0.08 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.146 -0.971 . . . . 0.0 110.214 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.426 ' N ' ' O ' ' A' ' 8' ' ' SER . 1.3 ttt -123.6 3.03 8.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.247 -0.908 . . . . 0.0 110.226 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.449 ' OD1' ' SG ' ' A' ' 14' ' ' CYS . 8.7 m-80 -101.97 70.42 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.896 . . . . 0.0 110.035 179.883 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.61 -24.29 14.08 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.871 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -86.7 -64.32 1.17 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.171 -1.194 . . . . 0.0 110.112 -179.989 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -81.34 119.45 23.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.287 -0.883 . . . . 0.0 110.382 -179.677 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.557 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 5.5 mt -90.62 -46.15 8.46 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.196 -0.94 . . . . 0.0 110.676 -179.882 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.598 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 12.3 m80 -111.72 78.63 1.14 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.168 -0.957 . . . . 0.0 110.353 -178.932 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.404 ' HA3' ' HA ' ' A' ' 32' ' ' CYS . . . 178.72 -160.9 26.99 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.963 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -127.56 138.7 52.96 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.401 -1.058 . . . . 0.0 110.221 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -81.5 134.88 35.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.246 -0.909 . . . . 0.0 110.199 179.969 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.52 ' CD1' ' O ' ' A' ' 19' ' ' CYS . 24.3 mm -142.59 172.81 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.262 -0.899 . . . . 0.0 110.262 -179.908 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.477 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 8.8 t80 -137.03 138.25 40.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.242 -0.911 . . . . 0.0 109.58 179.866 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.578 HD23 ' CD2' ' A' ' 29' ' ' TYR . 3.3 mm? -100.51 136.42 40.42 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.973 -1.079 . . . . 0.0 111.28 -179.26 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.513 HG13 ' N ' ' A' ' 24' ' ' ASP . 10.7 p -90.72 -27.18 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.509 -0.744 . . . . 0.0 110.497 179.847 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.513 ' N ' HG13 ' A' ' 23' ' ' VAL . 4.5 m-20 -78.24 -17.21 56.99 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.122 -0.986 . . . . 0.0 108.886 179.426 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.532 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.9 mtm -143.38 64.86 1.33 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.726 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.465 ' C ' ' O ' ' A' ' 25' ' ' MET . 66.1 p -29.12 88.4 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.699 0.761 . . . . 0.0 111.733 -178.32 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.532 ' N ' ' O ' ' A' ' 25' ' ' MET . 4.4 pt20 -160.39 177.79 10.24 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.659 -0.651 . . . . 0.0 109.444 179.557 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -81.1 156.08 25.96 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.233 -0.917 . . . . 0.0 110.235 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.578 ' CD2' HD23 ' A' ' 22' ' ' LEU . 2.8 t80 -150.22 95.34 2.26 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.307 -0.871 . . . . 0.0 110.132 -179.959 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 4.0 m -102.36 106.9 17.75 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.195 -0.941 . . . . 0.0 110.105 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.404 ' C ' ' HD3' ' A' ' 31' ' ' ARG . 15.3 tpp85 -79.52 97.93 6.64 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.177 -0.952 . . . . 0.0 109.504 179.602 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 77.9 m -79.73 175.91 10.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.445 -0.785 . . . . 0.0 110.525 -179.39 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -79.85 124.76 28.93 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.395 -0.815 . . . . 0.0 109.618 179.864 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.1 t -65.16 -9.0 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.388 -0.82 . . . . 0.0 110.335 -179.423 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -78.48 -3.22 86.13 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 179.863 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.598 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.9 OUTLIER -79.9 168.22 19.53 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.036 -1.273 . . . . 0.0 109.684 179.75 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.596 HG21 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -108.22 32.09 5.06 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.929 -1.107 . . . . 0.0 110.784 -179.595 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -147.93 171.38 28.45 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.269 -1.532 . . . . 0.0 109.269 179.437 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.0 p -86.18 21.13 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.17 -1.194 . . . . 0.0 109.946 179.828 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.523 ' O ' ' CB ' ' A' ' 41' ' ' CYS . 41.0 ttp180 -137.48 -95.62 0.21 Allowed 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.285 -0.885 . . . . 0.0 110.03 -179.674 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.9 p 163.62 73.04 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.78 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.522 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 2.0 tt0 -133.71 -28.93 1.37 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.418 -0.801 . . . . 0.0 110.673 -179.48 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.596 ' CE1' HG21 ' A' ' 37' ' ' THR . 3.5 p80 -128.34 113.46 15.64 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.907 -1.121 . . . . 0.0 109.922 179.236 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.599 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 37.2 t80 -79.41 106.43 11.44 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.463 0.649 . . . . 0.0 110.041 -179.253 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.583 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.86 -29.46 70.41 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.286 -0.884 . . . . 0.0 109.936 -179.679 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.599 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.244 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.462 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.298 0.57 . . . . 0.0 110.114 . . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.532 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 2.8 tt -144.74 156.1 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.211 -0.931 . . . . 0.0 110.308 -179.816 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.26 157.16 25.36 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.902 . . . . 0.0 110.244 179.919 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -96.19 165.46 12.21 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.231 -0.918 . . . . 0.0 110.219 -179.987 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 84.3 m -109.26 -152.86 0.5 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 110.342 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.94 -170.45 2.24 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.268 -0.895 . . . . 0.0 110.294 -179.916 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 m -85.24 11.55 9.8 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.904 . . . . 0.0 110.097 179.864 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.36 16.23 11.37 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.9 . . . . 0.0 110.114 -179.903 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.67 20.86 9.36 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.254 -0.904 . . . . 0.0 110.286 -179.87 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.09 72.47 1.09 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.171 -0.956 . . . . 0.0 110.236 -179.988 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -120.51 2.04 12.45 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.454 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 24.7 t80 -119.65 -57.4 1.98 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.184 -1.186 . . . . 0.0 110.246 179.964 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.4 p -90.33 121.65 32.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.237 -0.914 . . . . 0.0 110.366 -179.951 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.523 ' N ' HD22 ' A' ' 15' ' ' LEU . 3.9 mt -90.72 -56.98 2.98 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.152 -0.968 . . . . 0.0 110.714 -179.853 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.593 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 13.2 m80 -100.21 83.74 2.72 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.259 -0.901 . . . . 0.0 110.395 -178.885 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.492 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 176.53 -160.4 27.9 Favored Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.846 -1.301 . . . . 0.0 109.846 -179.8 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.417 ' OE1' ' HA ' ' A' ' 18' ' ' GLN . 2.2 mm100 -124.7 147.43 48.6 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.356 -1.085 . . . . 0.0 110.192 -179.968 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.7 t -93.73 130.12 39.81 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.382 -0.824 . . . . 0.0 110.318 -179.961 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.593 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -142.66 -176.95 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.42 -0.8 . . . . 0.0 109.978 179.867 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.466 ' O ' HG13 ' A' ' 3' ' ' ILE . 9.7 t80 -143.47 124.81 14.66 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.152 -0.968 . . . . 0.0 109.957 -179.92 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.429 HD13 HD12 ' A' ' 3' ' ' ILE . 1.9 mp -79.49 128.36 33.26 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.003 -1.061 . . . . 0.0 111.317 -179.269 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.462 HG11 ' HB3' ' A' ' 2' ' ' SER . 5.5 p -90.38 -26.16 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.688 -0.633 . . . . 0.0 110.417 179.788 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -78.17 -11.89 59.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.099 -1.001 . . . . 0.0 108.659 178.951 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 10.0 ttm -150.55 68.24 0.96 Allowed 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.929 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 13.7 p -29.19 89.86 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 121.745 0.783 . . . . 0.0 111.344 -178.471 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.1 147.65 18.14 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.738 -0.602 . . . . 0.0 109.725 -179.965 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.518 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.0 m-20 -64.87 124.49 22.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.442 -0.786 . . . . 0.0 110.133 -179.953 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.473 ' O ' HG12 ' A' ' 20' ' ' ILE . 4.8 t80 -116.54 132.43 56.68 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.413 -0.805 . . . . 0.0 109.931 -179.866 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -129.64 112.63 13.87 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.092 -1.005 . . . . 0.0 110.374 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.492 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.7 OUTLIER -86.0 115.04 23.36 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.255 -0.903 . . . . 0.0 109.451 179.389 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 91.9 m -78.89 179.41 7.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.15 -0.969 . . . . 0.0 110.61 -179.408 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.463 ' OE2' ' CE1' ' A' ' 44' ' ' PHE . 22.3 tt0 -83.89 116.51 22.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.392 -0.818 . . . . 0.0 110.404 -179.543 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.1 t -52.43 101.67 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.192 -0.943 . . . . 0.0 109.555 179.523 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.472 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 147.9 -10.61 1.22 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.61 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.593 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.4 m-85 -78.78 160.21 27.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.897 -1.354 . . . . 0.0 109.465 179.769 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.6 HG23 ' CE1' ' A' ' 43' ' ' HIS . 1.0 OUTLIER -105.72 -4.62 20.74 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.841 -1.162 . . . . 0.0 111.125 -179.084 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.505 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -98.34 140.89 15.28 Favored Glycine 0 N--CA 1.488 2.11 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.778 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.425 ' C ' ' O ' ' A' ' 38' ' ' GLY . 8.5 p -44.85 -25.73 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.133 -1.216 . . . . 0.0 108.807 179.072 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.533 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 7.4 ttp180 -102.15 -130.67 0.25 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.218 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -151.72 75.64 1.16 Allowed 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 179.011 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.533 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 0.9 OUTLIER -123.82 -29.9 3.62 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.394 -0.816 . . . . 0.0 110.336 -179.264 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.6 ' CE1' HG23 ' A' ' 37' ' ' THR . 3.0 p80 -130.45 117.09 19.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.961 -1.087 . . . . 0.0 110.05 179.443 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.594 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 44.6 t80 -79.28 104.38 9.86 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 121.494 0.664 . . . . 0.0 110.002 -179.351 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.576 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.67 -32.87 74.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.466 -0.771 . . . . 0.0 110.172 -179.515 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.594 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.9 mt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.248 179.963 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.491 ' N ' HG12 ' A' ' 23' ' ' VAL . 16.5 t . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 121.32 0.581 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.539 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.81 149.58 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.328 -0.858 . . . . 0.0 110.124 179.964 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -119.0 161.3 20.45 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 110.241 -179.949 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -110.38 165.9 11.41 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.333 -0.854 . . . . 0.0 110.206 179.957 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 72.5 m -112.96 -155.59 0.57 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.229 -0.919 . . . . 0.0 110.206 -179.991 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 m -135.61 -164.13 1.49 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.256 -0.903 . . . . 0.0 110.318 179.961 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.53 10.3 13.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 0.0 110.216 -179.983 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -123.13 19.23 9.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 0.0 110.181 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.79 23.06 2.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.893 . . . . 0.0 110.175 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.407 ' OD1' ' SG ' ' A' ' 14' ' ' CYS . 0.9 OUTLIER -106.25 68.3 0.76 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.221 -0.924 . . . . 0.0 110.206 -179.978 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -109.22 43.65 1.67 Allowed Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 179.948 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -156.93 -58.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.297 -1.119 . . . . 0.0 110.204 -179.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.6 p -91.15 118.87 30.79 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.265 -0.897 . . . . 0.0 110.295 -179.912 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.567 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.8 mt -90.43 -43.13 10.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.117 -0.99 . . . . 0.0 110.325 179.8 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.583 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 7.9 m80 -111.65 78.02 1.09 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.251 -0.905 . . . . 0.0 110.163 -179.486 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.41 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 176.07 -171.02 44.06 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -114.44 146.41 40.67 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.2 -1.176 . . . . 0.0 110.326 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.4 t -84.47 147.47 27.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.322 -0.861 . . . . 0.0 110.037 179.805 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.539 ' CG2' HG12 ' A' ' 3' ' ' ILE . 0.7 OUTLIER -155.35 -177.59 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.147 -0.971 . . . . 0.0 110.107 -179.805 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.473 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 14.8 t80 -142.36 132.66 24.88 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.282 -0.886 . . . . 0.0 109.98 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.593 HD21 ' CD2' ' A' ' 29' ' ' TYR . 1.5 mm? -94.47 134.5 36.94 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.126 -0.984 . . . . 0.0 111.016 -179.339 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.525 HG11 ' N ' ' A' ' 24' ' ' ASP . 10.7 p -90.92 -24.94 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.297 -0.877 . . . . 0.0 110.524 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.525 ' N ' HG11 ' A' ' 23' ' ' VAL . 3.3 p30 -78.56 -15.68 58.29 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.044 -1.035 . . . . 0.0 108.956 179.314 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.544 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.5 ttp -146.01 66.48 1.2 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 178.899 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.91 88.56 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 122.001 0.905 . . . . 0.0 111.877 -178.223 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 tt0 -160.86 173.79 14.82 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 121.318 0.58 . . . . 0.0 109.935 179.401 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -77.19 140.99 40.3 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.462 -0.774 . . . . 0.0 110.23 -179.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.593 ' CD2' HD21 ' A' ' 22' ' ' LEU . 9.8 t80 -135.64 113.94 11.51 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.356 -0.84 . . . . 0.0 110.031 179.894 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 15.4 m -117.85 116.97 28.03 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.045 -1.034 . . . . 0.0 110.41 -179.809 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.41 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.2 tpp85 -79.49 118.34 21.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.155 -0.966 . . . . 0.0 109.447 179.431 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 95.7 m -79.52 170.76 16.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.392 -0.818 . . . . 0.0 110.573 -179.329 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -79.48 117.14 20.16 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.358 -0.839 . . . . 0.0 109.968 179.974 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 36.4 t -50.13 103.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.296 -0.877 . . . . 0.0 109.686 179.966 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.74 -12.75 1.32 Allowed Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.67 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.32 172.14 14.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.203 -1.175 . . . . 0.0 109.648 179.85 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.593 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.72 29.78 6.91 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.906 -1.121 . . . . 0.0 110.524 179.974 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.55 160.08 31.5 Favored Glycine 0 N--CA 1.489 2.186 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.547 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 11.7 p -88.88 27.09 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.177 -1.19 . . . . 0.0 109.536 179.321 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.559 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -132.95 14.31 4.29 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.48 -0.762 . . . . 0.0 109.738 -179.667 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.9 p 32.62 87.63 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 121.467 0.651 . . . . 0.0 110.601 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.559 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 1.1 tp10 -156.09 -34.81 0.09 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.405 -0.809 . . . . 0.0 110.644 -179.61 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.593 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.4 p80 -120.46 119.21 32.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.882 -1.136 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.607 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 17.3 t80 -84.21 111.74 19.64 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-O 121.247 0.546 . . . . 0.0 109.859 -179.728 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.568 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -68.43 -23.71 64.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.285 -0.884 . . . . 0.0 109.655 -179.78 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.607 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.8 mt . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.269 -179.819 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.455 ' HB2' HG11 ' A' ' 23' ' ' VAL . 2.6 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.353 0.597 . . . . 0.0 110.403 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.53 ' CD1' ' HB ' ' A' ' 20' ' ' ILE . 1.7 tt -129.51 157.37 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.294 -0.879 . . . . 0.0 109.991 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.479 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -121.57 168.06 12.17 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.212 -0.93 . . . . 0.0 110.262 -179.913 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.29 159.51 14.9 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.206 -0.934 . . . . 0.0 110.234 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 65.1 m -104.59 -147.99 0.4 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.242 -0.911 . . . . 0.0 110.147 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -127.48 -171.4 2.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.247 -0.908 . . . . 0.0 110.212 -179.934 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.8 t -79.81 -55.42 5.0 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.253 -0.904 . . . . 0.0 110.167 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -63.07 -11.3 18.67 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.242 -0.911 . . . . 0.0 110.149 179.906 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.7 ttm -88.14 27.37 1.22 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.253 -0.905 . . . . 0.0 110.225 -179.986 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -121.85 69.89 0.94 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.219 -0.926 . . . . 0.0 110.232 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -119.7 3.29 13.44 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -108.77 -50.53 3.0 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.159 -1.201 . . . . 0.0 110.182 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 22.3 p -104.07 120.09 40.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.216 -0.928 . . . . 0.0 110.271 179.932 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.565 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 10.1 mt -90.17 -43.22 10.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.298 -0.876 . . . . 0.0 110.519 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.565 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.6 m80 -110.53 86.88 2.4 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.134 -0.979 . . . . 0.0 110.258 -179.503 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.448 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.68 -131.39 2.11 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.968 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -160.35 149.71 17.47 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.233 -1.157 . . . . 0.0 110.236 179.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.2 t -94.54 147.54 23.17 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.195 -0.941 . . . . 0.0 110.194 179.948 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.637 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 19.0 pt -157.7 167.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.302 -0.874 . . . . 0.0 110.063 179.96 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.479 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 12.4 t80 -120.36 118.84 31.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.205 -0.934 . . . . 0.0 110.065 -179.983 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.59 HD13 ' CD2' ' A' ' 29' ' ' TYR . 11.3 mt -83.45 135.89 34.51 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.242 -0.912 . . . . 0.0 110.766 -179.751 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.524 HG12 ' N ' ' A' ' 24' ' ' ASP . 7.2 p -88.32 -29.0 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.398 -0.814 . . . . 0.0 110.078 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.524 ' N ' HG12 ' A' ' 23' ' ' VAL . 2.6 p30 -78.41 -22.8 47.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.208 -0.933 . . . . 0.0 108.716 179.191 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.1 mmt -134.23 61.14 1.68 Allowed 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 178.526 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.466 ' C ' ' O ' ' A' ' 25' ' ' MET . 3.2 p -28.74 86.2 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 121.576 0.703 . . . . 0.0 111.883 -178.46 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 pt20 -161.21 167.56 25.83 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.576 -0.702 . . . . 0.0 109.556 179.526 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' ' OD1' ' A' ' 28' ' ' ASN . 7.0 p30 -82.51 90.58 6.77 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.327 -0.858 . . . . 0.0 109.787 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.637 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 5.4 t80 -79.7 131.92 36.07 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.405 -0.809 . . . . 0.0 110.283 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -120.58 113.21 19.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.169 -0.957 . . . . 0.0 110.368 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.503 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . 3.0 tpm_? -81.73 116.95 21.67 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.193 -0.942 . . . . 0.0 109.461 179.452 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 66.9 m -79.06 173.63 12.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.279 -0.888 . . . . 0.0 110.136 -179.793 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -79.42 111.65 15.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.284 -0.885 . . . . 0.0 109.909 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.3 t -49.15 103.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.446 -0.784 . . . . 0.0 109.727 -179.959 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 141.71 -7.28 2.46 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -179.741 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.558 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.25 179.97 7.09 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.175 -1.191 . . . . 0.0 109.796 179.853 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -116.5 23.91 11.71 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.915 -1.116 . . . . 0.0 110.731 -179.629 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -149.65 157.78 27.38 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.545 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.6 p -85.78 40.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.248 -1.149 . . . . 0.0 109.797 179.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.56 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.03 21.07 0.16 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.452 -0.78 . . . . 0.0 109.973 -179.522 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 8.8 p 32.32 84.85 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.665 -0.647 . . . . 0.0 110.745 -179.702 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.56 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 23.8 tt0 -146.01 -41.53 0.21 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.405 -0.809 . . . . 0.0 109.967 -179.878 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.8 p-80 -119.43 128.69 54.26 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.11 -0.994 . . . . 0.0 110.372 179.598 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.6 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 34.4 t80 -86.68 130.32 34.53 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 121.383 0.611 . . . . 0.0 110.434 -178.504 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.544 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -91.64 -37.29 13.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 109.849 -179.878 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.6 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.3 mt . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.201 -179.663 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.273 0.559 . . . . 0.0 110.336 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.51 ' CD1' ' HB ' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -128.19 150.25 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.259 -0.901 . . . . 0.0 110.086 179.841 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.48 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -118.77 -163.61 0.97 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.206 -0.934 . . . . 0.0 110.173 179.93 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -130.74 154.4 48.0 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.13 -0.981 . . . . 0.0 110.352 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 94.6 m -83.81 -165.35 1.1 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.408 -0.807 . . . . 0.0 110.239 179.926 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.48 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.4 OUTLIER -125.69 -158.41 0.84 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.301 -0.874 . . . . 0.0 110.114 179.812 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.48 ' N ' ' OG ' ' A' ' 7' ' ' SER . 2.8 m -79.93 168.97 18.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.154 -0.967 . . . . 0.0 110.126 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 50.48 20.94 0.76 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.206 -0.934 . . . . 0.0 110.235 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tpp -122.85 -15.52 7.38 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.201 -0.937 . . . . 0.0 110.181 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -89.16 52.48 2.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.315 -0.866 . . . . 0.0 110.354 -179.941 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -109.63 1.94 30.63 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.437 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 45.9 t80 -93.4 -57.3 2.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.203 -1.175 . . . . 0.0 110.128 179.999 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.3 p -97.54 119.74 36.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.271 -0.893 . . . . 0.0 110.111 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.545 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.3 mt -90.24 -45.18 9.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.221 -0.924 . . . . 0.0 110.303 -179.999 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.568 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 6.5 m80 -108.59 85.71 2.16 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.297 -0.877 . . . . 0.0 110.224 -179.591 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.466 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 169.82 -174.75 44.05 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.03 145.76 30.97 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.268 -1.136 . . . . 0.0 110.311 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 5.6 t -96.08 130.07 43.19 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.365 -0.834 . . . . 0.0 110.385 -179.932 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.579 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.7 177.53 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.372 -0.83 . . . . 0.0 110.102 179.994 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.48 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 13.8 t80 -128.0 135.14 49.49 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.289 -0.882 . . . . 0.0 109.703 179.707 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.608 HD21 ' CD2' ' A' ' 29' ' ' TYR . 1.2 mm? -92.86 132.86 36.64 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.979 -1.076 . . . . 0.0 111.149 -179.309 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.463 HG13 ' N ' ' A' ' 24' ' ' ASP . 9.1 p -90.87 -31.7 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.461 -0.775 . . . . 0.0 110.586 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.463 ' N ' HG13 ' A' ' 23' ' ' VAL . 48.1 t0 -78.06 -19.67 53.82 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.124 -0.985 . . . . 0.0 108.78 179.403 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 27' ' ' GLN . 35.8 mtt -137.19 61.56 1.62 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.608 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 89.5 p -29.21 87.79 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 121.614 0.721 . . . . 0.0 111.584 -178.499 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.557 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.4 pt20 -160.73 171.46 18.81 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.66 -0.65 . . . . 0.0 109.648 179.689 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -79.72 115.86 19.56 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.447 -0.783 . . . . 0.0 110.292 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.608 ' CD2' HD21 ' A' ' 22' ' ' LEU . 5.7 t80 -105.67 141.47 37.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.349 -0.844 . . . . 0.0 109.717 179.804 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 14.3 m -141.58 112.05 7.02 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.017 -1.052 . . . . 0.0 110.694 -179.562 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.466 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.5 OUTLIER -81.04 112.84 18.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.207 -0.933 . . . . 0.0 109.427 179.291 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 95.8 m -79.36 172.4 13.85 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.307 -0.871 . . . . 0.0 110.519 -179.507 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -79.39 114.03 18.0 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.441 -0.787 . . . . 0.0 109.965 -179.849 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.1 t -46.08 102.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.27 -0.894 . . . . 0.0 109.709 179.961 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.36 -13.1 1.4 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -179.666 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.568 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -79.28 176.03 10.05 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.162 -1.199 . . . . 0.0 109.852 179.892 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.604 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -117.29 26.33 9.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.906 -1.121 . . . . 0.0 110.784 -179.78 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -147.66 160.5 28.32 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.819 -1.313 . . . . 0.0 109.819 179.607 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.508 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 69.9 t -86.8 19.14 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.325 -1.103 . . . . 0.0 109.818 179.59 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.543 ' CD ' ' O ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -140.23 21.72 2.41 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.522 -0.736 . . . . 0.0 109.672 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 5.9 p 32.31 93.04 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 CA-C-O 121.493 0.663 . . . . 0.0 111.118 179.711 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.527 ' HB3' ' NH2' ' A' ' 40' ' ' ARG . 30.1 tt0 -156.61 -38.04 0.08 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.358 -0.839 . . . . 0.0 110.232 179.714 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.604 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.2 p-80 -117.36 129.59 55.96 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.029 -1.044 . . . . 0.0 110.611 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.606 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.5 t80 -88.13 130.28 35.08 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.433 0.635 . . . . 0.0 110.376 -178.737 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.582 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -94.39 -33.45 13.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.454 -0.779 . . . . 0.0 110.277 -179.65 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.606 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.2 mt . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.291 -179.745 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.438 ' HB3' HG13 ' A' ' 23' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.286 0.565 . . . . 0.0 110.227 . . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.539 HG12 ' CG2' ' A' ' 20' ' ' ILE . 9.5 tt -83.37 166.48 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.315 -0.866 . . . . 0.0 110.185 -179.987 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.48 ' O ' HG21 ' A' ' 20' ' ' ILE . 4.2 m -137.98 165.47 26.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.197 -0.939 . . . . 0.0 110.547 -179.631 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -91.83 154.39 18.93 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.241 -0.912 . . . . 0.0 110.223 179.892 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.7 m -91.71 -141.15 0.18 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.32 -0.863 . . . . 0.0 110.259 -179.984 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.519 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.5 OUTLIER -159.47 -155.2 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.286 -0.884 . . . . 0.0 109.962 -179.931 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.519 ' N ' ' OG ' ' A' ' 7' ' ' SER . 0.1 OUTLIER -79.67 166.47 21.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.063 -1.023 . . . . 0.0 109.871 179.936 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 50.84 20.86 0.83 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.083 -1.01 . . . . 0.0 110.19 -179.822 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.99 14.23 5.76 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.175 -0.953 . . . . 0.0 110.202 -179.866 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.4 ' OD1' ' N ' ' A' ' 11' ' ' ASN . 10.3 m-20 -118.35 -141.11 0.36 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.236 -0.915 . . . . 0.0 110.389 -179.878 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.14 49.57 3.03 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.286 -1.526 . . . . 0.0 109.286 -179.817 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.488 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 8.6 t80 -155.0 -70.27 0.12 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.314 -1.109 . . . . 0.0 109.938 -179.819 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -87.87 125.99 34.78 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.072 -1.017 . . . . 0.0 110.33 179.74 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.524 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 3.9 mt -90.19 -49.04 6.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.19 -0.943 . . . . 0.0 110.142 179.765 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.524 ' ND1' ' HB2' ' A' ' 15' ' ' LEU . 10.4 m80 -104.83 77.21 1.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.219 -0.926 . . . . 0.0 110.112 -179.838 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.48 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -176.98 -178.97 47.14 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.868 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.53 140.46 41.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.255 -1.144 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 8.4 t -79.76 147.66 31.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.197 -0.939 . . . . 0.0 109.828 179.854 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.539 ' CG2' HG12 ' A' ' 3' ' ' ILE . 0.3 OUTLIER -154.22 -170.0 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.152 -0.968 . . . . 0.0 110.001 -179.693 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.475 ' O ' HG13 ' A' ' 3' ' ' ILE . 8.6 t80 -147.88 128.39 14.07 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.077 -1.014 . . . . 0.0 109.857 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.584 HD21 ' CD2' ' A' ' 29' ' ' TYR . 0.8 OUTLIER -84.19 131.78 34.73 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.196 -0.94 . . . . 0.0 111.103 -179.31 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.438 HG13 ' HB3' ' A' ' 2' ' ' SER . 8.6 p -90.54 -28.31 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.343 -0.848 . . . . 0.0 110.587 179.732 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.52 ' OD2' ' CD1' ' A' ' 22' ' ' LEU . 1.9 p30 -78.43 -15.25 58.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.019 -1.05 . . . . 0.0 108.789 179.229 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -144.45 65.55 1.28 Allowed 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 178.733 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.487 ' C ' ' O ' ' A' ' 25' ' ' MET . 40.3 p -29.15 89.38 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.702 0.763 . . . . 0.0 111.542 -178.355 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 pt20 -157.81 168.89 25.9 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.737 -0.602 . . . . 0.0 109.419 179.51 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -77.22 124.96 28.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.283 -0.886 . . . . 0.0 110.594 -179.615 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.584 ' CD2' HD21 ' A' ' 22' ' ' LEU . 35.5 t80 -110.83 158.39 18.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.402 -0.811 . . . . 0.0 109.77 179.73 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.9 m -158.1 108.38 2.13 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.058 -1.026 . . . . 0.0 110.503 -179.95 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.48 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.8 tpp180 -81.29 115.04 20.48 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.88 . . . . 0.0 109.666 179.681 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 97.5 m -79.4 175.06 10.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.167 -0.958 . . . . 0.0 110.521 -179.56 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -79.46 117.94 20.88 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.367 -0.833 . . . . 0.0 110.383 -179.792 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -49.94 99.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.283 -0.886 . . . . 0.0 109.914 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 152.35 -16.84 0.77 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.847 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.472 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.0 OUTLIER -79.55 172.92 13.14 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.147 -1.207 . . . . 0.0 110.023 179.947 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.598 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -113.29 31.47 6.44 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.017 -1.052 . . . . 0.0 110.518 -179.636 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.32 162.9 33.62 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.448 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.468 ' O ' ' OH ' ' A' ' 13' ' ' TYR . 2.4 m -84.34 14.73 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.345 -1.091 . . . . 0.0 109.733 179.546 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.56 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -128.26 18.18 6.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.386 -0.821 . . . . 0.0 109.852 -179.444 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.6 p 27.33 91.06 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 CA-C-O 121.402 0.62 . . . . 0.0 111.369 179.493 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.554 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 10.8 tm-20 -156.6 -37.79 0.08 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.398 -0.814 . . . . 0.0 110.284 179.752 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.598 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 3.1 p-80 -114.86 128.44 56.29 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.008 -1.058 . . . . 0.0 110.523 179.887 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.625 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 15.7 t80 -86.63 126.33 34.44 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.459 0.647 . . . . 0.0 109.842 -179.009 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.584 ' O ' ' CG ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -85.27 12.47 8.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.447 -0.783 . . . . 0.0 109.955 -179.329 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.625 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.5 mt . . . . . 0 C--N 1.302 -1.479 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.395 -179.748 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.531 ' CB ' HG13 ' A' ' 23' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.301 0.572 . . . . 0.0 109.959 . . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.538 ' CD1' HG21 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -153.68 164.94 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.238 -0.914 . . . . 0.0 110.267 -179.802 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.448 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 3.7 m -148.52 167.16 26.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 0.0 110.219 179.984 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.41 168.99 9.04 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 110.027 179.908 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 57.0 m -86.49 -166.3 1.51 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.177 -0.952 . . . . 0.0 110.169 -179.937 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.84 -64.85 0.69 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.313 -0.867 . . . . 0.0 110.314 -179.963 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.44 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 0.5 OUTLIER -153.69 -71.17 0.14 Allowed 'General case' 0 C--N 1.291 -1.946 0 O-C-N 121.78 -0.575 . . . . 0.0 110.377 -179.961 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -62.72 -11.18 15.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.205 -0.934 . . . . 0.0 110.218 -179.972 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.438 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -104.27 39.5 1.64 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.258 -0.901 . . . . 0.0 110.159 179.898 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.44 ' OD1' ' O ' ' A' ' 8' ' ' SER . 41.4 p-10 -137.74 21.44 2.88 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.284 -0.885 . . . . 0.0 110.337 -179.885 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -100.18 75.14 0.44 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.971 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -160.28 -58.43 0.06 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.264 -1.139 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -97.25 118.2 33.15 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.342 -0.849 . . . . 0.0 110.605 -179.718 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.58 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.7 mt -75.77 -40.69 54.84 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 109.887 179.706 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.583 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 6.4 m80 -119.85 89.36 3.11 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.414 -0.804 . . . . 0.0 110.584 -179.096 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.45 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 171.08 -177.81 43.83 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 179.791 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -108.06 153.46 23.09 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.294 -1.121 . . . . 0.0 110.306 179.86 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -92.05 133.66 35.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.377 -0.827 . . . . 0.0 110.539 -179.809 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.538 HG21 ' CD1' ' A' ' 3' ' ' ILE . 9.4 mm -142.71 178.67 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.35 -0.844 . . . . 0.0 109.883 179.968 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.448 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 20.6 t80 -147.68 129.45 15.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.986 -1.071 . . . . 0.0 110.252 179.952 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.613 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 2.9 mm? -88.65 131.78 34.84 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.267 -0.896 . . . . 0.0 110.749 -179.662 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.531 HG13 ' CB ' ' A' ' 2' ' ' SER . 8.4 p -90.57 -23.19 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.341 -0.849 . . . . 0.0 110.612 179.88 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.529 ' N ' HG12 ' A' ' 23' ' ' VAL . 9.6 t70 -78.59 -12.43 60.02 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.003 -1.061 . . . . 0.0 108.806 179.28 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -151.01 68.9 0.95 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.957 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.489 ' C ' ' O ' ' A' ' 25' ' ' MET . 40.1 p -29.02 89.52 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.791 0.805 . . . . 0.0 111.308 -178.419 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.55 148.09 17.69 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.726 -0.609 . . . . 0.0 109.367 -179.883 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.52 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.2 m-80 -60.68 146.21 46.46 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.197 -0.94 . . . . 0.0 110.399 -179.635 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.613 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 3.5 t80 -142.73 102.85 4.12 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.441 -0.787 . . . . 0.0 109.991 179.984 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.9 m -108.62 119.03 38.33 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.108 -0.995 . . . . 0.0 110.278 -179.951 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.45 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -78.98 137.33 37.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.107 -0.996 . . . . 0.0 109.216 179.476 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.621 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.8 m -79.54 169.3 18.23 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.281 -0.887 . . . . 0.0 110.025 -179.528 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.529 ' O ' ' N ' ' A' ' 35' ' ' GLY . 9.6 tt0 -78.59 112.26 15.49 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.309 -0.869 . . . . 0.0 108.709 179.21 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.465 ' C ' ' O ' ' A' ' 33' ' ' GLU . 38.3 t -36.12 93.17 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 121.479 0.657 . . . . 0.0 110.475 -179.071 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 149.72 -15.77 1.07 Allowed Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.649 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.4 m-85 -81.12 169.24 17.66 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.137 -1.213 . . . . 0.0 109.922 179.939 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.622 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 5.2 t -122.55 45.55 2.35 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.968 -1.082 . . . . 0.0 111.171 -179.77 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.53 156.08 27.32 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.963 -1.255 . . . . 0.0 109.963 179.568 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.466 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 79.2 t -89.07 21.27 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.327 -1.102 . . . . 0.0 109.487 179.288 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.551 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 6.5 ttp180 -122.78 -19.23 6.28 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.568 -0.708 . . . . 0.0 109.978 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.621 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.7 m 69.51 70.26 0.25 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.172 -0.955 . . . . 0.0 110.234 179.281 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.551 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -141.03 -29.25 0.66 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.19 -0.944 . . . . 0.0 111.255 -179.838 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.622 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 6.0 p80 -125.63 120.46 30.84 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.623 -1.298 . . . . 0.0 111.214 179.963 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.591 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 51.6 t80 -82.57 103.14 11.88 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.295 0.569 . . . . 0.0 109.678 179.773 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.572 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.59 -30.34 71.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.239 -0.913 . . . . 0.0 110.237 -179.29 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.591 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.2 mt . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.13 -0.981 . . . . 0.0 110.147 -179.986 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.456 ' HB3' HG13 ' A' ' 23' ' ' VAL . 6.3 t . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.328 0.585 . . . . 0.0 110.205 . . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.464 ' O ' HG21 ' A' ' 3' ' ' ILE . 0.9 OUTLIER -80.63 141.18 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.29 -0.881 . . . . 0.0 110.216 -179.933 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.402 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -101.33 158.53 15.98 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.306 -179.97 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -108.17 151.49 25.85 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.302 -0.874 . . . . 0.0 110.019 179.864 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 61.3 m -97.81 -159.86 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.269 -0.895 . . . . 0.0 110.365 -179.94 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.7 t -145.12 -146.47 0.19 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.204 -0.935 . . . . 0.0 110.198 179.996 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.435 ' O ' ' N ' ' A' ' 10' ' ' MET . 23.7 t -79.87 168.02 19.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.224 -0.922 . . . . 0.0 110.134 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' A' ' 8' ' ' SER . 20.0 t0 42.08 26.93 0.06 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.262 -0.899 . . . . 0.0 110.288 179.954 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.435 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -125.78 -0.86 7.33 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.261 -0.9 . . . . 0.0 110.321 -179.892 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.422 ' O ' ' CG ' ' A' ' 11' ' ' ASN . 24.4 p-10 -140.03 105.53 5.09 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.169 -0.957 . . . . 0.0 110.194 -179.976 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.45 20.79 6.9 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.902 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.44 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 71.0 t80 -110.62 -55.57 2.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.189 -1.183 . . . . 0.0 110.273 -179.899 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.2 p -93.52 123.27 36.72 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.274 -0.891 . . . . 0.0 110.268 -179.818 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.541 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -90.18 -43.65 10.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.111 -0.993 . . . . 0.0 110.416 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.562 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 9.2 m80 -107.87 85.89 2.2 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.265 -0.897 . . . . 0.0 110.233 -179.513 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.462 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.93 -165.1 36.1 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.983 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -121.28 134.79 55.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.38 -1.07 . . . . 0.0 110.31 -179.955 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 10.7 t -84.47 141.76 30.55 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 110.125 179.903 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.545 HD13 ' CD1' ' A' ' 29' ' ' TYR . 9.5 pt -157.7 -167.38 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.183 -0.948 . . . . 0.0 110.059 -179.778 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.501 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 12.1 t80 -144.18 133.54 23.23 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.269 -0.895 . . . . 0.0 110.086 179.984 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.59 HD22 ' CD2' ' A' ' 29' ' ' TYR . 1.6 mm? -87.66 132.62 34.03 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.138 -0.976 . . . . 0.0 110.671 -179.642 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.456 HG13 ' HB3' ' A' ' 2' ' ' SER . 4.8 p -90.71 -22.31 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.256 -0.903 . . . . 0.0 110.674 179.797 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.416 ' OD2' HD11 ' A' ' 22' ' ' LEU . 12.5 p30 -78.46 -9.63 59.38 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.014 -1.054 . . . . 0.0 108.913 179.26 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -157.35 70.85 0.62 Allowed 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.146 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.501 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 12.5 p -29.32 89.43 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 121.768 0.794 . . . . 0.0 111.307 -178.587 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.18 149.61 17.7 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.704 -0.623 . . . . 0.0 109.478 -179.7 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.509 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 3.3 t-20 -61.09 135.13 57.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.215 -0.928 . . . . 0.0 110.227 -179.857 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.59 ' CD2' HD22 ' A' ' 22' ' ' LEU . 7.2 t80 -129.07 126.24 38.99 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.445 -0.785 . . . . 0.0 109.74 -179.936 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 8.2 m -123.47 112.78 17.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.98 . . . . 0.0 110.718 -179.554 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.462 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 8.9 tpp85 -79.51 111.35 15.7 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.272 -0.893 . . . . 0.0 109.686 179.568 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 68.5 m -79.32 167.74 20.49 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.222 -0.924 . . . . 0.0 110.027 -179.871 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -79.82 106.36 11.78 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.295 -0.878 . . . . 0.0 110.225 -179.727 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.6 m -47.25 107.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 O-C-N 121.399 -0.813 . . . . 0.0 109.674 179.583 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.13 -10.77 2.04 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.305 -1.518 . . . . 0.0 109.305 -179.369 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.562 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -78.66 178.97 7.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.197 -1.178 . . . . 0.0 109.692 179.862 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.598 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -106.7 -43.92 4.58 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 118.538 -1.265 . . . . 0.0 110.584 -179.989 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.73 158.03 42.5 Favored Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.635 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.8 p -84.99 44.88 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.12 -1.224 . . . . 0.0 109.696 179.756 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.26 27.21 0.17 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.407 -0.808 . . . . 0.0 109.746 -179.438 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 15.2 p 31.33 93.47 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.63 -0.669 . . . . 0.0 111.026 179.778 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 9.9 tm-20 -159.24 -41.77 0.06 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.481 -0.762 . . . . 0.0 110.035 179.938 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.598 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 0.6 OUTLIER -120.14 129.47 54.17 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.06 -1.025 . . . . 0.0 110.669 179.83 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.574 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 35.6 t80 -88.76 125.15 34.75 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.404 -178.758 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.529 ' CB ' HG23 ' A' ' 37' ' ' THR . 0.2 OUTLIER -98.05 -11.83 22.53 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.362 -0.836 . . . . 0.0 110.45 -179.534 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.574 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 6.3 mt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.052 -1.03 . . . . 0.0 110.241 -179.711 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.482 ' CA ' ' HB ' ' A' ' 23' ' ' VAL . 3.1 m . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.238 0.542 . . . . 0.0 109.898 . . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.471 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 2.7 tt -79.6 148.67 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.233 -0.917 . . . . 0.0 109.803 179.595 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.444 ' CG2' ' N ' ' A' ' 5' ' ' LYS . 4.9 t -160.25 -150.12 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.144 -0.972 . . . . 0.0 110.759 -179.928 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 20' ' ' ILE . 35.6 mtpt -117.28 174.96 5.83 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.417 -0.802 . . . . 0.0 110.28 -179.806 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 14.3 m -113.37 -11.16 13.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.276 -0.89 . . . . 0.0 110.257 -179.802 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.558 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 1.1 m 79.69 -175.26 0.07 Allowed 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.662 -0.649 . . . . 0.0 110.654 179.99 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.472 ' O ' ' ND2' ' A' ' 11' ' ' ASN . 0.2 OUTLIER -78.97 -39.2 34.99 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.299 -0.876 . . . . 0.0 111.363 -179.108 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -84.36 46.13 1.19 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.941 -1.099 . . . . 0.0 109.68 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.53 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -155.17 24.2 0.42 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.429 -0.794 . . . . 0.0 109.815 -179.226 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.472 ' ND2' ' O ' ' A' ' 8' ' ' SER . 15.5 p30 -118.78 -158.24 0.72 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.108 -0.995 . . . . 0.0 109.922 -179.905 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.38 44.6 0.43 Allowed Glycine 0 N--CA 1.488 2.155 0 N-CA-C 109.267 -1.533 . . . . 0.0 109.267 -179.903 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -159.7 -44.38 0.05 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.392 -1.064 . . . . 0.0 110.002 -179.676 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -106.37 131.45 53.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.569 -0.707 . . . . 0.0 109.934 -179.588 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.581 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.1 mt -90.78 -42.58 10.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.346 -0.846 . . . . 0.0 110.438 179.667 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.581 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.8 m80 -113.52 79.24 1.22 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.2 -0.938 . . . . 0.0 110.235 -179.567 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 178.53 -166.83 36.94 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.951 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -131.33 149.18 52.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.282 -1.129 . . . . 0.0 110.239 -179.995 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.7 t -95.87 146.08 24.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.23 -0.919 . . . . 0.0 110.073 179.993 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.648 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 15.1 pt -156.11 -173.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.253 -0.904 . . . . 0.0 110.234 -179.795 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.471 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 12.7 t80 -131.67 145.79 51.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.306 -0.871 . . . . 0.0 109.859 179.782 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.585 HD22 ' CG ' ' A' ' 29' ' ' TYR . 1.4 mm? -103.64 137.75 41.26 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.054 -1.029 . . . . 0.0 111.366 -179.33 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 24' ' ' ASP . 9.3 p -91.16 -27.66 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 110.855 179.865 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.515 ' N ' HG13 ' A' ' 23' ' ' VAL . 10.7 m-20 -77.79 -17.68 57.23 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.071 -1.018 . . . . 0.0 108.831 179.666 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 27' ' ' GLN . 7.0 mtt -144.48 64.38 1.3 Allowed 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 178.698 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 25' ' ' MET . 58.9 p -29.31 86.24 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.711 0.767 . . . . 0.0 111.814 -178.461 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.6 pt20 -161.29 -175.8 5.04 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.605 -0.684 . . . . 0.0 109.467 179.677 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -81.86 145.35 30.42 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.263 -0.898 . . . . 0.0 109.97 179.645 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.648 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 12.3 t80 -141.02 108.67 5.62 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.357 -0.839 . . . . 0.0 109.82 -179.682 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 25.4 m -103.33 112.88 25.96 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.254 -0.904 . . . . 0.0 110.797 -179.499 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -90.33 95.46 10.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.157 -0.964 . . . . 0.0 109.736 179.492 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 92.8 m -79.71 178.91 7.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.224 -0.922 . . . . 0.0 110.057 -179.91 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.51 131.32 36.01 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.237 -0.914 . . . . 0.0 109.803 179.864 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.4 t -66.64 -18.33 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.333 -0.854 . . . . 0.0 110.353 -179.494 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.13 -7.13 49.76 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 179.93 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -90.43 168.32 11.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.219 -1.165 . . . . 0.0 110.233 -179.913 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.595 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -110.86 34.03 4.24 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.119 -0.988 . . . . 0.0 110.497 179.797 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.43 156.93 28.29 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.643 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.524 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 77.0 t -85.07 44.96 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.288 -1.125 . . . . 0.0 109.568 179.54 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.552 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.83 20.92 0.17 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.347 -0.845 . . . . 0.0 109.97 -179.375 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.3 p 26.71 90.94 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 121.485 0.66 . . . . 0.0 111.574 179.631 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.552 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.6 tt0 -155.57 -34.62 0.09 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.835 . . . . 0.0 110.597 179.749 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.595 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.3 p80 -121.89 119.9 32.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.977 -1.077 . . . . 0.0 110.683 179.725 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.561 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 35.4 t80 -83.02 119.34 24.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.718 -0.614 . . . . 0.0 109.743 179.938 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.551 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.4 OUTLIER -89.14 -21.19 23.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.393 -0.817 . . . . 0.0 110.343 -179.435 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.561 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.4 mt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.349 -179.636 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.474 ' CB ' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.352 0.596 . . . . 0.0 110.102 . . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.543 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 5.0 tt -81.69 156.41 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.304 -0.873 . . . . 0.0 110.344 179.939 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.462 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 5.6 t -136.94 -150.67 0.37 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.311 -0.868 . . . . 0.0 110.063 179.87 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.423 ' N ' ' CG2' ' A' ' 4' ' ' THR . 11.1 ttpt -107.67 -178.64 3.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.476 -0.765 . . . . 0.0 110.266 179.986 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 79.5 m -111.95 -154.32 0.54 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.3 -0.875 . . . . 0.0 110.171 -179.947 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.506 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.4 OUTLIER -137.49 -156.57 0.7 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.243 -0.911 . . . . 0.0 110.095 -179.91 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.506 ' N ' ' OG ' ' A' ' 7' ' ' SER . 21.9 t -79.81 167.66 20.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.181 -0.949 . . . . 0.0 110.04 179.93 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 53.11 19.18 1.35 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.176 -0.953 . . . . 0.0 110.173 -179.86 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -119.67 4.51 11.07 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.345 -0.847 . . . . 0.0 110.199 -179.986 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -111.3 90.53 3.36 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.241 -0.912 . . . . 0.0 110.236 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -144.76 40.56 1.14 Allowed Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.983 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -148.13 -57.43 0.23 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.201 -1.176 . . . . 0.0 110.271 179.941 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 28.4 p -97.13 118.86 34.51 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.174 -0.954 . . . . 0.0 110.128 -179.958 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.587 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 12.1 mt -89.27 -40.3 12.92 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.246 -0.909 . . . . 0.0 110.307 -179.974 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.587 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -114.35 81.98 1.64 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.046 -1.034 . . . . 0.0 110.193 -179.651 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -178.28 -173.77 43.97 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.968 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -101.43 144.41 30.26 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.286 -1.126 . . . . 0.0 110.413 -179.985 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 14.8 t -98.35 125.53 43.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.287 -0.883 . . . . 0.0 110.262 -179.959 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.574 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.0 -175.74 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.453 -0.779 . . . . 0.0 110.139 -179.954 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.475 ' O ' HG13 ' A' ' 3' ' ' ILE . 11.8 t80 -138.27 125.96 22.25 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.165 -0.959 . . . . 0.0 110.107 179.975 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.573 HD22 ' CD2' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -80.3 129.8 34.75 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.174 -0.954 . . . . 0.0 110.838 -179.584 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.474 HG12 ' CB ' ' A' ' 2' ' ' SER . 5.0 p -90.59 -28.07 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.391 -0.818 . . . . 0.0 110.438 179.731 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -78.27 -13.52 59.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.069 -1.019 . . . . 0.0 108.719 179.097 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.531 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -147.45 66.31 1.13 Allowed 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.902 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.492 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.9 p -29.29 89.8 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.757 0.789 . . . . 0.0 111.436 -178.604 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -159.08 147.63 18.17 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.693 -0.629 . . . . 0.0 109.481 -179.998 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.513 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.3 m-20 -63.77 109.9 1.88 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.304 -0.872 . . . . 0.0 110.084 -179.987 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.573 ' CD2' HD22 ' A' ' 22' ' ' LEU . 6.2 t80 -98.01 141.25 31.2 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.238 -0.914 . . . . 0.0 109.684 179.871 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 19.5 m -141.95 113.25 7.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.089 -1.007 . . . . 0.0 110.586 -179.497 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -81.5 104.46 11.95 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.197 -0.94 . . . . 0.0 109.625 179.511 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 94.8 m -79.5 168.29 19.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.331 -0.856 . . . . 0.0 110.186 -179.65 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -78.8 127.44 32.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.188 -0.945 . . . . 0.0 109.504 179.783 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.4 t -66.93 -10.3 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.346 -0.846 . . . . 0.0 110.613 -179.19 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -79.44 -5.94 89.09 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 179.835 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.58 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -83.14 178.65 8.01 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.195 -1.18 . . . . 0.0 110.194 -179.95 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -111.85 28.5 8.69 Favored 'General case' 0 N--CA 1.498 1.974 0 C-N-CA 119.046 -1.062 . . . . 0.0 110.16 179.663 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.22 157.75 29.1 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 179.527 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -84.68 43.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -1.162 . . . . 0.0 109.723 179.522 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.556 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -157.03 18.71 0.3 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.463 -0.773 . . . . 0.0 110.135 -179.405 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 13.7 p 29.76 91.4 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.432 -0.793 . . . . 0.0 111.566 179.393 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.543 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.7 tt0 -158.62 -37.74 0.06 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -0.925 . . . . 0.0 110.42 179.507 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 0.6 OUTLIER -119.0 125.13 48.67 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.049 -1.032 . . . . 0.0 110.523 179.83 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.587 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.6 t80 -88.2 126.56 35.21 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.467 0.651 . . . . 0.0 109.865 -179.173 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.543 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -92.71 -28.39 16.67 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.471 -0.768 . . . . 0.0 110.164 -179.394 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.587 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.4 mt . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.45 -179.689 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.488 ' O ' ' CG1' ' A' ' 23' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.248 0.546 . . . . 0.0 110.148 . . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.523 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 2.4 tt -107.95 177.69 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.302 -0.874 . . . . 0.0 110.234 -179.941 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.466 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -153.46 169.65 22.64 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.243 -0.911 . . . . 0.0 110.139 -179.936 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.71 167.51 9.85 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 110.196 -179.988 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 39.9 m -102.14 -149.45 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 110.217 179.994 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -139.8 -169.65 2.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.227 -0.921 . . . . 0.0 110.064 -179.979 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 78.4 p -82.46 9.82 8.43 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.938 . . . . 0.0 110.221 179.999 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -123.34 20.29 9.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.19 -0.944 . . . . 0.0 110.209 -179.953 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 9.8 ttt -146.05 22.31 1.39 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.227 -0.92 . . . . 0.0 110.301 -179.971 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -118.19 94.97 4.69 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.305 -0.872 . . . . 0.0 110.203 179.942 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -155.12 28.64 0.64 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.933 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -122.98 -61.74 1.41 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.21 -1.17 . . . . 0.0 110.261 179.94 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.6 p -90.8 119.26 30.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.204 -0.935 . . . . 0.0 110.351 -179.816 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.579 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.4 mt -80.89 -42.9 20.7 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.326 -0.859 . . . . 0.0 109.999 179.794 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.579 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.2 m80 -118.36 80.98 1.61 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.355 -0.841 . . . . 0.0 110.36 -179.421 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.4 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -170.31 165.94 39.19 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.943 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.459 ' HB2' ' HB3' ' A' ' 31' ' ' ARG . 1.4 mt-30 -80.89 148.92 29.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.212 -1.17 . . . . 0.0 110.149 179.946 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 15.3 t -103.38 119.64 39.27 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.34 -0.85 . . . . 0.0 110.255 179.911 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.571 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -142.35 -175.69 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.205 -0.934 . . . . 0.0 110.372 179.959 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.461 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 6.3 t80 -143.51 126.68 16.54 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.241 -0.912 . . . . 0.0 109.696 179.89 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.465 HD12 ' CB ' ' A' ' 29' ' ' TYR . 1.6 mp -79.46 132.11 36.26 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.191 -0.943 . . . . 0.0 111.011 -179.529 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.488 ' CG1' ' O ' ' A' ' 2' ' ' SER . 8.6 p -90.31 -29.37 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.487 -0.758 . . . . 0.0 110.241 179.942 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.454 ' N ' HG13 ' A' ' 23' ' ' VAL . 3.2 p30 -78.31 -15.69 58.48 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.129 -0.982 . . . . 0.0 108.735 179.042 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.524 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -142.57 64.43 1.37 Allowed 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.037 -1.098 . . . . 0.0 108.037 178.642 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.475 ' C ' ' O ' ' A' ' 25' ' ' MET . 44.8 p -29.14 89.64 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.725 0.774 . . . . 0.0 111.476 -178.52 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.524 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.03 146.7 16.03 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.713 -0.617 . . . . 0.0 109.484 179.93 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.492 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 7.6 p30 -63.6 110.1 1.89 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 110.189 -179.953 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.472 ' HB3' HG12 ' A' ' 20' ' ' ILE . 5.4 t80 -99.39 134.6 42.03 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.367 -0.833 . . . . 0.0 109.729 179.889 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.2 m -130.22 114.48 15.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.082 -1.011 . . . . 0.0 110.566 -179.682 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.459 ' HB3' ' HB2' ' A' ' 18' ' ' GLN . 3.6 tpp180 -79.81 130.98 35.78 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.162 -0.961 . . . . 0.0 109.531 179.525 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 12.2 m -79.78 159.53 26.52 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.222 -0.924 . . . . 0.0 110.121 -179.689 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 35' ' ' GLY . 9.9 tt0 -79.17 107.28 11.82 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.24 -0.912 . . . . 0.0 109.481 179.694 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.415 ' C ' ' O ' ' A' ' 33' ' ' GLU . 37.3 t -42.87 97.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.638 -0.664 . . . . 0.0 110.02 -179.558 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 152.78 -16.07 0.72 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.958 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.572 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.5 m-85 -79.67 169.23 18.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.077 -1.249 . . . . 0.0 110.11 179.964 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.579 HG22 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -113.44 31.86 6.19 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.997 -1.064 . . . . 0.0 110.711 -179.764 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -152.46 157.22 27.15 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.671 -1.371 . . . . 0.0 109.671 179.676 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.4 p -87.86 20.63 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.271 -1.135 . . . . 0.0 109.965 179.814 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.589 ' CZ ' ' CB ' ' A' ' 42' ' ' GLU . 4.3 tmm_? -124.05 -20.36 5.36 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.191 179.851 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.2 m 72.79 82.53 0.13 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.326 -0.859 . . . . 0.0 109.945 179.75 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.589 ' CB ' ' CZ ' ' A' ' 40' ' ' ARG . 0.9 OUTLIER -155.54 -30.7 0.1 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.453 -0.78 . . . . 0.0 111.047 -179.871 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.579 ' CE1' HG22 ' A' ' 37' ' ' THR . 5.7 p80 -122.15 121.51 37.06 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.69 -1.256 . . . . 0.0 110.881 179.783 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.587 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.6 t80 -83.66 108.65 16.88 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.243 0.544 . . . . 0.0 109.891 -179.884 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.573 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -69.74 -16.84 63.39 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.318 -0.864 . . . . 0.0 109.958 -179.707 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.587 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.307 -179.835 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.233 0.539 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.541 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -124.93 160.72 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.254 -0.904 . . . . 0.0 110.169 179.823 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.449 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -135.97 -178.39 5.12 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.264 -0.897 . . . . 0.0 110.079 -179.559 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -84.5 -177.72 6.7 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.237 -0.914 . . . . 0.0 110.028 179.9 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 63.1 m -108.85 -104.14 0.36 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.182 -0.949 . . . . 0.0 110.396 -179.923 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.482 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.1 OUTLIER 174.07 -164.35 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.954 -1.091 . . . . 0.0 110.195 -179.886 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.482 ' N ' ' OG ' ' A' ' 7' ' ' SER . 0.7 OUTLIER -82.75 169.68 15.9 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.178 -0.951 . . . . 0.0 110.121 179.895 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.404 ' C ' ' O ' ' A' ' 8' ' ' SER . 12.1 m-20 43.17 26.41 0.09 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.247 -0.908 . . . . 0.0 110.2 -179.917 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.415 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.8 OUTLIER -124.68 4.33 8.2 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.24 -0.913 . . . . 0.0 110.334 -179.88 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -106.69 82.58 1.73 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.215 -0.928 . . . . 0.0 110.218 179.943 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -137.34 25.55 3.0 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.973 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -125.17 -52.74 1.63 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.227 -1.16 . . . . 0.0 110.241 -179.967 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 20.1 p -106.82 120.47 42.11 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.337 -0.852 . . . . 0.0 110.43 -179.974 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.568 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.7 mt -89.83 -43.39 10.67 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.256 -0.902 . . . . 0.0 110.432 -179.973 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.573 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 5.0 m80 -110.26 88.5 2.78 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.278 -0.889 . . . . 0.0 110.077 -179.482 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.429 ' C ' ' OE1' ' A' ' 18' ' ' GLN . . . 174.91 -126.61 1.2 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 -179.873 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.579 ' NE2' ' CG ' ' A' ' 31' ' ' ARG . 14.6 pm0 -160.5 134.72 7.26 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.433 -1.04 . . . . 0.0 110.248 179.642 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.6 OUTLIER -81.45 148.9 29.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.262 -0.899 . . . . 0.0 110.374 -179.692 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.543 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -159.57 -172.22 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.235 -0.915 . . . . 0.0 109.643 179.913 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.459 ' O ' HG13 ' A' ' 3' ' ' ILE . 4.5 t80 -151.81 128.92 11.12 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.076 -1.015 . . . . 0.0 110.271 -179.636 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 26' ' ' SER . 36.4 mt -79.34 130.39 35.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.146 -0.971 . . . . 0.0 110.866 -179.696 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.6 p -90.3 -34.05 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.157 -0.964 . . . . 0.0 109.968 179.361 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.447 ' OD1' ' HB2' ' A' ' 25' ' ' MET . 3.0 p30 -78.23 -20.88 50.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.152 -0.967 . . . . 0.0 108.586 179.101 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.506 ' O ' ' C ' ' A' ' 26' ' ' SER . 3.9 ttm -136.78 61.5 1.63 Allowed 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.559 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.506 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -29.52 92.66 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 122.106 0.955 . . . . 0.0 111.206 -178.608 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -158.73 141.25 14.24 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.933 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -55.81 113.88 1.67 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.104 -0.997 . . . . 0.0 110.504 -179.511 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.543 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 4.4 t80 -105.93 120.98 43.13 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.349 -0.844 . . . . 0.0 109.789 179.73 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -127.17 111.41 13.95 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.113 -0.992 . . . . 0.0 110.18 179.804 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.579 ' CG ' ' NE2' ' A' ' 18' ' ' GLN . 13.2 tpp180 -84.64 103.88 14.14 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.129 -0.982 . . . . 0.0 110.036 179.777 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 73.6 m -80.57 173.98 12.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.323 -0.861 . . . . 0.0 110.28 -179.842 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -79.89 133.46 36.23 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.277 -0.889 . . . . 0.0 109.896 179.892 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.8 t -71.35 -26.38 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.282 -0.887 . . . . 0.0 110.469 -179.531 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.45 -12.12 31.19 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.805 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.573 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.0 OUTLIER -79.57 178.4 8.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.182 -1.187 . . . . 0.0 110.279 -179.974 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.583 HG22 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -110.39 25.28 11.95 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.128 -0.982 . . . . 0.0 110.267 179.61 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -158.28 157.52 28.39 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.652 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.517 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 70.7 t -84.67 44.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.219 -1.165 . . . . 0.0 109.823 179.715 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.562 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.4 OUTLIER -157.32 20.04 0.29 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.441 -0.787 . . . . 0.0 109.972 -179.523 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.1 p 28.24 89.75 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.429 0.633 . . . . 0.0 111.399 179.724 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.562 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.8 tm-20 -153.63 -37.03 0.1 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.432 -0.793 . . . . 0.0 110.143 179.865 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.583 ' CE1' HG22 ' A' ' 37' ' ' THR . 6.3 p80 -119.59 121.52 39.51 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.0 110.221 179.209 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.582 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 24.7 t80 -84.95 120.16 26.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.696 -0.627 . . . . 0.0 110.064 -179.505 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.527 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -87.14 -12.16 47.86 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.479 -0.763 . . . . 0.0 109.916 -179.572 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.582 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.8 mt . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 117.926 -1.035 . . . . 0.0 110.274 -179.882 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.521 ' CB ' HG12 ' A' ' 23' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.27 0.557 . . . . 0.0 110.105 . . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.514 ' CD1' ' HB ' ' A' ' 20' ' ' ILE . 3.0 tt -142.74 161.71 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.313 -0.867 . . . . 0.0 110.179 179.96 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.473 ' N ' HG12 ' A' ' 3' ' ' ILE . 1.3 m -143.57 162.25 36.37 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.223 -0.923 . . . . 0.0 110.221 179.755 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 mtmp? -86.56 167.73 14.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.222 -0.924 . . . . 0.0 110.178 -179.882 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 75.5 m -90.59 -178.39 5.29 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.305 -0.872 . . . . 0.0 110.233 179.983 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.7 t -108.25 -153.17 0.5 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.923 . . . . 0.0 110.265 -179.895 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.5 172.04 11.29 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.341 -0.849 . . . . 0.0 110.304 -179.991 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t0 45.26 25.3 0.19 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.222 -0.924 . . . . 0.0 110.157 -179.953 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.439 ' HE3' ' HB2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -124.16 2.86 8.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.178 -0.951 . . . . 0.0 110.291 179.992 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -101.55 47.63 0.9 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.273 -0.892 . . . . 0.0 110.261 -179.985 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -120.44 16.0 9.84 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.997 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.0 t80 -105.45 -53.23 2.69 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -1.161 . . . . 0.0 110.276 179.972 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 23.4 p -109.89 118.05 35.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.264 -0.897 . . . . 0.0 110.31 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.561 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -90.35 -43.11 10.54 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.233 -0.917 . . . . 0.0 110.338 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 8.3 m80 -107.85 83.94 1.88 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.31 -0.869 . . . . 0.0 110.015 -179.538 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.469 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 175.73 -161.22 29.89 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.813 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -121.78 133.98 54.92 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.251 -1.147 . . . . 0.0 110.119 179.827 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -85.61 140.34 30.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.226 -0.921 . . . . 0.0 110.318 -179.831 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.641 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 32.8 pt -157.65 -167.95 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 110.075 -179.949 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.52 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 11.2 t80 -147.08 139.69 24.88 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.907 . . . . 0.0 110.04 -179.919 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.601 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.5 mm? -92.2 134.52 34.8 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.105 -0.997 . . . . 0.0 110.743 -179.725 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.521 HG12 ' CB ' ' A' ' 2' ' ' SER . 7.5 p -90.66 -28.32 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.239 -0.913 . . . . 0.0 110.658 179.997 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.515 ' OD1' ' N ' ' A' ' 25' ' ' MET . 58.0 p30 -78.17 -12.98 60.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.922 -1.111 . . . . 0.0 108.892 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -146.41 65.78 1.19 Allowed 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.777 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.52 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 20.5 p -30.03 87.93 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.64 0.733 . . . . 0.0 111.928 -178.466 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.7 tt0 -158.59 168.05 27.93 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.581 -0.7 . . . . 0.0 109.763 179.531 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.48 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 2.0 p-10 -76.52 127.47 32.89 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.398 -0.814 . . . . 0.0 110.373 -179.86 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.641 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 6.3 t80 -122.31 119.83 32.29 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.422 -0.798 . . . . 0.0 109.816 179.906 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 22.2 m -123.79 115.15 20.89 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.128 -0.983 . . . . 0.0 110.51 -179.561 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.469 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 8.1 tpp85 -80.97 115.71 20.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.263 -0.898 . . . . 0.0 109.675 179.528 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 87.4 m -79.68 168.84 18.82 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.237 -0.914 . . . . 0.0 110.512 -179.667 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -79.84 115.44 19.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.415 -0.803 . . . . 0.0 110.216 -179.866 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.2 t -54.83 110.06 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.347 -0.846 . . . . 0.0 109.778 179.748 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 138.9 -8.23 3.3 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.701 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.22 177.09 9.09 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.158 -1.201 . . . . 0.0 109.908 179.943 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.606 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.62 29.88 7.33 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.92 -1.112 . . . . 0.0 110.115 -179.913 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.01 155.77 26.92 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.384 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 39' ' ' VAL . 14.8 p -85.12 44.27 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.24 -1.153 . . . . 0.0 109.628 179.547 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.554 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.22 22.26 0.16 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.491 -0.755 . . . . 0.0 109.909 -179.374 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 11.8 p 29.63 90.28 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.612 -0.68 . . . . 0.0 111.351 179.625 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.554 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.6 tm-20 -151.85 -45.04 0.11 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.162 -0.961 . . . . 0.0 110.415 179.943 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.606 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 3.0 p-80 -117.85 129.62 55.76 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.074 -1.017 . . . . 0.0 110.817 179.883 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.635 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 14.8 t80 -87.03 126.44 34.75 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.399 0.619 . . . . 0.0 109.978 -178.794 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.576 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -84.92 2.48 42.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.473 -0.767 . . . . 0.0 109.954 -179.598 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.635 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.4 mt . . . . . 0 C--N 1.302 -1.496 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.31 -179.518 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.454 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 40.8 t . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.186 0.517 . . . . 0.0 110.2 . . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.589 ' CG1' ' CG2' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -100.02 156.66 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.326 -0.859 . . . . 0.0 110.349 179.974 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.491 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 3.2 m -137.25 166.72 23.09 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.141 179.955 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.9 mttt -106.61 156.08 18.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.214 -0.929 . . . . 0.0 110.35 -179.945 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 90.7 m -81.8 -160.82 0.38 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.276 -0.89 . . . . 0.0 110.149 -179.948 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.0 t -131.81 -159.62 0.98 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.252 -0.905 . . . . 0.0 110.221 179.967 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.0 m -80.33 171.23 15.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.263 -0.898 . . . . 0.0 110.214 179.967 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 46.5 24.02 0.27 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.279 -0.888 . . . . 0.0 110.238 -179.951 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.11 7.73 7.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.218 -0.926 . . . . 0.0 110.28 -179.981 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -115.22 96.79 5.85 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.223 -0.923 . . . . 0.0 110.229 -179.93 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.56 39.19 1.31 Allowed Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.995 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.431 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 82.6 t80 -142.42 -53.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -1.143 . . . . 0.0 110.262 -179.932 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.3 p -100.86 118.34 36.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.458 -179.833 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.547 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.8 mt -90.49 -43.05 10.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.248 -0.907 . . . . 0.0 110.328 179.838 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.547 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.3 m80 -108.24 83.13 1.73 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.269 -0.894 . . . . 0.0 110.289 -179.403 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.434 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 179.33 -134.26 2.25 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.999 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -160.28 142.6 13.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -1.136 . . . . 0.0 110.387 179.981 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -83.37 135.51 34.68 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.192 -0.943 . . . . 0.0 110.036 179.739 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.589 ' CG2' ' CG1' ' A' ' 3' ' ' ILE . 37.9 mm -143.13 169.74 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.155 -0.966 . . . . 0.0 110.257 -179.643 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.491 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 23.6 t80 -131.45 140.2 49.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.021 -1.049 . . . . 0.0 110.052 179.813 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.577 HD23 ' CD2' ' A' ' 29' ' ' TYR . 3.2 mm? -102.63 138.61 39.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.125 -0.985 . . . . 0.0 110.927 -179.57 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.518 HG11 ' N ' ' A' ' 24' ' ' ASP . 7.5 p -90.4 -28.29 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.279 -0.888 . . . . 0.0 110.479 179.936 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.518 ' N ' HG11 ' A' ' 23' ' ' VAL . 15.4 t70 -78.23 -17.81 56.23 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.087 -1.008 . . . . 0.0 108.769 179.351 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.576 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -139.57 62.78 1.51 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.685 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.6 p -29.21 85.54 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 121.565 0.698 . . . . 0.0 112.003 -178.284 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.576 ' N ' ' O ' ' A' ' 25' ' ' MET . 9.9 pt20 -161.39 -177.29 5.89 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.577 -0.702 . . . . 0.0 109.385 179.354 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -82.14 163.94 21.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.27 -0.894 . . . . 0.0 110.254 179.937 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.577 ' CD2' HD23 ' A' ' 22' ' ' LEU . 8.6 t80 -150.91 90.45 1.62 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.282 -0.886 . . . . 0.0 109.97 179.875 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.7 m -91.84 101.67 14.26 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.292 -0.88 . . . . 0.0 110.388 -179.735 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.434 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.9 OUTLIER -79.28 118.39 21.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.194 -0.941 . . . . 0.0 109.654 179.589 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 82.1 m -79.73 170.45 16.5 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.373 -0.83 . . . . 0.0 110.36 -179.738 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -79.78 116.22 19.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.356 -0.84 . . . . 0.0 110.118 -179.931 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 t -53.65 105.48 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.266 -0.896 . . . . 0.0 109.678 179.897 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.94 -10.7 1.85 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.663 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.547 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.15 178.6 7.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.12 -1.223 . . . . 0.0 109.673 179.876 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.613 HG21 ' CE1' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -109.65 25.77 11.42 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 118.793 -1.163 . . . . 0.0 110.57 -179.799 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.42 160.28 31.62 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 179.29 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 11.5 p -87.09 38.13 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.115 -1.226 . . . . 0.0 109.622 179.382 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.544 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -146.31 14.01 1.26 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.562 -0.711 . . . . 0.0 109.65 -179.684 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 8.0 p 31.07 93.29 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.515 -0.74 . . . . 0.0 111.242 179.757 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.544 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.1 tm-20 -159.5 -38.38 0.06 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.509 -0.745 . . . . 0.0 110.022 179.612 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.613 ' CE1' HG21 ' A' ' 37' ' ' THR . 2.1 p-80 -120.28 125.6 48.5 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 122.166 0.984 . . . . 0.0 110.538 179.78 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.595 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.2 t80 -85.59 127.48 34.47 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.338 0.589 . . . . 0.0 109.88 -179.026 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.539 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -86.89 -35.48 18.95 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.359 -0.838 . . . . 0.0 110.023 -179.5 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.595 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.7 mt . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.295 -179.775 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.49 ' CB ' HG12 ' A' ' 23' ' ' VAL . 1.3 m . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.331 0.586 . . . . 0.0 110.228 . . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.526 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 0.9 OUTLIER -143.9 154.74 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.281 -0.887 . . . . 0.0 110.186 -179.938 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.02 164.07 18.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.264 -0.898 . . . . 0.0 110.311 179.98 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.4 168.06 9.56 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.295 -0.878 . . . . 0.0 110.204 179.993 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 71.8 m -107.84 -170.93 1.77 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.213 -0.929 . . . . 0.0 110.223 179.99 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -116.85 -155.17 0.58 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.339 -0.851 . . . . 0.0 110.184 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.81 170.26 16.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.206 -0.933 . . . . 0.0 110.184 179.986 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.3 15.1 3.2 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.226 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.94 15.06 9.99 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.0 110.305 -179.977 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.71 114.17 16.28 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.225 -0.922 . . . . 0.0 110.088 179.985 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.15 27.71 0.19 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 -179.944 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -131.02 -47.59 1.01 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.246 -1.149 . . . . 0.0 110.204 179.914 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 17.1 p -102.78 123.38 46.34 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.296 -0.877 . . . . 0.0 110.134 179.901 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.483 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 4.2 mt -90.5 -52.33 4.96 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.276 -0.89 . . . . 0.0 110.406 -179.823 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.502 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 10.5 m80 -99.04 82.81 2.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.37 -0.831 . . . . 0.0 110.358 -179.267 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.471 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 178.69 -135.31 2.57 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.93 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.455 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 5.0 pt20 -160.34 145.82 14.99 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -1.102 . . . . 0.0 110.23 179.863 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 41.9 t -89.43 131.13 35.64 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -0.876 . . . . 0.0 110.051 179.963 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.635 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 20.5 pt -143.46 -172.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.374 -0.829 . . . . 0.0 110.085 -179.865 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.522 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 14.9 t80 -142.66 132.53 24.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.242 -0.911 . . . . 0.0 109.868 179.861 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.583 HD23 ' CD2' ' A' ' 29' ' ' TYR . 2.5 mm? -86.49 131.57 34.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.14 -0.975 . . . . 0.0 110.612 -179.726 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.49 HG12 ' CB ' ' A' ' 2' ' ' SER . 5.9 p -90.32 -25.04 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.257 -0.902 . . . . 0.0 110.504 179.919 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -78.38 -4.74 49.7 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.024 -1.048 . . . . 0.0 108.858 179.015 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.2 ttt -159.12 68.5 0.44 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 179.183 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.522 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 17.9 p -29.51 88.79 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.708 0.766 . . . . 0.0 111.471 -178.484 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.0 OUTLIER -160.49 148.44 16.3 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.629 -0.669 . . . . 0.0 109.462 -179.963 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.513 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.6 t-20 -59.08 148.93 29.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.283 -0.886 . . . . 0.0 109.853 179.921 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.635 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 5.4 t80 -145.82 114.43 6.8 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.161 -0.962 . . . . 0.0 110.328 -179.517 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.7 m -108.3 111.46 23.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.056 -1.028 . . . . 0.0 110.241 -179.964 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.471 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 1.6 tpp180 -85.61 114.48 22.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.253 -0.904 . . . . 0.0 110.017 179.717 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 96.6 m -79.82 175.99 10.13 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.315 -0.865 . . . . 0.0 110.509 -179.921 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -81.16 115.82 20.76 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.273 -0.892 . . . . 0.0 110.249 -179.944 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 59.7 t -52.16 105.84 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.194 -0.942 . . . . 0.0 109.909 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 146.62 -13.57 1.56 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 -179.872 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.502 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.54 174.34 11.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.35 -1.088 . . . . 0.0 109.951 179.886 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.66 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 0.4 OUTLIER -106.01 -32.45 8.29 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 118.86 -1.136 . . . . 0.0 111.117 -179.674 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.506 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -92.13 159.51 25.42 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.928 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.85 44.41 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.247 -1.149 . . . . 0.0 109.531 179.455 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.569 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -159.6 27.11 0.19 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.544 -0.722 . . . . 0.0 109.789 -179.339 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.2 p 28.5 91.94 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.606 -0.684 . . . . 0.0 111.472 179.577 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.553 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 15.4 tm-20 -157.47 -37.96 0.07 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.36 -0.838 . . . . 0.0 110.199 179.599 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.66 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 6.0 p80 -125.29 128.47 48.29 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.048 -1.032 . . . . 0.0 111.159 179.678 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.573 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 89.4 t80 -93.93 112.81 24.71 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.724 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.576 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -94.94 -10.54 30.76 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.266 -0.896 . . . . 0.0 110.197 -179.102 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.573 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 7.5 mt . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.213 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.526 ' O ' ' CG1' ' A' ' 1' ' ' VAL . 14.5 p . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 121.303 0.573 . . . . 0.0 110.219 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.48 ' HB2' HG13 ' A' ' 23' ' ' VAL . 94.0 p -139.55 90.06 2.38 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.208 -0.932 . . . . 0.0 110.084 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.529 HG12 ' CG2' ' A' ' 20' ' ' ILE . 9.4 tt -141.23 169.58 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.349 -0.844 . . . . 0.0 110.066 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.474 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 4.0 m -141.35 167.27 22.56 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.303 -0.873 . . . . 0.0 110.423 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -80.98 -170.43 2.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.2 -0.937 . . . . 0.0 110.151 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 99.5 m -116.08 172.67 7.02 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.206 -0.934 . . . . 0.0 110.255 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 t -110.91 -151.28 0.48 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.339 -0.851 . . . . 0.0 110.32 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.8 m -84.62 172.76 11.32 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.336 -0.853 . . . . 0.0 110.318 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 45.29 24.84 0.17 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.36 -0.838 . . . . 0.0 110.296 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.5 2.17 10.16 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.187 -0.945 . . . . 0.0 110.211 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.67 76.47 1.4 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 110.126 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -135.02 27.83 3.12 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -135.64 -60.49 0.74 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.236 -1.155 . . . . 0.0 110.199 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -91.47 120.28 32.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.323 -0.861 . . . . 0.0 110.145 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.573 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.8 mt -90.08 -41.88 11.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.19 -0.944 . . . . 0.0 110.493 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.583 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 8.8 m80 -114.4 85.09 2.17 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.258 -0.901 . . . . 0.0 110.098 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.483 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.03 178.18 42.11 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -99.75 140.61 33.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.311 -1.111 . . . . 0.0 110.143 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -85.43 134.32 34.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.311 -0.868 . . . . 0.0 110.278 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.529 ' CG2' HG12 ' A' ' 3' ' ' ILE . 0.4 OUTLIER -139.4 -174.34 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.825 0 O-C-N 121.204 -0.935 . . . . 0.0 109.58 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.467 ' O ' HG13 ' A' ' 3' ' ' ILE . 11.3 t80 -149.31 123.46 9.5 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.919 -1.113 . . . . 0.0 110.504 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.541 ' HG ' ' HB2' ' A' ' 29' ' ' TYR . 21.0 mt -79.52 132.11 36.23 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.236 -0.915 . . . . 0.0 110.947 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.52 HG11 ' N ' ' A' ' 24' ' ' ASP . 8.7 p -90.09 -33.36 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.244 -0.91 . . . . 0.0 109.864 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.52 ' N ' HG11 ' A' ' 23' ' ' VAL . 5.7 p-10 -78.29 -20.92 50.53 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.231 -0.918 . . . . 0.0 108.58 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.523 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.1 tpt -133.06 60.27 1.71 Allowed 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.479 ' C ' ' O ' ' A' ' 25' ' ' MET . 3.6 p -29.21 89.45 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.667 0.746 . . . . 0.0 111.611 -178.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.523 ' N ' ' O ' ' A' ' 25' ' ' MET . 2.6 pt20 -159.85 170.44 21.43 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.712 -0.617 . . . . 0.0 109.431 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -81.15 116.23 20.96 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.261 -0.899 . . . . 0.0 110.508 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.541 ' HB2' ' HG ' ' A' ' 22' ' ' LEU . 4.3 t80 -109.96 103.92 12.76 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.394 -0.816 . . . . 0.0 109.475 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 65.9 m -108.26 114.67 28.72 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.191 -0.943 . . . . 0.0 110.395 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.483 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.8 tpp85 -79.54 120.73 24.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.896 . . . . 0.0 109.401 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 95.5 m -78.98 171.84 14.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.138 -0.976 . . . . 0.0 110.471 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -79.38 121.24 24.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.391 -0.818 . . . . 0.0 110.037 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 32.6 t -52.51 104.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.222 -0.924 . . . . 0.0 109.73 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.457 ' O ' HD13 ' A' ' 46' ' ' LEU . . . 144.56 -10.77 1.94 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.34 172.02 14.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.214 -1.168 . . . . 0.0 109.843 179.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.58 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -113.39 31.67 6.31 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.891 -1.13 . . . . 0.0 111.066 -179.253 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.43 155.44 26.59 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.5 p -85.69 43.5 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.308 -1.113 . . . . 0.0 109.475 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.552 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.1 OUTLIER -156.64 20.14 0.33 Allowed 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.565 -0.709 . . . . 0.0 109.787 -179.353 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 5.2 p 27.57 90.73 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.685 -0.634 . . . . 0.0 111.614 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.547 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 10.4 tm-20 -154.89 -36.51 0.09 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.469 -0.769 . . . . 0.0 110.197 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.58 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.9 p80 -120.42 119.51 33.26 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.016 -1.053 . . . . 0.0 110.626 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.578 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 41.3 t80 -82.78 114.79 21.35 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.332 0.587 . . . . 0.0 110.045 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.52 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -77.98 -35.07 50.59 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.315 -0.866 . . . . 0.0 110.105 -179.69 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.578 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.6 mt . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.338 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 78.8 t . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.297 0.57 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.527 ' HB2' ' CG1' ' A' ' 23' ' ' VAL . 1.4 p -155.14 41.53 0.44 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.223 -0.923 . . . . 0.0 110.121 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.537 HG12 ' CG2' ' A' ' 20' ' ' ILE . 1.0 OUTLIER -155.93 166.58 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.363 -0.836 . . . . 0.0 110.464 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.484 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.4 m -149.11 172.22 15.15 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.365 -0.835 . . . . 0.0 110.142 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.67 175.54 5.41 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.229 -0.92 . . . . 0.0 110.227 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 93.7 m -117.09 176.63 5.04 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.291 -0.881 . . . . 0.0 110.26 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -155.96 17.22 0.36 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 0.0 110.672 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.0 m -151.79 -70.39 0.16 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.187 -0.946 . . . . 0.0 110.246 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -80.25 12.9 2.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.161 -0.962 . . . . 0.0 110.552 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.518 ' HB3' ' CB ' ' A' ' 6' ' ' CYS . 22.2 ptm -78.89 -27.69 43.98 Favored 'General case' 0 C--N 1.308 -1.232 0 O-C-N 121.106 -0.996 . . . . 0.0 110.186 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.5 p30 -100.69 44.89 0.99 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.213 -0.929 . . . . 0.0 110.184 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -129.16 -39.11 0.31 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.8 t80 -94.08 -65.04 1.01 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.194 -1.18 . . . . 0.0 110.403 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.2 p -91.24 119.73 31.56 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.162 -0.961 . . . . 0.0 110.269 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.575 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.8 mt -87.59 -40.96 13.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.195 -0.94 . . . . 0.0 110.254 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.575 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.8 m80 -113.53 88.03 2.75 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.16 -0.963 . . . . 0.0 110.091 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.83 -168.43 41.27 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -117.24 134.62 54.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -1.117 . . . . 0.0 110.052 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 3.8 t -79.84 146.8 32.04 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.228 -0.92 . . . . 0.0 109.94 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.537 ' CG2' HG12 ' A' ' 3' ' ' ILE . 1.2 mt -152.35 -176.83 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.152 -0.967 . . . . 0.0 109.841 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.484 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 20.6 t80 -147.99 117.88 7.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.111 -0.993 . . . . 0.0 109.971 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.572 HD22 ' CD2' ' A' ' 29' ' ' TYR . 1.2 mm? -79.93 130.15 35.06 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.098 -1.001 . . . . 0.0 110.195 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.527 ' CG1' ' HB2' ' A' ' 2' ' ' SER . 7.2 p -89.34 -26.05 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.245 -0.909 . . . . 0.0 110.153 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -78.39 -13.77 59.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.163 -0.96 . . . . 0.0 108.683 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.534 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -148.1 66.91 1.09 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 178.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.489 ' C ' ' O ' ' A' ' 25' ' ' MET . 80.7 p -29.15 89.14 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 121.761 0.791 . . . . 0.0 111.743 -178.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.534 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -156.8 144.36 19.08 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.607 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.446 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 9.1 t30 -62.85 108.04 1.11 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.194 -0.941 . . . . 0.0 110.455 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.572 ' CD2' HD22 ' A' ' 22' ' ' LEU . 5.7 t80 -94.31 106.06 18.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.327 -0.858 . . . . 0.0 110.017 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -111.74 110.07 20.24 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 110.344 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.2 tpp180 -80.05 103.62 10.06 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.169 -0.957 . . . . 0.0 109.668 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 79.3 m -79.54 171.69 14.81 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.305 -0.872 . . . . 0.0 110.247 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -79.33 126.66 31.09 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.234 -0.916 . . . . 0.0 109.836 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 12.7 t -65.99 -15.15 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 110.114 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.27 -15.62 68.05 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.529 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.5 m-85 -79.75 169.86 17.34 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.219 -1.165 . . . . 0.0 109.955 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.668 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 15.2 t -101.43 26.48 7.19 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 118.874 -1.131 . . . . 0.0 110.655 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.08 160.64 31.81 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.7 p -85.04 43.76 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.1 -1.235 . . . . 0.0 109.716 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.635 ' NH2' ' CD2' ' A' ' 43' ' ' HIS . 1.1 ttp180 -150.29 13.8 0.77 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.464 -0.772 . . . . 0.0 110.224 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.3 p 29.56 88.52 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.494 -0.754 . . . . 0.0 110.886 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 3.4 tt0 -154.85 -36.9 0.09 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.267 -0.895 . . . . 0.0 110.385 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.668 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 6.6 p80 -127.88 124.05 36.53 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.025 -1.047 . . . . 0.0 111.327 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.543 ' CE2' ' C ' ' A' ' 46' ' ' LEU . 87.3 t80 -90.63 89.78 7.68 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.577 ' HB3' ' CB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -64.51 -21.67 66.75 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.365 -0.834 . . . . 0.0 110.322 -179.094 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.543 ' C ' ' CE2' ' A' ' 44' ' ' PHE . 7.2 mt . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.211 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.22 0.534 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.468 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 6.6 m -154.58 120.48 5.22 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.253 -0.905 . . . . 0.0 110.261 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.527 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.3 tt -112.21 150.79 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.23 161.53 18.85 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.272 -0.893 . . . . 0.0 110.204 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.0 tptt -85.09 158.62 20.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.172 -0.955 . . . . 0.0 110.186 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 75.6 m -90.13 -173.46 3.85 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.326 -0.859 . . . . 0.0 110.252 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.7 t -124.96 -152.2 0.51 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.869 . . . . 0.0 110.203 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.34 170.73 10.31 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.297 -0.877 . . . . 0.0 110.1 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.2 t70 52.68 19.57 1.29 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.244 -0.91 . . . . 0.0 110.232 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -118.15 5.33 11.98 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.333 -0.855 . . . . 0.0 110.276 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -105.84 76.21 1.17 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.203 -0.935 . . . . 0.0 110.215 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -125.87 -27.19 1.17 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.834 -1.307 . . . . 0.0 109.834 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -81.43 -52.77 6.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -1.179 . . . . 0.0 110.469 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 28.0 p -99.61 119.77 38.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.259 -0.901 . . . . 0.0 110.511 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.55 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.8 mt -90.49 -43.49 10.21 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.191 -0.943 . . . . 0.0 110.367 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 7.1 m80 -110.98 86.28 2.28 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.223 -0.923 . . . . 0.0 110.219 -179.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.48 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 173.83 177.41 43.01 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -97.6 148.27 23.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.24 -1.153 . . . . 0.0 110.059 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -97.75 134.65 40.63 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.25 -0.906 . . . . 0.0 110.231 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.534 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -148.85 -172.36 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 110.048 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.474 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 17.7 t80 -142.19 133.38 26.18 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.174 -0.954 . . . . 0.0 110.067 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.576 HD21 ' CD2' ' A' ' 29' ' ' TYR . 1.1 mm? -86.26 130.88 34.37 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.08 -1.012 . . . . 0.0 110.604 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.468 ' HB ' ' O ' ' A' ' 2' ' ' SER . 7.5 p -90.51 -25.7 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.265 -0.897 . . . . 0.0 110.47 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.433 ' N ' HG13 ' A' ' 23' ' ' VAL . 22.1 m-20 -78.37 -11.69 59.96 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.106 -0.996 . . . . 0.0 108.792 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -151.18 67.9 0.92 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.017 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 25' ' ' MET . 67.2 p -29.3 90.1 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.673 0.749 . . . . 0.0 111.282 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -159.42 148.6 18.23 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.515 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 2.8 p-10 -64.04 116.71 6.15 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.247 -0.908 . . . . 0.0 110.284 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.576 ' CD2' HD21 ' A' ' 22' ' ' LEU . 5.8 t80 -105.86 138.45 42.03 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.26 -0.9 . . . . 0.0 109.775 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 6.8 m -135.55 120.64 18.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.022 -1.049 . . . . 0.0 110.702 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.48 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -94.28 119.21 32.72 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.213 -0.929 . . . . 0.0 109.524 179.303 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 91.7 m -79.45 173.82 12.2 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.304 -0.873 . . . . 0.0 110.514 -179.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.54 117.57 20.6 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.354 -0.841 . . . . 0.0 109.927 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.1 t -49.09 102.07 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.242 -0.911 . . . . 0.0 109.761 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.16 -12.24 1.41 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.3 167.18 21.27 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.176 -1.191 . . . . 0.0 109.698 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.584 HG21 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.95 35.0 3.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.959 -1.088 . . . . 0.0 110.91 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.25 158.99 30.39 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 6.5 p -88.04 29.43 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.224 -1.162 . . . . 0.0 109.866 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.541 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -145.91 20.31 1.45 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.444 -0.785 . . . . 0.0 109.749 -179.607 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 6.4 p 30.55 94.56 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 CA-C-O 121.529 0.681 . . . . 0.0 111.308 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -155.07 -37.0 0.09 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.514 -0.741 . . . . 0.0 110.097 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.584 ' CE1' HG21 ' A' ' 37' ' ' THR . 5.6 p80 -121.72 117.63 27.11 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.14 -0.975 . . . . 0.0 110.295 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.582 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 39.9 t80 -80.32 111.46 16.72 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.36 0.6 . . . . 0.0 109.991 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.518 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -74.05 -31.94 63.1 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.435 -0.791 . . . . 0.0 110.133 -179.659 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.582 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.247 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.204 0.526 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.479 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 29.2 t -156.32 60.39 0.56 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.283 -0.886 . . . . 0.0 110.219 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.533 ' CD1' ' HB ' ' A' ' 20' ' ' ILE . 5.7 tt -79.56 156.04 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.232 -0.917 . . . . 0.0 110.386 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.449 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.2 OUTLIER -124.29 -171.45 2.34 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.356 -0.84 . . . . 0.0 110.162 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 20' ' ' ILE . 14.1 mtpt -125.94 158.42 35.24 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.296 -0.877 . . . . 0.0 110.231 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 23.2 m -86.7 -150.62 0.16 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.878 . . . . 0.0 110.146 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -149.96 -155.35 0.62 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.218 -0.926 . . . . 0.0 110.125 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.9 m -90.32 27.92 1.56 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.245 -0.91 . . . . 0.0 110.124 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.444 ' O ' ' OD1' ' A' ' 9' ' ' ASP . 56.2 t0 -144.87 31.42 1.15 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.28 -0.888 . . . . 0.0 110.201 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.2 tpp -152.39 17.51 0.63 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.331 -0.856 . . . . 0.0 110.208 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -106.54 81.92 1.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -133.69 4.4 4.72 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -115.22 -56.63 2.34 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.254 -1.145 . . . . 0.0 110.113 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -96.55 116.48 29.16 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.167 -0.958 . . . . 0.0 110.516 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.59 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.3 mt -87.37 -40.36 14.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.389 -0.819 . . . . 0.0 110.129 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.9 m80 -118.0 87.22 2.67 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.317 -0.864 . . . . 0.0 110.325 -179.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.448 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -178.31 -169.28 38.92 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.445 ' O ' ' CD1' ' A' ' 20' ' ' ILE . 8.6 mm-40 -106.85 134.82 49.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.304 -1.115 . . . . 0.0 110.306 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -92.14 126.82 37.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.28 -0.887 . . . . 0.0 110.116 179.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.536 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -147.67 -169.64 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.233 -0.917 . . . . 0.0 110.511 -179.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.495 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 10.2 t80 -145.7 133.13 20.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.38 -0.825 . . . . 0.0 109.705 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.566 HD22 ' CD2' ' A' ' 29' ' ' TYR . 1.5 mm? -86.75 131.85 34.02 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.737 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.479 ' HB ' ' O ' ' A' ' 2' ' ' SER . 4.5 p -90.7 -22.76 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.235 -0.915 . . . . 0.0 110.741 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.471 ' N ' HG12 ' A' ' 23' ' ' VAL . 15.3 m-20 -78.14 -9.51 59.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.069 -1.019 . . . . 0.0 108.893 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -157.11 71.02 0.64 Allowed 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.061 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.495 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 40.6 p -29.26 89.89 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.689 0.757 . . . . 0.0 111.227 -178.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -157.37 147.78 21.03 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.769 -0.582 . . . . 0.0 109.517 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.519 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.0 m120 -64.01 122.98 17.83 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.325 -0.86 . . . . 0.0 110.433 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.566 ' CD2' HD22 ' A' ' 22' ' ' LEU . 5.8 t80 -112.52 131.24 55.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.359 -0.838 . . . . 0.0 109.762 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.4 m -131.64 112.14 12.31 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.159 -0.963 . . . . 0.0 110.624 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.448 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 16.7 tpp85 -84.86 134.58 34.28 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.265 -0.897 . . . . 0.0 110.03 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.631 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 6.1 t -79.71 164.07 24.02 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.252 -0.905 . . . . 0.0 110.066 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 14.9 tt0 -79.58 110.69 15.14 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.285 -0.884 . . . . 0.0 109.495 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.427 ' C ' ' O ' ' A' ' 33' ' ' GLU . 37.6 t -43.36 96.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.503 -0.748 . . . . 0.0 109.719 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 151.52 -14.73 0.82 Allowed Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.581 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.4 m-85 -79.04 -178.33 6.06 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.109 -1.23 . . . . 0.0 109.826 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.583 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.3 OUTLIER -106.03 -57.37 2.05 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.036 -1.04 . . . . 0.0 110.662 -179.683 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.421 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -85.41 152.86 26.99 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.433 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 44.1 t -76.23 2.17 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.237 -1.155 . . . . 0.0 109.96 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.593 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 4.5 tmm_? -80.28 -10.0 59.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.336 -0.852 . . . . 0.0 109.878 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.631 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 11.2 m 59.95 66.9 0.92 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.392 -0.817 . . . . 0.0 110.476 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.593 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER -152.59 -28.25 0.16 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.067 -1.021 . . . . 0.0 111.965 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.583 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.1 p80 -122.78 121.21 35.74 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.56 -1.338 . . . . 0.0 111.659 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.613 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.8 t80 -80.14 110.46 15.57 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.869 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.547 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -74.93 -14.66 60.67 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.104 -0.998 . . . . 0.0 109.958 -179.72 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.613 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 6.0 mt . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.275 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.186 0.517 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.527 ' CB ' HG13 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -140.46 103.77 4.62 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.343 -0.848 . . . . 0.0 110.076 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.534 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -160.19 167.88 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.291 -0.881 . . . . 0.0 110.403 -179.656 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.488 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.2 m -144.98 162.4 37.01 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.427 -0.796 . . . . 0.0 110.039 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -119.08 157.73 27.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.252 -0.905 . . . . 0.0 110.133 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 86.3 m -91.91 -124.55 0.08 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.294 -0.879 . . . . 0.0 109.976 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.2 t -146.77 -154.38 0.55 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.972 -1.08 . . . . 0.0 110.122 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -85.04 -59.04 2.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.233 -0.917 . . . . 0.0 110.338 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -83.44 11.89 6.31 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.269 -0.895 . . . . 0.0 110.356 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 8.5 tpt -100.0 -4.42 30.07 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.264 -0.898 . . . . 0.0 110.202 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.441 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 39.4 t-20 -120.89 67.87 0.87 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.232 -0.918 . . . . 0.0 110.144 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.67 24.72 16.03 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.469 ' O ' ' NH1' ' A' ' 40' ' ' ARG . 7.5 t80 -110.19 -50.04 3.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.239 -1.154 . . . . 0.0 110.231 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 1.9 m -89.04 138.16 31.66 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.428 -0.795 . . . . 0.0 110.392 -179.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.555 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 13.6 mt -91.44 -46.96 7.71 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.564 -0.71 . . . . 0.0 110.2 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.577 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 5.4 m80 -119.44 91.66 3.6 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.332 -0.855 . . . . 0.0 110.217 -179.02 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.13 -167.13 39.64 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -127.19 164.02 22.58 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.283 -1.127 . . . . 0.0 110.272 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -96.23 135.2 38.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.282 -0.886 . . . . 0.0 110.315 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.534 ' CG2' HG12 ' A' ' 3' ' ' ILE . 17.2 mm -134.58 173.35 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.351 -0.843 . . . . 0.0 109.825 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.488 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 19.7 t80 -144.51 127.84 16.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.923 -1.111 . . . . 0.0 110.399 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.539 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.5 mm? -89.78 133.76 34.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.258 -0.901 . . . . 0.0 110.485 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.53 HG11 ' N ' ' A' ' 24' ' ' ASP . 12.6 p -90.42 -30.55 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.171 -0.955 . . . . 0.0 110.462 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.53 ' N ' HG11 ' A' ' 23' ' ' VAL . 3.4 p30 -78.3 -18.18 55.58 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.115 -0.991 . . . . 0.0 108.814 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.503 ' O ' ' N ' ' A' ' 27' ' ' GLN . 18.0 ttt -138.13 62.27 1.57 Allowed 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.493 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.56 92.0 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 122.119 0.961 . . . . 0.0 111.148 -178.532 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.505 ' HG3' ' N ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER -159.95 147.63 16.73 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.366 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.505 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 6.5 m120 -67.52 105.85 1.97 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.263 -0.898 . . . . 0.0 110.121 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.539 ' HB2' HD23 ' A' ' 22' ' ' LEU . 5.7 t80 -87.61 90.62 8.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.424 -0.797 . . . . 0.0 110.233 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 7.5 m -82.05 115.25 21.11 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 110.553 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -94.75 111.2 22.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.205 -0.934 . . . . 0.0 110.108 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 79.4 m -79.93 178.07 8.47 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.243 -0.911 . . . . 0.0 110.376 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -80.15 146.27 31.9 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.324 -0.86 . . . . 0.0 109.854 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.1 t -76.28 29.59 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.143 -0.973 . . . . 0.0 111.818 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -126.52 -5.06 6.12 Favored Glycine 0 N--CA 1.487 2.044 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.577 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 15.9 m-85 -95.4 157.51 15.86 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.354 -1.086 . . . . 0.0 109.57 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.583 HG23 ' CE1' ' A' ' 43' ' ' HIS . 10.2 t -108.85 43.47 1.25 Allowed 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 118.468 -1.293 . . . . 0.0 110.633 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.84 161.5 32.84 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -87.55 35.64 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.081 -1.247 . . . . 0.0 109.568 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.576 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 0.5 OUTLIER -143.1 8.11 1.63 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.472 -0.767 . . . . 0.0 110.279 -179.428 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 2.5 p 34.02 78.8 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.379 -0.826 . . . . 0.0 111.012 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.576 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 33.5 tt0 -142.24 -33.65 0.47 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.406 -0.809 . . . . 0.0 110.159 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.583 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.5 p80 -118.76 114.61 22.95 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.995 -1.065 . . . . 0.0 109.485 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.574 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 27.0 t80 -78.68 98.07 6.08 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 121.776 0.798 . . . . 0.0 109.323 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.571 ' CE2' HD11 ' A' ' 46' ' ' LEU . 0.2 OUTLIER -64.57 -9.15 17.19 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 121.751 -0.593 . . . . 0.0 110.537 -179.015 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.574 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 8.1 mt . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 10.0 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.203 0.525 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.452 ' HB3' HG12 ' A' ' 23' ' ' VAL . 3.0 t -114.09 56.43 0.71 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.266 -0.896 . . . . 0.0 110.148 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.528 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.79 152.22 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.278 -0.889 . . . . 0.0 110.146 179.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.451 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -124.03 -165.14 1.31 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.245 -0.909 . . . . 0.0 110.187 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -106.58 -175.33 2.76 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.232 -0.917 . . . . 0.0 110.207 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 80.5 m -105.23 -155.83 0.55 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 110.356 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -147.42 -138.31 0.09 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.278 -0.889 . . . . 0.0 110.006 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.3 4.82 14.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.054 -1.028 . . . . 0.0 110.059 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -107.19 17.55 22.79 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.324 -0.86 . . . . 0.0 109.823 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.46 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 7.0 ptm -79.49 -26.61 41.58 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.359 -0.838 . . . . 0.0 110.639 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.16 58.19 1.81 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.144 -0.972 . . . . 0.0 110.307 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -146.89 13.17 1.49 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.559 ' CE1' ' HA ' ' A' ' 40' ' ' ARG . 8.4 t80 -157.28 -57.8 0.08 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.168 -1.196 . . . . 0.0 110.312 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.3 p -107.97 114.75 28.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.192 -0.943 . . . . 0.0 110.933 -179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.589 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.2 mt -90.13 -42.48 11.05 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.435 -0.791 . . . . 0.0 109.886 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -111.26 76.91 1.0 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.231 -0.918 . . . . 0.0 110.134 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -172.46 179.5 43.97 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.463 ' HB2' ' HB3' ' A' ' 31' ' ' ARG . 1.0 OUTLIER -93.39 148.07 22.39 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.3 -1.118 . . . . 0.0 110.186 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -109.07 121.02 44.26 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.271 -0.893 . . . . 0.0 110.371 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.544 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -144.3 179.52 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.385 -0.822 . . . . 0.0 110.087 -179.819 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.451 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 20.9 t80 -127.48 133.68 49.87 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.146 -0.971 . . . . 0.0 110.124 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.608 HD23 ' CD2' ' A' ' 29' ' ' TYR . 0.6 OUTLIER -89.17 133.58 34.35 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.243 -0.911 . . . . 0.0 110.545 -179.967 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.452 HG12 ' HB3' ' A' ' 2' ' ' SER . 8.8 p -90.24 -26.34 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.238 -0.914 . . . . 0.0 110.44 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.442 ' N ' HG11 ' A' ' 23' ' ' VAL . 33.0 t0 -78.56 -15.72 58.24 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.056 -1.028 . . . . 0.0 108.821 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -145.47 65.93 1.23 Allowed 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.829 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.494 ' C ' ' O ' ' A' ' 25' ' ' MET . 32.5 p -29.02 89.21 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 CA-C-O 121.648 0.737 . . . . 0.0 111.464 -178.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.3 OUTLIER -159.8 170.14 22.11 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.671 -0.643 . . . . 0.0 109.552 179.731 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.52 100.85 8.78 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.306 -0.871 . . . . 0.0 110.351 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.608 ' CD2' HD23 ' A' ' 22' ' ' LEU . 12.2 t80 -86.99 130.14 34.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.327 -0.858 . . . . 0.0 109.453 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 7.6 m -130.55 116.75 18.58 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.875 -1.14 . . . . 0.0 110.855 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.463 ' HB3' ' HB2' ' A' ' 18' ' ' GLN . 8.0 tpp85 -79.23 128.68 33.61 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.132 -0.98 . . . . 0.0 109.113 179.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.623 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 5.7 m -79.67 159.0 26.87 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.15 -0.969 . . . . 0.0 110.133 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 34' ' ' VAL . 31.3 tt0 -78.36 107.85 11.29 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.258 -0.901 . . . . 0.0 109.166 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.431 ' C ' ' O ' ' A' ' 33' ' ' GLU . 39.6 t -40.99 101.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 121.697 -0.627 . . . . 0.0 110.436 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.526 ' O ' ' CD2' ' A' ' 46' ' ' LEU . . . 140.76 -8.42 2.79 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.565 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -84.79 173.01 11.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.029 -1.277 . . . . 0.0 110.486 -179.798 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.599 HG22 ' CE1' ' A' ' 43' ' ' HIS . 3.9 t -127.57 38.37 4.06 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 118.895 -1.122 . . . . 0.0 111.155 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.516 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -151.35 155.16 25.99 Favored Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.417 -1.373 . . . . 0.0 109.976 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.536 ' N ' ' HD3' ' A' ' 40' ' ' ARG . 79.6 t -83.55 12.68 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.379 -1.071 . . . . 0.0 109.844 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.589 ' HD3' ' N ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -123.26 -7.74 8.19 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.412 -0.805 . . . . 0.0 109.431 179.638 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.623 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 26.8 m 58.77 65.73 1.18 Allowed 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -178.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -135.32 -30.83 1.01 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.561 -0.712 . . . . 0.0 110.868 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.599 ' CE1' HG22 ' A' ' 37' ' ' THR . 5.1 p80 -120.2 123.75 44.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.756 -1.215 . . . . 0.0 111.349 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.597 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 43.9 t80 -86.7 104.25 15.92 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.382 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.595 ' CD2' HD11 ' A' ' 46' ' ' LEU . 0.2 OUTLIER -71.82 -3.19 20.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.396 -0.815 . . . . 0.0 110.163 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.597 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.1 mm? . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.344 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.174 0.511 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.473 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 3.2 m -148.52 43.27 1.01 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.171 -0.955 . . . . 0.0 110.356 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.532 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.5 OUTLIER -141.56 122.66 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.138 -0.976 . . . . 0.0 110.659 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.524 ' HB ' ' CB ' ' A' ' 21' ' ' TYR . 4.2 m -90.96 167.28 12.52 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.387 -0.821 . . . . 0.0 109.765 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -122.34 169.29 11.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.274 -0.891 . . . . 0.0 110.13 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 62.8 m -110.61 -144.33 0.39 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.31 -0.869 . . . . 0.0 110.18 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 t -139.84 -166.27 2.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.229 -0.919 . . . . 0.0 110.111 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.18 7.48 13.53 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.208 -0.933 . . . . 0.0 110.283 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.12 25.81 10.07 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.213 -0.929 . . . . 0.0 110.224 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.436 ' SD ' ' SG ' ' A' ' 6' ' ' CYS . 31.8 ttm -144.67 28.11 1.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.225 -0.922 . . . . 0.0 110.196 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -110.42 27.6 9.47 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.243 -0.91 . . . . 0.0 110.167 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.15 -17.28 79.53 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -83.63 -50.08 8.55 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.251 -1.146 . . . . 0.0 110.327 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -105.79 120.9 42.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.254 -0.904 . . . . 0.0 110.408 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.567 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.6 mt -90.31 -42.29 11.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.336 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.567 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.1 m80 -111.17 86.45 2.32 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.173 -0.955 . . . . 0.0 110.1 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.437 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 168.93 -163.0 36.8 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -123.62 152.87 41.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.306 -1.114 . . . . 0.0 110.06 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 6.8 t -92.16 146.88 23.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.0 110.282 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.532 ' CG2' HG12 ' A' ' 3' ' ' ILE . 1.0 OUTLIER -153.43 -174.08 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.278 -0.889 . . . . 0.0 109.803 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.524 ' CB ' ' HB ' ' A' ' 4' ' ' THR . 27.0 t80 -148.7 130.49 15.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.077 -1.015 . . . . 0.0 109.835 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.566 HD21 ' CD2' ' A' ' 29' ' ' TYR . 1.6 mm? -92.14 132.52 36.55 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.036 -1.04 . . . . 0.0 111.041 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.473 ' HB ' ' O ' ' A' ' 2' ' ' SER . 6.1 t -90.74 -27.22 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.33 -0.856 . . . . 0.0 110.382 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -77.52 -19.9 55.06 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.986 -1.072 . . . . 0.0 108.393 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.529 ' O ' ' N ' ' A' ' 27' ' ' GLN . 19.9 mtm -141.99 62.04 1.44 Allowed 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.487 ' C ' ' O ' ' A' ' 25' ' ' MET . 2.6 p -29.18 89.76 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.803 0.811 . . . . 0.0 111.494 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.529 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.32 147.85 17.91 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.734 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.506 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 5.9 m-80 -57.13 129.55 42.25 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.152 -0.967 . . . . 0.0 110.379 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.566 ' CD2' HD21 ' A' ' 22' ' ' LEU . 6.6 t80 -120.75 107.97 13.4 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.523 -0.736 . . . . 0.0 109.831 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 4.5 m -113.03 112.71 24.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.118 -0.988 . . . . 0.0 110.409 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.437 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 7.2 tpm_? -79.66 116.78 20.05 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.216 -0.928 . . . . 0.0 109.69 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 96.8 m -79.26 175.61 10.43 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.226 -0.921 . . . . 0.0 110.021 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -79.25 110.93 14.98 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.229 -0.919 . . . . 0.0 109.724 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.1 t -44.77 101.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.396 -0.815 . . . . 0.0 109.672 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 146.2 -8.66 1.46 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.478 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.02 176.67 9.44 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.915 -1.344 . . . . 0.0 109.895 -179.967 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.607 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -113.99 28.69 8.56 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.897 -1.127 . . . . 0.0 110.472 -179.724 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -158.15 156.27 27.22 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.0 p -84.63 42.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.326 -1.102 . . . . 0.0 109.839 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.553 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.27 22.93 0.16 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.341 -0.849 . . . . 0.0 109.849 -179.476 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 5.4 p 28.33 93.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.664 -0.647 . . . . 0.0 111.676 179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.553 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 13.4 tm-20 -154.81 -42.1 0.09 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.39 -0.819 . . . . 0.0 110.067 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.607 ' CE1' HG23 ' A' ' 37' ' ' THR . 1.9 p-80 -118.53 128.35 54.49 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.099 -1.001 . . . . 0.0 110.419 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.59 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 36.8 t80 -87.78 128.08 35.32 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.422 0.63 . . . . 0.0 110.16 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.573 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -89.43 -37.33 14.89 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.387 -0.82 . . . . 0.0 110.087 -179.477 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.59 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.001 -0.999 . . . . 0.0 110.151 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 46.2 t . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.183 0.516 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.457 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 6.5 m -103.31 90.49 3.72 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.348 -0.845 . . . . 0.0 110.192 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.576 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -107.67 140.85 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 110.098 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.455 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -107.35 170.64 7.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 110.151 179.892 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -104.99 171.82 7.11 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.186 -0.947 . . . . 0.0 110.232 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 62.5 m -90.6 -143.62 0.17 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.287 -0.883 . . . . 0.0 110.106 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.5 p -158.17 -72.72 0.09 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.235 -0.916 . . . . 0.0 110.328 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.0 m -154.39 -75.14 0.11 Allowed 'General case' 0 C--N 1.292 -1.9 0 O-C-N 121.666 -0.646 . . . . 0.0 110.162 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -62.26 -12.1 18.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.881 . . . . 0.0 110.231 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.1 tpt -91.38 19.41 6.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.202 -0.936 . . . . 0.0 110.185 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.403 ' OD1' ' HB3' ' A' ' 6' ' ' CYS . 4.4 m-20 -126.39 81.09 1.97 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.285 -0.884 . . . . 0.0 110.221 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.09 59.92 0.43 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.516 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 63.8 t80 -160.11 -55.43 0.06 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.283 -1.128 . . . . 0.0 110.253 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.4 p -96.46 118.92 33.98 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.3 -0.875 . . . . 0.0 110.567 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.521 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 6.1 mt -90.66 -47.37 7.7 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.259 -0.901 . . . . 0.0 110.215 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 10.1 m80 -106.78 82.28 1.68 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.37 -0.831 . . . . 0.0 110.201 -179.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 178.08 -171.02 43.44 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.4 mm-40 -109.36 133.48 53.01 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.198 -1.177 . . . . 0.0 110.168 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -87.61 135.18 33.46 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.315 -0.865 . . . . 0.0 110.184 179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.641 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 26.9 pt -157.46 -168.07 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.214 -0.929 . . . . 0.0 110.235 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.558 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 8.4 t80 -141.3 139.44 33.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.209 -0.932 . . . . 0.0 110.004 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.604 HD22 ' CD2' ' A' ' 29' ' ' TYR . 0.7 OUTLIER -94.92 137.39 34.05 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.229 -0.919 . . . . 0.0 110.979 -179.525 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.457 ' HB ' ' O ' ' A' ' 2' ' ' SER . 8.3 p -90.14 -27.23 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.346 -0.846 . . . . 0.0 110.371 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.409 ' O ' ' SD ' ' A' ' 25' ' ' MET . 42.1 t0 -78.36 -15.42 58.72 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.165 -0.959 . . . . 0.0 108.814 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.2 OUTLIER -145.08 65.03 1.27 Allowed 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 179.01 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.558 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 49.7 p -29.41 87.72 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 121.623 0.725 . . . . 0.0 111.753 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 25' ' ' MET . 4.1 pt20 -160.89 175.79 12.14 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.584 -0.698 . . . . 0.0 109.544 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -82.18 111.24 18.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 110.339 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.641 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 10.0 t80 -100.11 118.75 37.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.343 -0.848 . . . . 0.0 109.706 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 20.7 m -119.66 111.51 18.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.06 -1.025 . . . . 0.0 110.641 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.465 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 13.5 tpp180 -81.03 117.88 22.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.195 -0.94 . . . . 0.0 109.485 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 98.0 m -79.37 170.47 16.55 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 110.349 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -79.61 114.0 18.2 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.322 -0.861 . . . . 0.0 110.183 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 44.2 t -47.21 100.86 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.328 -0.858 . . . . 0.0 109.802 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 149.47 -13.37 1.05 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.711 -1.356 . . . . 0.0 109.711 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.2 m-85 -79.19 170.43 16.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.2 -1.177 . . . . 0.0 109.631 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.584 HG21 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -109.98 32.79 4.83 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.829 -1.169 . . . . 0.0 110.886 -179.67 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.65 159.9 31.37 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.0 p -88.8 33.59 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.234 -1.156 . . . . 0.0 109.482 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.555 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.6 OUTLIER -142.91 17.89 1.96 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.461 -0.774 . . . . 0.0 109.595 -179.602 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 2.2 p 27.83 86.81 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.123 0 CA-C-O 121.442 0.639 . . . . 0.0 111.131 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.555 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 12.4 tm-20 -151.81 -34.79 0.13 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.451 -0.781 . . . . 0.0 110.4 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.584 ' CE1' HG21 ' A' ' 37' ' ' THR . 6.2 p80 -120.91 117.64 27.85 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.034 -1.041 . . . . 0.0 110.364 179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.595 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 28.0 t80 -80.23 109.38 14.65 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.313 0.578 . . . . 0.0 109.991 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.567 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -70.45 -16.69 62.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.91 . . . . 0.0 109.682 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.595 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.7 mt . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.279 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.496 ' O ' ' CG1' ' A' ' 1' ' ' VAL . 9.5 p . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.212 0.529 . . . . 0.0 110.235 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.443 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER -139.01 177.69 7.71 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.335 -0.853 . . . . 0.0 109.91 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.52 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.0 OUTLIER -155.78 165.13 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.347 -0.846 . . . . 0.0 110.209 -179.887 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.471 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 2.8 m -142.13 166.02 25.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.938 . . . . 0.0 110.027 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -85.72 163.21 18.37 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -0.875 . . . . 0.0 110.265 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 21.3 m -93.92 -145.17 0.24 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.231 -0.918 . . . . 0.0 110.209 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.0 t -151.94 -150.2 0.33 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 110.092 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.436 ' O ' ' N ' ' A' ' 10' ' ' MET . 0.3 OUTLIER -84.37 168.71 15.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.291 -0.88 . . . . 0.0 110.209 179.881 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 8' ' ' SER . 0.4 OUTLIER 42.12 27.15 0.07 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.267 -0.896 . . . . 0.0 110.231 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.453 ' SD ' ' HB3' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -122.68 -4.15 8.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.176 -0.953 . . . . 0.0 110.229 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -116.84 69.73 0.76 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.276 -0.89 . . . . 0.0 110.209 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -129.82 29.56 3.73 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.515 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 47.0 t80 -124.47 -57.25 1.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.333 -1.098 . . . . 0.0 110.295 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.7 p -91.45 122.75 34.32 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.283 -0.885 . . . . 0.0 110.34 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.536 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 5.6 mt -90.44 -45.46 8.97 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.259 -0.901 . . . . 0.0 110.238 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.536 ' ND1' ' HB2' ' A' ' 15' ' ' LEU . 7.1 m80 -109.07 87.44 2.49 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.309 -0.869 . . . . 0.0 110.159 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.468 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 177.98 -175.58 47.57 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -107.99 137.83 45.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.204 -1.174 . . . . 0.0 110.253 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.5 t -86.72 139.6 30.59 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.0 110.225 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.644 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 24.2 pt -157.33 -173.19 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.249 -0.907 . . . . 0.0 109.96 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.471 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 5.7 t80 -144.64 128.54 17.41 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.141 -0.975 . . . . 0.0 110.306 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.539 ' HG ' ' HB2' ' A' ' 29' ' ' TYR . 15.9 mt -79.54 133.55 36.47 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.339 -0.851 . . . . 0.0 110.779 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.482 HG12 ' N ' ' A' ' 24' ' ' ASP . 12.4 p -89.5 -30.91 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.889 . . . . 0.0 109.916 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.482 ' N ' HG12 ' A' ' 23' ' ' VAL . 50.5 m-20 -78.49 -20.07 51.65 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.136 -0.978 . . . . 0.0 108.684 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.558 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.0 mtm -136.78 61.72 1.62 Allowed 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 25' ' ' MET . 35.0 p -29.37 87.68 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 CA-C-O 121.7 0.762 . . . . 0.0 111.508 -178.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -160.64 148.17 15.89 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.473 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.7 t30 -62.62 114.97 3.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.196 -0.94 . . . . 0.0 110.304 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.644 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 4.1 t80 -106.54 121.78 44.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.408 -0.808 . . . . 0.0 109.687 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 19.9 m -117.52 112.12 20.17 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.078 -1.014 . . . . 0.0 110.478 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.468 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 1.9 tpp180 -81.89 117.52 22.21 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.207 -0.933 . . . . 0.0 109.635 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 65.8 m -79.36 170.85 15.99 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.229 -0.919 . . . . 0.0 110.488 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -79.46 113.16 17.38 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.335 -0.853 . . . . 0.0 110.194 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.5 t -48.67 106.71 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.44 -0.787 . . . . 0.0 109.955 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.26 -10.92 2.26 Favored Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -79.53 177.14 9.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.177 -1.19 . . . . 0.0 109.975 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.652 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -110.12 -43.26 3.99 Favored 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 118.732 -1.187 . . . . 0.0 111.21 -179.524 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.59 158.79 43.68 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.269 -1.532 . . . . 0.0 109.269 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.491 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 80.9 t -84.7 44.45 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.247 -1.149 . . . . 0.0 109.513 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.564 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -160.28 26.65 0.17 Allowed 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.481 -0.762 . . . . 0.0 109.61 -179.372 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 10.9 p 30.78 93.12 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.512 -0.743 . . . . 0.0 111.335 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.549 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 6.6 tm-20 -160.17 -42.7 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 110.388 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.652 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 0.2 OUTLIER -120.1 136.73 54.49 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 122.177 0.989 . . . . 0.0 110.8 -179.76 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.586 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 69.4 t80 -97.32 137.09 36.85 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.142 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.586 ' O ' ' CG ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -121.77 13.11 10.69 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 110.605 -179.431 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.586 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.6 mt . . . . . 0 N--CA 1.492 1.639 0 O-C-N 120.938 -1.101 . . . . 0.0 110.303 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 34.2 m . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 121.325 0.584 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.471 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 4.9 t -157.05 71.08 0.65 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.264 -0.897 . . . . 0.0 110.11 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.531 ' CG1' ' CG2' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.73 150.8 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.91 . . . . 0.0 110.34 -179.78 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.3 m -131.41 170.74 14.25 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.388 -0.82 . . . . 0.0 110.205 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -109.26 179.6 4.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.214 -0.929 . . . . 0.0 110.185 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.3 m -106.92 -154.58 0.52 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 110.355 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.0 t -136.23 -145.72 0.22 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.095 -1.003 . . . . 0.0 110.647 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 41.2 t -79.79 -70.67 0.5 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.31 -0.869 . . . . 0.0 110.421 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -76.33 2.96 11.96 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.264 -0.897 . . . . 0.0 110.366 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.18 14.95 25.88 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.13 -0.981 . . . . 0.0 110.191 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -140.95 120.08 12.87 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.31 -0.869 . . . . 0.0 110.245 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.48 62.57 0.19 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.572 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 52.1 t80 -151.45 -57.11 0.15 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.273 -1.134 . . . . 0.0 110.145 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 23.5 p -85.66 124.85 32.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.263 -0.898 . . . . 0.0 110.319 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.573 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.6 mt -89.99 -42.53 11.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.273 -0.892 . . . . 0.0 110.256 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.579 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 8.7 m80 -113.91 92.85 4.12 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.281 -0.887 . . . . 0.0 110.147 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.459 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 167.53 -132.6 2.64 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 0.8 OUTLIER -158.81 149.49 19.98 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -1.103 . . . . 0.0 110.285 -179.945 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -89.68 146.2 24.69 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.297 -0.877 . . . . 0.0 110.364 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.531 ' CG2' ' CG1' ' A' ' 3' ' ' ILE . 1.1 mt -153.03 -166.54 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.296 -0.877 . . . . 0.0 109.579 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.473 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 16.7 t80 -152.65 125.7 8.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.088 -1.007 . . . . 0.0 110.135 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.576 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.3 mm? -88.44 132.22 34.56 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.2 -0.937 . . . . 0.0 110.611 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 2' ' ' SER . 9.4 p -90.38 -24.11 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.243 -0.911 . . . . 0.0 110.462 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.51 -13.69 59.71 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.107 -0.996 . . . . 0.0 108.703 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.537 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.0 tpp -150.0 67.88 0.99 Allowed 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 25' ' ' MET . 12.5 p -29.28 89.44 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.715 0.769 . . . . 0.0 111.536 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.11 147.85 16.58 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.725 -0.609 . . . . 0.0 109.377 179.9 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.507 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 10.8 m-20 -59.79 127.92 34.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.157 -0.964 . . . . 0.0 110.248 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.576 ' CD2' HD23 ' A' ' 22' ' ' LEU . 8.7 t80 -117.82 109.94 17.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.269 -0.894 . . . . 0.0 110.207 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -112.76 110.23 20.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.23 -0.919 . . . . 0.0 110.163 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.459 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -81.4 123.76 28.84 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.23 -0.919 . . . . 0.0 109.817 179.585 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 78.7 m -79.73 178.58 8.06 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.324 -0.86 . . . . 0.0 110.251 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -80.69 114.74 19.79 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.25 -0.906 . . . . 0.0 110.176 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.4 t -47.33 103.0 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.334 -0.854 . . . . 0.0 109.796 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 145.4 -11.46 1.77 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.579 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.9 OUTLIER -79.54 167.38 20.84 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.127 -1.219 . . . . 0.0 109.923 179.994 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.591 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -108.21 33.96 3.86 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.048 -1.032 . . . . 0.0 110.555 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.5 156.32 27.6 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.6 p -87.51 33.27 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.2 -1.176 . . . . 0.0 109.834 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.572 ' HG3' ' CE1' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -148.68 20.02 1.03 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.349 -0.845 . . . . 0.0 109.677 -179.65 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.1 p 30.77 94.42 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.65 0.738 . . . . 0.0 111.603 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.562 ' CB ' ' CZ ' ' A' ' 40' ' ' ARG . 6.2 tm-20 -153.8 -36.69 0.1 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.551 -0.718 . . . . 0.0 109.96 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.591 ' CE1' HG23 ' A' ' 37' ' ' THR . 4.8 p80 -122.82 116.28 23.41 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.233 -0.917 . . . . 0.0 109.624 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.604 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 23.9 t80 -79.62 107.94 12.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.763 -0.586 . . . . 0.0 110.486 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.552 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -67.43 -30.55 70.32 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.397 -0.814 . . . . 0.0 109.428 179.663 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.604 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.5 mt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.188 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.229 0.537 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.537 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -136.23 137.77 41.15 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.204 -0.935 . . . . 0.0 110.225 179.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.543 HG12 ' CG2' ' A' ' 20' ' ' ILE . 1.1 tp -144.18 154.47 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.305 -0.872 . . . . 0.0 110.16 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.506 ' O ' ' N ' ' A' ' 21' ' ' TYR . 3.1 m -140.47 168.19 20.37 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.262 -0.898 . . . . 0.0 110.119 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.44 179.55 6.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.176 -0.953 . . . . 0.0 110.302 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 86.4 m -105.22 164.76 11.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.262 -0.898 . . . . 0.0 110.276 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.8 t -102.34 -152.38 0.44 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.326 -0.859 . . . . 0.0 110.141 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.414 ' O ' ' N ' ' A' ' 10' ' ' MET . 0.8 OUTLIER -83.81 171.55 13.02 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.34 -0.85 . . . . 0.0 110.076 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 8' ' ' SER . 3.0 t0 42.42 27.87 0.1 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.185 -0.947 . . . . 0.0 110.191 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.414 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -126.21 3.99 7.1 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.276 -0.89 . . . . 0.0 110.15 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -110.35 86.73 2.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.263 -0.898 . . . . 0.0 110.265 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.01 64.64 0.39 Allowed Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -154.19 -60.62 0.13 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.263 -1.139 . . . . 0.0 110.165 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.4 p -96.28 117.18 30.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.278 -0.889 . . . . 0.0 110.43 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.562 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.3 mt -69.22 -42.66 75.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.49 -0.756 . . . . 0.0 109.784 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.565 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 4.3 m80 -117.25 80.63 1.52 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.439 -0.788 . . . . 0.0 110.388 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.416 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -177.33 152.76 12.39 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.211 -1.556 . . . . 0.0 109.211 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.53 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -80.85 169.81 17.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.125 -1.22 . . . . 0.0 110.563 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -107.22 130.12 54.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.241 -0.912 . . . . 0.0 110.798 -179.579 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.592 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -132.79 -165.89 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.363 -0.836 . . . . 0.0 109.494 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.506 ' N ' ' O ' ' A' ' 4' ' ' THR . 12.5 t80 -149.57 135.16 18.49 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.054 -1.029 . . . . 0.0 109.871 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.566 HD21 ' CD1' ' A' ' 29' ' ' TYR . 1.2 mm? -95.77 134.05 39.16 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.15 -0.969 . . . . 0.0 111.234 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.537 HG11 ' CB ' ' A' ' 2' ' ' SER . 7.0 p -90.73 -25.16 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.434 -0.791 . . . . 0.0 110.385 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.528 ' N ' HG13 ' A' ' 23' ' ' VAL . 5.1 m-20 -78.88 -14.53 59.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.096 -1.003 . . . . 0.0 108.82 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.548 ' O ' ' N ' ' A' ' 27' ' ' GLN . 5.5 ttm -147.31 67.38 1.14 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 25' ' ' MET . 17.2 p -29.81 87.68 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.599 0.714 . . . . 0.0 111.922 -178.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.0 OUTLIER -157.83 170.67 21.81 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.67 -0.644 . . . . 0.0 109.782 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -79.4 125.18 29.2 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.413 -0.804 . . . . 0.0 110.582 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.566 ' CD1' HD21 ' A' ' 22' ' ' LEU . 30.1 t80 -105.7 167.49 9.73 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.392 -0.817 . . . . 0.0 109.46 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.4 m -152.13 117.66 5.35 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.028 -1.045 . . . . 0.0 110.683 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.53 ' HB3' ' CG ' ' A' ' 18' ' ' GLN . 4.8 tpp85 -84.89 125.79 32.93 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.104 -0.998 . . . . 0.0 108.896 179.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.3 m -79.69 163.62 24.39 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.129 -0.982 . . . . 0.0 110.334 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.508 ' O ' ' N ' ' A' ' 35' ' ' GLY . 10.2 tt0 -78.19 111.91 14.62 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.754 -0.779 . . . . 0.0 109.287 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.434 ' C ' ' O ' ' A' ' 33' ' ' GLU . 35.3 t -41.86 94.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.578 -0.701 . . . . 0.0 109.985 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 153.73 -17.2 0.65 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.565 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.6 m-85 -79.37 167.92 20.2 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.081 -1.247 . . . . 0.0 109.92 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.593 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -113.86 37.01 3.41 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.139 -1.025 . . . . 0.0 110.924 -179.491 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.91 157.38 28.87 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.7 p -88.99 27.56 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.277 -1.131 . . . . 0.0 109.551 179.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.539 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 12.1 ttp180 -127.16 -18.87 4.46 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.539 -0.726 . . . . 0.0 110.276 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.7 m 68.45 78.83 0.22 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.156 -0.965 . . . . 0.0 109.829 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.539 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -152.18 -32.56 0.14 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.473 -0.767 . . . . 0.0 110.984 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.593 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.6 p80 -123.17 118.95 28.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.894 -1.129 . . . . 0.0 110.922 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.596 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 40.6 t80 -81.64 105.18 12.58 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.322 0.582 . . . . 0.0 109.798 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.539 ' CB ' HG21 ' A' ' 37' ' ' THR . 0.0 OUTLIER -64.78 -27.37 68.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.288 -0.883 . . . . 0.0 110.095 -179.567 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.596 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.7 mt . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.348 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 1' ' ' VAL . 59.2 t . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.195 0.521 . . . . 0.0 110.218 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.9 t -154.89 138.91 16.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.246 -0.909 . . . . 0.0 110.41 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.533 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.9 tt -121.19 152.79 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.315 -0.865 . . . . 0.0 110.063 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.468 ' CB ' ' HB3' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -110.01 169.69 8.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.902 . . . . 0.0 110.271 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -117.87 159.69 22.67 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.285 -0.884 . . . . 0.0 110.103 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 61.4 m -110.65 -151.26 0.47 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.113 -0.992 . . . . 0.0 110.34 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.7 t -152.99 -151.07 0.36 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.291 -0.88 . . . . 0.0 110.086 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.42 ' O ' ' C ' ' A' ' 9' ' ' ASP . 79.2 p -86.99 165.38 15.89 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.182 -0.949 . . . . 0.0 110.119 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.42 ' C ' ' O ' ' A' ' 8' ' ' SER . 2.2 m-20 41.48 31.01 0.16 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.214 -0.929 . . . . 0.0 110.301 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.78 -14.38 9.01 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.344 -0.847 . . . . 0.0 110.362 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -148.65 107.4 3.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.0 110.428 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -104.44 52.82 0.72 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.336 -1.506 . . . . 0.0 109.336 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -126.58 -55.37 1.42 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -1.106 . . . . 0.0 110.447 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.3 p -96.59 117.23 30.52 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.132 -0.98 . . . . 0.0 110.619 -179.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.59 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 14.4 mt -82.26 -39.52 22.89 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.365 -0.835 . . . . 0.0 109.839 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.6 m80 -121.41 84.35 2.23 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.443 -0.786 . . . . 0.0 110.243 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -177.02 175.8 47.82 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -93.22 141.49 28.37 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.269 -1.136 . . . . 0.0 110.276 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 7.9 t -98.79 124.12 43.46 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.353 -0.842 . . . . 0.0 110.144 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.59 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.55 -173.7 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.389 -0.82 . . . . 0.0 110.141 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.469 ' O ' HG13 ' A' ' 3' ' ' ILE . 10.8 t80 -138.99 136.53 35.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.832 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.601 HD21 ' CD2' ' A' ' 29' ' ' TYR . 1.3 mm? -92.41 133.94 35.41 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.02 -1.05 . . . . 0.0 111.009 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.1 p -90.46 -27.7 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.356 -0.84 . . . . 0.0 110.563 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -78.36 -17.79 56.0 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.082 -1.011 . . . . 0.0 108.964 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.548 ' O ' ' N ' ' A' ' 27' ' ' GLN . 14.8 mtt -142.62 64.9 1.36 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.48 ' C ' ' O ' ' A' ' 25' ' ' MET . 11.8 p -29.18 88.69 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.716 0.769 . . . . 0.0 111.553 -178.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.7 pt20 -160.32 171.8 18.48 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.655 -0.653 . . . . 0.0 109.636 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -80.08 122.7 27.1 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.385 -0.822 . . . . 0.0 110.478 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.601 ' CD2' HD21 ' A' ' 22' ' ' LEU . 5.3 t80 -113.07 129.75 56.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.507 -0.746 . . . . 0.0 109.429 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.7 m -129.84 113.32 14.52 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.99 -1.069 . . . . 0.0 110.874 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -79.57 133.38 36.45 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.282 -0.886 . . . . 0.0 109.097 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 10.8 m -78.99 160.26 27.27 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.235 -0.916 . . . . 0.0 109.985 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.516 ' O ' ' N ' ' A' ' 35' ' ' GLY . 12.1 tt0 -78.54 112.99 16.17 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.294 -0.879 . . . . 0.0 109.023 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.436 ' C ' ' O ' ' A' ' 33' ' ' GLU . 24.0 t -40.76 94.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.586 -0.696 . . . . 0.0 110.3 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 153.41 -18.89 0.7 Allowed Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 3.6 m-85 -82.2 166.19 19.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -1.162 . . . . 0.0 109.902 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.583 HG23 ' CE1' ' A' ' 43' ' ' HIS . 9.1 t -121.38 47.81 1.78 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.973 -1.079 . . . . 0.0 111.158 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.63 157.62 29.07 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.7 p -88.59 23.83 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.345 -1.091 . . . . 0.0 109.421 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.558 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 11.2 ttp180 -126.51 -19.66 4.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.578 -0.701 . . . . 0.0 110.291 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.8 m 68.18 68.54 0.33 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.12 -0.987 . . . . 0.0 110.263 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.558 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 5.3 tm-20 -137.99 -27.87 0.89 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.367 -0.833 . . . . 0.0 110.992 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.583 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.4 p80 -126.95 121.82 32.81 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.762 -1.211 . . . . 0.0 111.111 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.603 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.3 t80 -83.16 101.18 11.03 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.528 ' CB ' HG21 ' A' ' 37' ' ' THR . 0.1 OUTLIER -64.31 -14.33 55.4 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.208 -0.933 . . . . 0.0 110.149 -179.362 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.603 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 6.9 mt . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.228 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.53 ' HA ' ' CG1' ' A' ' 23' ' ' VAL . 11.3 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.258 0.551 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.498 ' N ' HG12 ' A' ' 23' ' ' VAL . 2.8 m -92.16 105.11 17.41 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.224 -0.923 . . . . 0.0 110.646 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.588 ' CD1' ' CG2' ' A' ' 20' ' ' ILE . 0.9 OUTLIER -80.11 164.6 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.245 -0.91 . . . . 0.0 109.873 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.512 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 2.3 m -148.7 166.34 28.67 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.11 -0.994 . . . . 0.0 110.259 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.65 162.02 13.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.234 -0.916 . . . . 0.0 110.163 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.8 m -93.19 -150.25 0.28 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.266 -0.896 . . . . 0.0 110.194 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 t -147.37 -155.42 0.62 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.264 -0.898 . . . . 0.0 110.22 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.34 172.11 14.19 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.29 -0.881 . . . . 0.0 110.205 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.5 t0 47.83 23.71 0.49 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.218 -0.926 . . . . 0.0 110.276 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.14 9.65 6.26 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.255 -0.903 . . . . 0.0 110.234 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.403 ' OD1' ' SG ' ' A' ' 14' ' ' CYS . 0.9 OUTLIER -119.52 76.84 1.16 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -0.912 . . . . 0.0 110.402 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -121.74 -8.95 7.21 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -91.67 -49.19 6.42 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.252 -1.146 . . . . 0.0 110.165 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.0 p -101.46 121.13 41.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.405 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.573 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.4 mt -90.03 -40.18 12.47 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -0.927 . . . . 0.0 110.402 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.573 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.6 m80 -114.19 89.93 3.22 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.204 -0.935 . . . . 0.0 110.12 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.46 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 171.1 -167.1 40.27 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -117.68 162.85 17.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.368 -1.078 . . . . 0.0 110.298 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -98.16 137.97 36.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.262 -0.899 . . . . 0.0 110.185 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.588 ' CG2' ' CD1' ' A' ' 3' ' ' ILE . 15.9 mm -142.38 172.71 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.319 -0.863 . . . . 0.0 110.169 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.512 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 32.1 t80 -134.4 136.02 43.02 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.103 -0.998 . . . . 0.0 109.849 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.562 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 3.4 mm? -99.54 132.37 44.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.019 -1.051 . . . . 0.0 111.043 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.53 ' CG1' ' HA ' ' A' ' 1' ' ' VAL . 11.5 p -90.77 -24.58 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.6 -0.688 . . . . 0.0 110.722 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.498 ' N ' HG11 ' A' ' 23' ' ' VAL . 13.3 m-20 -78.05 -15.14 59.17 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.027 -1.046 . . . . 0.0 108.801 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.544 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -147.17 67.17 1.14 Allowed 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.641 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.492 ' C ' ' O ' ' A' ' 25' ' ' MET . 61.9 p -28.97 88.63 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.762 0.792 . . . . 0.0 111.403 -178.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.65 149.0 16.36 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.974 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.517 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.5 t30 -59.3 157.33 11.02 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.303 -0.873 . . . . 0.0 109.886 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.582 ' CD1' ' N ' ' A' ' 30' ' ' CYS . 12.9 t80 -138.87 159.77 41.34 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.312 -0.867 . . . . 0.0 109.699 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 28.6 m -153.47 107.61 3.06 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.07 -1.019 . . . . 0.0 110.595 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.468 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 1.3 tpp180 -82.43 121.35 26.62 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.252 -0.905 . . . . 0.0 109.468 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 75.8 m -79.46 170.75 16.12 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.219 -0.926 . . . . 0.0 110.549 -179.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -79.51 114.47 18.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.399 -0.813 . . . . 0.0 110.052 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 47.2 t -47.54 103.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.392 -0.818 . . . . 0.0 109.75 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 145.93 -10.66 1.62 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.477 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.39 176.16 9.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.112 -1.228 . . . . 0.0 109.84 179.905 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.625 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -115.03 31.56 6.61 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.98 -1.075 . . . . 0.0 110.878 -179.432 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.26 159.84 31.17 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.7 p -86.98 37.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -1.122 . . . . 0.0 109.545 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.579 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -150.7 15.06 0.76 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.463 -0.773 . . . . 0.0 110.005 -179.441 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 9.4 p 32.67 87.19 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.67 -0.644 . . . . 0.0 110.6 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.579 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 1.5 tt0 -151.2 -38.76 0.12 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.403 -0.81 . . . . 0.0 110.286 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.625 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.6 p-80 -120.53 128.5 53.16 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.04 -1.038 . . . . 0.0 110.703 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 25.0 t80 -86.76 128.3 35.02 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.424 0.63 . . . . 0.0 110.155 -178.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.593 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -95.38 6.26 49.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.429 -0.794 . . . . 0.0 110.118 -179.391 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 C--N 1.302 -1.48 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.443 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 121.278 0.561 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.453 ' HB3' HG12 ' A' ' 23' ' ' VAL . 1.3 t -82.47 96.79 8.12 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.238 -0.914 . . . . 0.0 110.287 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.535 HD11 ' CD1' ' A' ' 20' ' ' ILE . 0.9 OUTLIER -122.56 152.91 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.308 -0.87 . . . . 0.0 110.139 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.513 ' N ' HG13 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -125.97 172.78 9.65 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.229 -0.919 . . . . 0.0 110.267 -179.972 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.91 166.25 12.27 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.244 -0.91 . . . . 0.0 110.19 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 21.6 m -92.8 -143.76 0.22 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.211 -0.931 . . . . 0.0 110.186 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 t -137.12 -178.85 5.39 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 110.131 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.6 m -81.76 8.56 9.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.25 -0.906 . . . . 0.0 110.171 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -125.84 21.49 7.59 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.243 -0.911 . . . . 0.0 110.238 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.67 21.86 2.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.226 -0.922 . . . . 0.0 110.188 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.428 ' OD1' ' SG ' ' A' ' 19' ' ' CYS . 72.1 m-20 -113.58 91.33 3.6 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.224 -0.922 . . . . 0.0 110.163 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -158.99 49.4 0.41 Allowed Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -144.98 -65.75 0.33 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -1.145 . . . . 0.0 110.191 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.601 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.6 p -83.64 125.68 32.08 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.224 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.575 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -89.48 -41.4 12.08 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.19 -0.944 . . . . 0.0 110.369 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.575 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.7 m80 -112.5 77.21 1.03 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.117 -0.989 . . . . 0.0 110.209 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -170.08 178.5 42.87 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -107.19 140.08 40.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.295 -1.121 . . . . 0.0 110.36 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -82.28 139.85 33.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.218 -0.927 . . . . 0.0 109.965 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.637 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 26.3 pt -156.21 -163.58 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.199 -0.938 . . . . 0.0 110.205 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.576 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 5.3 t80 -153.48 141.61 20.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.156 -0.965 . . . . 0.0 109.882 -179.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.598 HD21 ' CD2' ' A' ' 29' ' ' TYR . 1.7 mm? -92.48 136.02 33.57 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.187 -0.946 . . . . 0.0 110.875 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.453 HG12 ' HB3' ' A' ' 2' ' ' SER . 7.7 p -90.94 -27.81 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.387 -0.821 . . . . 0.0 110.706 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' A' ' 25' ' ' MET . 58.3 p30 -78.46 -12.85 60.03 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.91 -1.118 . . . . 0.0 109.002 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 51.2 mtt -147.98 65.82 1.1 Allowed 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.576 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 69.0 p -29.68 89.25 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.703 0.763 . . . . 0.0 111.51 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.26 147.88 16.36 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.864 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.516 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 20.4 p30 -58.36 132.92 55.11 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.127 -0.983 . . . . 0.0 110.141 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.637 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 10.3 t80 -128.27 123.25 33.66 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.316 -0.865 . . . . 0.0 110.276 -179.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.601 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.7 m -113.74 115.2 27.44 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.09 -1.006 . . . . 0.0 110.172 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -86.18 100.6 12.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.13 -0.981 . . . . 0.0 109.569 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 86.6 m -79.52 172.68 13.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.319 -0.863 . . . . 0.0 110.239 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -79.53 127.64 32.38 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.324 -0.86 . . . . 0.0 109.859 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.9 t -71.49 -13.64 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.353 -0.842 . . . . 0.0 110.236 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -74.85 -7.45 80.86 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.535 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -79.78 177.5 8.85 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.183 -1.187 . . . . 0.0 110.091 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.615 HG22 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.59 27.57 9.52 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.922 -1.112 . . . . 0.0 110.13 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -159.07 157.76 28.81 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.321 -1.512 . . . . 0.0 109.321 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.531 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 67.1 t -84.84 43.52 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.186 -1.185 . . . . 0.0 109.705 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.533 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -155.85 16.26 0.36 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.274 -0.891 . . . . 0.0 110.258 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 9.0 p 32.17 89.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.59 -0.694 . . . . 0.0 110.639 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.533 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 1.8 tt0 -155.95 -41.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.326 -0.859 . . . . 0.0 110.121 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.615 ' CE1' HG22 ' A' ' 37' ' ' THR . 1.4 p-80 -118.37 126.36 51.94 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.066 -1.022 . . . . 0.0 110.512 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.591 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.4 t80 -87.5 129.02 35.22 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.553 -0.717 . . . . 0.0 109.986 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.549 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -92.64 -32.43 14.77 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.432 -0.793 . . . . 0.0 110.091 -179.412 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.591 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.8 mt . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.313 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 55.0 t . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.256 0.55 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.456 ' HB3' HG13 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -120.53 61.8 0.87 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.224 -0.922 . . . . 0.0 110.221 179.939 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.524 ' CD1' ' HB ' ' A' ' 20' ' ' ILE . 0.9 OUTLIER -109.86 149.94 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.254 -0.904 . . . . 0.0 110.247 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.454 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -115.53 179.46 3.96 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.256 -0.903 . . . . 0.0 110.215 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.62 170.81 8.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.242 -0.911 . . . . 0.0 110.199 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 97.8 m -108.48 -167.98 1.3 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.249 -0.907 . . . . 0.0 110.352 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.4 t -130.12 -138.97 0.22 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.058 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 33.0 t -79.71 5.61 12.95 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.09 -1.006 . . . . 0.0 110.133 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -97.33 8.7 44.06 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.283 -0.886 . . . . 0.0 110.018 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.453 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 22.3 ptt? -79.59 -14.06 59.08 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.323 -0.86 . . . . 0.0 110.455 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -107.96 90.15 3.21 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.21 -0.931 . . . . 0.0 110.087 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -171.4 -35.43 0.03 OUTLIER Glycine 0 N--CA 1.487 2.096 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -107.99 -62.82 1.39 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.219 -1.165 . . . . 0.0 110.418 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.601 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.1 p -87.31 117.93 26.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.196 -0.94 . . . . 0.0 110.483 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.577 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.3 mt -78.88 -42.8 26.4 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.293 -0.88 . . . . 0.0 109.985 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.579 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 4.4 m80 -119.32 86.75 2.61 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.416 -0.803 . . . . 0.0 110.368 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.46 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -179.47 171.1 42.83 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -96.86 162.7 13.29 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.239 -1.153 . . . . 0.0 110.495 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -109.78 132.15 54.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.368 -0.833 . . . . 0.0 110.532 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.524 ' HB ' ' CD1' ' A' ' 3' ' ' ILE . 0.1 OUTLIER -147.3 167.91 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.4 -0.812 . . . . 0.0 109.932 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.493 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 7.0 t80 -120.04 120.44 36.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.131 -0.981 . . . . 0.0 110.178 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.577 HD12 ' CD2' ' A' ' 29' ' ' TYR . 11.1 mt -83.7 136.1 34.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.154 -0.966 . . . . 0.0 110.862 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.503 HG11 ' N ' ' A' ' 24' ' ' ASP . 14.8 p -88.66 -29.5 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.466 -0.771 . . . . 0.0 110.1 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.503 ' N ' HG11 ' A' ' 23' ' ' VAL . 44.3 t0 -78.63 -21.86 47.81 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.178 -0.951 . . . . 0.0 108.752 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.574 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -134.34 61.13 1.68 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 178.65 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.47 ' C ' ' O ' ' A' ' 25' ' ' MET . 7.3 p -28.89 85.53 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.523 0.678 . . . . 0.0 111.906 -178.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.574 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -161.35 164.74 29.84 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.613 -0.679 . . . . 0.0 109.633 179.522 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -79.51 91.95 5.22 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.407 -0.808 . . . . 0.0 109.701 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.577 ' CD2' HD12 ' A' ' 22' ' ' LEU . 5.9 t80 -79.8 135.6 36.52 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.414 -0.804 . . . . 0.0 109.826 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.601 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -122.23 117.11 25.38 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.092 -1.005 . . . . 0.0 110.591 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.46 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -80.41 136.74 36.41 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.177 -0.952 . . . . 0.0 109.413 179.16 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.632 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 6.3 m -80.38 166.25 21.46 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.178 -0.951 . . . . 0.0 109.764 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.521 ' O ' ' N ' ' A' ' 35' ' ' GLY . 17.9 tt0 -78.41 110.06 13.14 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.122 -0.986 . . . . 0.0 108.772 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' A' ' 33' ' ' GLU . 26.0 t -37.49 93.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 CA-C-O 121.422 0.63 . . . . 0.0 110.412 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 149.87 -15.17 1.04 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.579 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.5 m-85 -80.51 173.95 12.09 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.177 -1.19 . . . . 0.0 110.198 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.592 ' CG2' ' CB ' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -125.47 45.68 2.54 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.055 -1.028 . . . . 0.0 110.835 -179.745 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.03 153.42 24.39 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.3 p -88.23 20.03 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.269 -1.136 . . . . 0.0 109.761 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.594 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 3.1 tmm_? -125.25 -16.78 5.85 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.442 -0.787 . . . . 0.0 110.073 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.632 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.8 m 69.79 83.76 0.15 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.312 -0.868 . . . . 0.0 109.919 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.594 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -156.72 -31.11 0.09 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.388 -0.82 . . . . 0.0 111.247 -179.738 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.589 ' CE1' HG21 ' A' ' 37' ' ' THR . 4.2 p80 -123.89 123.65 40.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.634 -1.291 . . . . 0.0 111.084 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.605 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 28.1 t80 -82.9 105.82 14.21 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.129 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -65.03 -16.16 63.14 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.187 -0.945 . . . . 0.0 109.778 -179.781 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.605 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.7 mt . . . . . 0 N--CA 1.488 1.459 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.28 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 75.3 t . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 121.248 0.547 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.503 ' CB ' HG13 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -94.28 108.1 20.0 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 110.239 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.532 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 2.5 tt -133.44 161.16 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.296 -0.877 . . . . 0.0 110.194 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.449 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.2 OUTLIER -126.94 -177.99 4.24 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.209 -0.932 . . . . 0.0 110.326 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.77 171.24 7.61 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.226 -0.921 . . . . 0.0 110.275 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 64.4 m -107.25 -163.08 0.88 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.286 -0.884 . . . . 0.0 110.223 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.56 -167.08 1.67 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.322 -0.861 . . . . 0.0 110.207 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.6 t -83.61 9.27 11.89 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.164 -0.96 . . . . 0.0 110.31 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -134.36 26.09 3.8 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.226 -0.921 . . . . 0.0 110.334 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 ttm -143.94 16.03 1.74 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.262 -0.899 . . . . 0.0 110.217 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.1 p-10 -111.75 57.87 0.63 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -0.906 . . . . 0.0 110.279 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -110.81 62.12 0.29 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.428 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 64.2 t80 -160.18 -50.27 0.05 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.381 -1.07 . . . . 0.0 110.196 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -104.39 119.89 39.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.346 -0.846 . . . . 0.0 110.324 -179.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.521 HD21 ' N ' ' A' ' 15' ' ' LEU . 5.6 mt -90.49 -48.29 7.19 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.228 -0.92 . . . . 0.0 110.127 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.577 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 11.2 m80 -103.73 69.39 0.97 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.368 -0.833 . . . . 0.0 110.25 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -174.14 -170.59 37.62 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -114.84 137.59 51.78 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.199 -1.177 . . . . 0.0 110.337 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -85.31 146.91 26.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.262 -0.899 . . . . 0.0 110.045 179.801 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.537 ' CG2' ' O ' ' A' ' 19' ' ' CYS . 8.1 pt -159.46 -174.57 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.282 -0.886 . . . . 0.0 110.272 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 5.9 t80 -135.97 120.54 18.24 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.283 -0.885 . . . . 0.0 109.825 179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.522 HD12 ' CD2' ' A' ' 29' ' ' TYR . 13.2 mt -79.71 131.69 36.01 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.242 -0.911 . . . . 0.0 110.975 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.503 HG13 ' CB ' ' A' ' 2' ' ' SER . 7.7 p -87.49 -27.98 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 109.839 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.461 ' N ' HG11 ' A' ' 23' ' ' VAL . 3.9 m-20 -78.65 -20.63 49.84 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 108.739 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.562 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -140.18 63.69 1.47 Allowed 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.79 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.485 ' C ' ' O ' ' A' ' 25' ' ' MET . 20.1 p -29.12 87.55 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 121.682 0.753 . . . . 0.0 111.503 -178.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.562 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.97 148.85 15.71 Favored 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.652 -0.655 . . . . 0.0 109.371 179.937 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.504 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 7.7 p30 -64.44 105.05 0.86 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.316 -0.865 . . . . 0.0 109.762 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.522 ' CD2' HD12 ' A' ' 22' ' ' LEU . 4.9 t80 -99.75 144.66 28.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.343 -0.848 . . . . 0.0 110.018 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 42.9 m -137.44 115.33 11.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.011 -1.056 . . . . 0.0 110.581 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -80.87 114.94 20.09 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.221 -0.925 . . . . 0.0 109.683 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 91.2 m -79.6 172.99 13.03 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.21 -0.932 . . . . 0.0 110.44 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -79.44 118.41 21.3 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.371 -0.831 . . . . 0.0 109.964 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.2 t -50.87 106.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.301 -0.874 . . . . 0.0 109.763 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.455 ' O ' HD11 ' A' ' 46' ' ' LEU . . . 143.97 -10.76 2.08 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.577 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.37 168.45 19.49 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.159 -1.2 . . . . 0.0 109.829 179.855 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.589 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.71 30.58 6.18 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.952 -1.093 . . . . 0.0 110.791 -179.742 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.12 154.61 25.66 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 11.6 p -84.87 44.22 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.297 -1.119 . . . . 0.0 109.759 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.549 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.55 22.58 0.18 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.461 -0.774 . . . . 0.0 109.759 -179.571 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 2.9 p 27.78 92.05 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 CA-C-O 121.387 0.613 . . . . 0.0 111.452 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.549 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -153.29 -37.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.442 -0.786 . . . . 0.0 110.278 179.833 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.589 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.9 p80 -121.92 116.48 24.45 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.194 -0.941 . . . . 0.0 110.451 179.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.557 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 38.0 t80 -79.89 115.47 19.5 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.477 0.656 . . . . 0.0 109.882 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.528 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -82.93 -26.24 31.62 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.295 -0.878 . . . . 0.0 110.038 -179.557 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.557 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.5 mt . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.172 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.508 ' O ' ' CG1' ' A' ' 1' ' ' VAL . 9.9 p . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.258 0.551 . . . . 0.0 110.289 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.52 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER -109.36 100.73 9.79 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.216 -0.927 . . . . 0.0 110.222 -179.939 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.522 ' CD1' ' CG2' ' A' ' 20' ' ' ILE . 1.8 tt -121.42 156.3 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.266 -0.896 . . . . 0.0 110.248 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.533 ' O ' ' CG2' ' A' ' 20' ' ' ILE . 4.9 t -141.56 -150.59 0.32 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.334 -0.854 . . . . 0.0 110.087 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.434 ' N ' ' CG2' ' A' ' 4' ' ' THR . 7.6 mttt -118.18 -174.82 2.73 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.502 -0.749 . . . . 0.0 110.446 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 67.4 m -109.97 -150.04 0.45 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.344 -0.848 . . . . 0.0 110.201 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.12 -170.69 1.93 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.27 -0.893 . . . . 0.0 110.17 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.78 15.54 11.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.238 -0.913 . . . . 0.0 110.224 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -128.9 31.36 4.94 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.215 -0.928 . . . . 0.0 110.181 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.4 ttt -148.21 20.03 1.09 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.267 -0.896 . . . . 0.0 110.337 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -101.82 75.02 1.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.897 . . . . 0.0 110.145 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -136.15 20.54 3.57 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -119.49 -58.56 1.9 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.12 -1.223 . . . . 0.0 110.297 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.0 p -97.06 121.71 39.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.321 -0.862 . . . . 0.0 110.349 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.54 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.8 mt -90.79 -45.55 8.75 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.222 -0.924 . . . . 0.0 110.382 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.57 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 6.3 m80 -108.81 77.03 1.05 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.257 -0.902 . . . . 0.0 110.148 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -173.09 -163.61 27.1 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -123.32 135.49 54.22 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.218 -1.166 . . . . 0.0 110.209 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t -79.9 144.94 32.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -0.887 . . . . 0.0 110.11 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.533 ' CG2' ' O ' ' A' ' 4' ' ' THR . 0.0 OUTLIER -158.18 -179.86 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.22 -0.925 . . . . 0.0 109.565 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.487 ' O ' HG13 ' A' ' 3' ' ' ILE . 17.9 t80 -144.22 128.58 17.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.886 -1.134 . . . . 0.0 110.449 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.552 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.7 mm? -85.14 130.63 34.57 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.15 -0.969 . . . . 0.0 110.789 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.52 HG11 ' CB ' ' A' ' 2' ' ' SER . 6.0 p -90.86 -25.74 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.345 -0.847 . . . . 0.0 110.564 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -78.08 -3.62 43.21 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.008 -1.057 . . . . 0.0 108.925 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.522 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -159.81 68.41 0.4 Allowed 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 179.18 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.509 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.58 91.76 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.981 0.896 . . . . 0.0 111.2 -178.409 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -160.18 147.95 16.53 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.504 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 23.1 t30 -63.21 128.71 37.09 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.373 -0.83 . . . . 0.0 110.235 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.552 ' CD2' HD23 ' A' ' 22' ' ' LEU . 6.5 t80 -122.16 116.58 24.43 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.357 -0.839 . . . . 0.0 110.108 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -122.57 112.69 18.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.223 -0.923 . . . . 0.0 110.142 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -80.13 102.06 9.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.173 -0.954 . . . . 0.0 109.842 179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 74.4 m -79.54 170.42 16.59 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.875 . . . . 0.0 110.041 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 32.2 tt0 -79.45 125.45 29.57 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.221 -0.924 . . . . 0.0 109.807 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.5 t -66.43 -20.72 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.398 -0.814 . . . . 0.0 110.182 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.93 -10.6 56.35 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.57 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.79 176.52 9.65 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -1.185 . . . . 0.0 109.912 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.583 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -108.64 27.48 9.37 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.907 -1.121 . . . . 0.0 110.343 179.573 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -159.29 155.59 26.68 Favored Glycine 0 N--CA 1.488 2.137 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.5 p -84.63 43.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.289 -1.124 . . . . 0.0 109.815 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.552 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -157.02 20.11 0.31 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.32 -0.862 . . . . 0.0 110.051 -179.557 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 8.9 p 29.22 91.42 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.495 0.664 . . . . 0.0 111.614 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.552 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.3 tt0 -155.56 -36.96 0.09 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.339 -0.851 . . . . 0.0 110.158 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.583 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.4 p80 -121.13 121.07 37.05 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.143 -0.973 . . . . 0.0 110.462 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.579 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 33.8 t80 -83.88 121.94 28.03 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.378 0.609 . . . . 0.0 109.839 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.554 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.2 OUTLIER -92.22 -19.83 21.8 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.28 -0.888 . . . . 0.0 110.069 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.579 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.0 mt . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.327 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.444 HG21 ' O ' ' A' ' 1' ' ' VAL . 20.9 m . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.229 0.538 . . . . 0.0 110.21 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.67 62.86 1.99 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.137 -0.977 . . . . 0.0 110.469 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.523 ' CD1' HG21 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -79.93 153.97 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.242 -0.911 . . . . 0.0 109.913 179.675 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.4 m -136.05 162.19 33.59 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.281 -0.887 . . . . 0.0 110.252 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -93.6 -178.8 4.82 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.433 -0.792 . . . . 0.0 110.099 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 15.5 m -110.97 -163.42 0.85 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.219 -0.926 . . . . 0.0 110.274 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.55 -158.84 0.9 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.271 -0.893 . . . . 0.0 110.159 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.0 p -81.77 168.65 17.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.234 -0.917 . . . . 0.0 110.121 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 46.5 23.68 0.25 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.141 -0.974 . . . . 0.0 110.345 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -120.75 -0.77 10.1 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 110.163 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -120.56 101.41 7.74 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.237 -0.914 . . . . 0.0 110.257 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -138.65 16.44 3.32 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -114.74 -53.4 2.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.313 -1.11 . . . . 0.0 110.284 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -93.62 123.11 36.72 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.295 -0.878 . . . . 0.0 110.632 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.543 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.5 mt -90.31 -42.85 10.73 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.267 -0.896 . . . . 0.0 110.315 179.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.543 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.9 m80 -109.8 88.27 2.71 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.302 -0.874 . . . . 0.0 110.165 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.13 -167.61 40.6 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -123.23 159.43 28.73 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.227 -1.16 . . . . 0.0 110.357 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.3 OUTLIER -99.94 149.21 23.66 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.231 -0.918 . . . . 0.0 110.504 -179.807 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.523 HG21 ' CD1' ' A' ' 3' ' ' ILE . 1.4 mt -155.0 -171.64 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.364 -0.835 . . . . 0.0 109.531 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.486 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 18.7 t80 -145.55 133.56 21.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.042 -1.036 . . . . 0.0 109.644 179.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.587 HD23 ' CD2' ' A' ' 29' ' ' TYR . 2.1 mm? -99.4 137.96 37.16 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.129 -0.982 . . . . 0.0 111.076 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.518 HG13 ' N ' ' A' ' 24' ' ' ASP . 7.2 p -90.38 -26.01 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.38 -0.825 . . . . 0.0 110.52 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.518 ' N ' HG13 ' A' ' 23' ' ' VAL . 49.0 p30 -77.9 -4.73 48.24 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.119 -0.988 . . . . 0.0 109.095 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.556 ' O ' ' N ' ' A' ' 27' ' ' GLN . 8.8 mtm -157.95 65.57 0.46 Allowed 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 179.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.474 ' C ' ' O ' ' A' ' 25' ' ' MET . 68.4 p -29.28 86.93 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 CA-C-O 121.614 0.721 . . . . 0.0 111.831 -178.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.556 ' N ' ' O ' ' A' ' 25' ' ' MET . 2.9 pt20 -160.9 174.91 13.13 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.707 -0.621 . . . . 0.0 109.405 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -79.28 146.85 32.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.345 -0.847 . . . . 0.0 110.549 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.587 ' CD2' HD23 ' A' ' 22' ' ' LEU . 8.1 t80 -129.88 108.54 10.21 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.53 -0.732 . . . . 0.0 109.592 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 5.8 m -111.72 107.77 16.97 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.104 -0.998 . . . . 0.0 110.74 -179.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.465 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -79.57 121.63 25.48 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.182 -0.948 . . . . 0.0 109.218 179.182 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 89.9 m -79.38 173.67 12.34 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.221 -0.925 . . . . 0.0 110.137 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -78.94 115.1 18.4 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.229 -0.919 . . . . 0.0 109.8 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.0 t -51.93 100.89 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.498 -0.751 . . . . 0.0 109.883 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 151.69 -13.64 0.78 Allowed Glycine 0 N--CA 1.493 2.449 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.428 ' CZ ' ' HD1' ' A' ' 44' ' ' PHE . 1.2 m-85 -79.13 170.54 16.5 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.012 -1.287 . . . . 0.0 110.049 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.556 HG22 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -112.38 35.72 3.69 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.937 -1.102 . . . . 0.0 110.544 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.406 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -160.29 154.9 25.97 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.0 p -85.18 45.43 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.21 -1.171 . . . . 0.0 109.47 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.559 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -158.76 20.01 0.21 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.518 -0.739 . . . . 0.0 109.979 -179.179 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 2.8 p 27.12 93.56 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.577 -0.702 . . . . 0.0 111.541 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.548 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 4.4 tt0 -160.73 -35.65 0.05 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.549 -0.719 . . . . 0.0 110.323 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.556 ' CE1' HG22 ' A' ' 37' ' ' THR . 7.4 p80 -124.15 112.55 17.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.111 -0.993 . . . . 0.0 110.652 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.428 ' HD1' ' CZ ' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -79.89 134.25 36.28 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.297 -0.877 . . . . 0.0 109.508 179.309 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.55 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -91.14 -24.05 20.08 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.362 -0.836 . . . . 0.0 110.212 -179.303 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.54 ' HG ' ' CD2' ' A' ' 45' ' ' PHE . 1.9 mt . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.277 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 69.2 t . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.24 0.543 . . . . 0.0 110.239 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -119.74 47.42 1.73 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.258 -0.901 . . . . 0.0 110.255 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.569 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 6.4 tt -79.93 157.29 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.513 HG23 ' N ' ' A' ' 5' ' ' LYS . 6.4 t -142.58 -153.85 0.49 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.296 -0.877 . . . . 0.0 110.006 179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.513 ' N ' HG23 ' A' ' 4' ' ' THR . 11.7 mtpt -102.73 178.61 4.52 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.394 -0.816 . . . . 0.0 110.258 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 59.6 m -105.69 -150.87 0.44 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.175 -0.953 . . . . 0.0 110.247 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.5 m -111.2 -170.03 1.57 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.209 -0.932 . . . . 0.0 110.203 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.68 13.34 8.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -0.888 . . . . 0.0 110.185 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.63 21.78 5.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.293 -0.88 . . . . 0.0 110.214 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -127.04 3.53 6.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.255 -0.903 . . . . 0.0 110.136 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.428 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 21.5 p30 -86.07 48.65 1.64 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.287 -0.883 . . . . 0.0 110.103 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -126.06 3.55 7.88 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -101.22 -48.49 4.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.15 -1.206 . . . . 0.0 110.27 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 22.1 p -105.16 116.18 31.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.291 -0.881 . . . . 0.0 110.63 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.575 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.6 mt -90.43 -39.05 12.87 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.301 -0.875 . . . . 0.0 110.506 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.595 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 21.3 m80 -110.73 63.11 0.61 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.109 -0.995 . . . . 0.0 110.555 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.474 ' HA3' ' SG ' ' A' ' 32' ' ' CYS . . . -173.51 -160.32 21.69 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -122.66 136.25 54.82 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.292 -1.122 . . . . 0.0 110.177 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t -84.64 146.73 27.33 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.326 -0.859 . . . . 0.0 110.449 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.569 ' CD1' ' CD1' ' A' ' 3' ' ' ILE . 5.0 pt -157.78 -170.61 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.379 -0.826 . . . . 0.0 110.104 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.478 ' O ' HG13 ' A' ' 3' ' ' ILE . 4.6 t80 -140.9 133.7 28.94 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.112 -0.993 . . . . 0.0 110.097 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.605 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.2 mm? -86.7 133.74 33.65 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.122 -0.986 . . . . 0.0 111.113 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.496 HG11 ' N ' ' A' ' 24' ' ' ASP . 7.2 p -90.83 -25.23 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.412 -0.805 . . . . 0.0 110.67 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.522 ' OD2' ' CD1' ' A' ' 22' ' ' LEU . 2.9 p30 -78.64 -15.52 58.41 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.047 -1.033 . . . . 0.0 108.9 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.6 mtt -147.43 67.0 1.13 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.1 p -29.11 88.76 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.693 0.758 . . . . 0.0 111.661 -178.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.3 OUTLIER -160.28 173.44 15.7 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.673 -0.642 . . . . 0.0 109.561 179.643 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -77.18 136.89 38.6 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.368 -0.832 . . . . 0.0 110.522 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.617 ' CD1' ' N ' ' A' ' 30' ' ' CYS . 8.6 t80 -135.82 154.42 51.19 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.461 -0.774 . . . . 0.0 109.653 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.617 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 3.0 m -153.64 123.51 6.83 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.926 -1.109 . . . . 0.0 110.94 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.3 tpp85 -103.04 106.72 17.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.175 -0.953 . . . . 0.0 109.093 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 27.0 m -111.27 -164.82 0.94 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.293 -0.88 . . . . 0.0 110.592 -178.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -78.24 123.05 26.49 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.244 -0.91 . . . . 0.0 109.615 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.4 t -64.5 -10.59 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.447 -0.783 . . . . 0.0 109.707 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.72 -7.09 53.86 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.595 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.6 m-85 -79.46 165.13 23.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.18 -1.188 . . . . 0.0 109.407 179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.58 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.61 34.0 4.22 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.878 -1.139 . . . . 0.0 111.478 -178.823 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.7 159.5 31.02 Favored Glycine 0 N--CA 1.491 2.336 0 C-N-CA 119.351 -1.404 . . . . 0.0 110.075 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -84.33 13.04 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -1.119 . . . . 0.0 109.362 178.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.543 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 28.0 ttp180 -109.08 -17.62 13.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.569 -0.707 . . . . 0.0 110.116 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 21.9 m 61.11 58.65 2.18 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.315 -0.866 . . . . 0.0 110.607 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.543 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER -136.35 -19.53 1.44 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.482 -0.761 . . . . 0.0 111.278 179.93 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.58 ' CE1' HG23 ' A' ' 37' ' ' THR . 4.9 p80 -127.52 119.93 27.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.736 -1.227 . . . . 0.0 110.7 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.603 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 21.1 t80 -81.75 108.22 15.12 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.327 0.584 . . . . 0.0 109.964 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.564 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -64.61 -15.9 61.87 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.222 -0.924 . . . . 0.0 109.912 -179.773 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.603 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.0 mt . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.27 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.232 0.539 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.593 ' CB ' ' CG1' ' A' ' 23' ' ' VAL . 48.3 m -129.44 85.92 2.37 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.243 -0.91 . . . . 0.0 110.147 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.541 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -139.18 153.0 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.297 -0.877 . . . . 0.0 110.043 -179.954 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.48 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -132.83 162.23 32.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.261 -0.899 . . . . 0.0 110.425 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -101.93 168.16 9.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.335 -0.853 . . . . 0.0 110.129 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 58.4 m -108.83 -145.66 0.4 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.227 -0.92 . . . . 0.0 110.253 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.495 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.3 OUTLIER -153.79 -158.27 0.85 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.311 -0.868 . . . . 0.0 110.062 179.877 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.495 ' N ' ' OG ' ' A' ' 7' ' ' SER . 3.0 t -80.5 168.62 18.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.154 -0.966 . . . . 0.0 110.231 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.6 t0 47.88 22.86 0.4 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.097 -1.002 . . . . 0.0 110.286 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.19 8.17 8.53 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.326 -0.859 . . . . 0.0 110.176 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -114.75 -142.72 0.38 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.285 -0.885 . . . . 0.0 110.04 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 116.94 -0.17 19.62 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.415 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 65.2 t80 -110.48 -51.35 2.88 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.222 -1.163 . . . . 0.0 110.132 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.2 p -96.67 120.74 37.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.307 -0.871 . . . . 0.0 110.163 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.571 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 10.8 mt -88.17 -40.96 13.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.201 -0.937 . . . . 0.0 110.377 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.571 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.1 m80 -114.2 80.3 1.37 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.216 -0.928 . . . . 0.0 110.037 -179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.484 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -179.74 -168.25 38.25 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.473 ' O ' HD11 ' A' ' 20' ' ' ILE . 87.1 mt-30 -115.04 167.55 10.71 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.298 -1.119 . . . . 0.0 110.283 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.3 t -103.68 126.36 50.77 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.394 -0.816 . . . . 0.0 110.378 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.585 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -130.25 -172.9 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.322 -0.861 . . . . 0.0 109.555 -179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.48 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 14.5 t80 -145.82 142.85 29.23 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.894 -1.129 . . . . 0.0 110.19 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.551 HD23 ' CD1' ' A' ' 29' ' ' TYR . 1.2 mm? -104.14 136.64 43.38 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.108 -0.995 . . . . 0.0 111.37 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.593 ' CG1' ' CB ' ' A' ' 2' ' ' SER . 14.7 p -90.78 -27.69 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.352 -0.842 . . . . 0.0 110.556 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.549 ' N ' HG13 ' A' ' 23' ' ' VAL . 34.2 m-20 -78.77 -19.04 53.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.035 -1.041 . . . . 0.0 108.839 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.542 ' HB3' ' NE2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -138.84 63.6 1.51 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.735 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.486 ' C ' ' O ' ' A' ' 25' ' ' MET . 11.5 p -28.75 89.03 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.679 0.752 . . . . 0.0 111.543 -178.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.542 ' NE2' ' HB3' ' A' ' 25' ' ' MET . 0.6 OUTLIER -159.73 176.74 11.61 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.609 -0.682 . . . . 0.0 109.73 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -88.09 115.94 25.92 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.495 -0.753 . . . . 0.0 110.352 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.551 ' CD1' HD23 ' A' ' 22' ' ' LEU . 28.7 t80 -91.08 157.03 17.47 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.493 -0.755 . . . . 0.0 109.73 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -141.15 112.85 7.64 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.067 -1.02 . . . . 0.0 110.403 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.484 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 11.1 tpp180 -88.66 115.77 26.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.262 -0.898 . . . . 0.0 109.479 179.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 91.4 m -79.05 170.12 17.15 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.281 -0.887 . . . . 0.0 110.391 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -79.44 113.97 18.0 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.316 -0.865 . . . . 0.0 110.143 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 47.4 t -48.12 104.62 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.362 -0.836 . . . . 0.0 109.786 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.92 -9.18 2.27 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.525 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.41 175.58 10.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.13 -1.217 . . . . 0.0 109.832 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -116.95 13.14 14.85 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.025 -1.047 . . . . 0.0 110.818 -179.583 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -128.74 161.73 22.36 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 39' ' ' VAL . 11.3 p -87.67 31.55 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.298 -1.119 . . . . 0.0 109.743 179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.562 ' CG ' ' O ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -160.37 29.62 0.16 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.332 -0.855 . . . . 0.0 109.962 -179.655 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 8.1 p 31.76 90.8 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.616 -0.677 . . . . 0.0 111.13 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.539 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 4.0 tm-20 -154.02 -39.88 0.09 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.295 -0.878 . . . . 0.0 110.098 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.2 p-80 -117.21 128.49 55.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.093 -1.004 . . . . 0.0 110.202 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.574 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 34.9 t80 -88.62 130.49 35.27 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.436 0.636 . . . . 0.0 110.528 -178.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -93.48 -36.8 12.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.409 -0.807 . . . . 0.0 110.001 -179.741 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.574 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.379 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.8 p . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.272 0.558 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.454 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 3.7 t -149.48 84.09 1.42 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.152 -0.967 . . . . 0.0 110.376 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.524 HG12 ' CG2' ' A' ' 20' ' ' ILE . 5.5 tt -80.03 -178.25 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.209 -0.932 . . . . 0.0 110.003 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.475 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -155.19 160.74 41.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.238 -0.914 . . . . 0.0 110.246 -179.896 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.5 mtmm -110.36 161.93 15.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.297 -0.877 . . . . 0.0 110.218 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.61 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.1 m -103.73 -144.64 0.37 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.269 -0.895 . . . . 0.0 110.101 179.991 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.413 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 0.5 OUTLIER -127.61 -154.43 0.63 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.183 -0.948 . . . . 0.0 110.214 179.943 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.3 m -82.35 -61.1 1.99 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.245 -0.909 . . . . 0.0 110.18 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -91.51 27.65 1.93 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.227 -0.92 . . . . 0.0 110.182 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.97 -11.83 14.93 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.274 -0.891 . . . . 0.0 110.217 -180.0 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 11' ' ' ASN . 7.7 p-10 -132.77 96.85 3.9 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.307 -0.87 . . . . 0.0 110.202 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.17 52.73 0.67 Allowed Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -121.79 -59.36 1.68 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -1.151 . . . . 0.0 110.184 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -87.75 118.75 27.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 110.296 -179.877 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.567 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.2 mt -78.72 -43.01 26.81 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.303 -0.873 . . . . 0.0 110.288 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 9.1 m80 -116.99 77.54 1.13 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.329 -0.857 . . . . 0.0 110.496 -178.919 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.441 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -175.85 167.71 39.64 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.832 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -89.96 145.55 25.03 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -1.209 . . . . 0.0 110.27 179.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.61 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 15.9 t -88.9 142.6 27.51 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.331 -0.856 . . . . 0.0 110.349 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.524 ' CG2' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -158.74 -175.44 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.314 -0.866 . . . . 0.0 109.697 179.979 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.491 ' O ' HG13 ' A' ' 3' ' ' ILE . 9.4 t80 -152.68 123.27 7.29 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.037 -1.039 . . . . 0.0 109.963 -179.852 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.546 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 1.9 mm? -82.16 130.98 35.23 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.214 -0.929 . . . . 0.0 111.048 -179.366 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.513 HG12 ' N ' ' A' ' 24' ' ' ASP . 7.7 p -90.39 -23.81 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.298 -0.876 . . . . 0.0 110.42 179.518 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.513 ' N ' HG12 ' A' ' 23' ' ' VAL . 4.2 m-20 -78.39 -10.23 59.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.067 -1.021 . . . . 0.0 108.771 178.9 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.547 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.5 mpp? -150.86 69.0 0.96 Allowed 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.466 ' C ' ' O ' ' A' ' 25' ' ' MET . 6.9 p -29.49 87.64 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 121.575 0.702 . . . . 0.0 111.91 -178.183 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 tt0 -158.67 154.1 25.86 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.703 -0.623 . . . . 0.0 109.85 179.595 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.97 127.35 32.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.468 -0.77 . . . . 0.0 110.232 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.546 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 15.5 t80 -116.57 123.6 47.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.313 -0.867 . . . . 0.0 109.965 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 5.8 m -125.67 118.58 25.93 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.154 -0.966 . . . . 0.0 110.38 -179.78 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.448 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 5.1 tpp85 -79.43 124.85 28.84 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.218 -0.926 . . . . 0.0 109.421 179.551 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.8 m -79.4 160.4 26.68 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.214 -0.929 . . . . 0.0 109.528 -179.782 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' GLY . 16.2 tt0 -78.79 110.34 13.87 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.072 -1.017 . . . . 0.0 109.411 179.764 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.433 ' C ' ' O ' ' A' ' 33' ' ' GLU . 40.3 t -41.61 94.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.541 -0.724 . . . . 0.0 110.244 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 152.9 -17.67 0.73 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.868 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.589 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.1 m-85 -79.92 165.97 22.11 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.192 -1.181 . . . . 0.0 110.216 -179.937 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.639 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 6.1 t -120.28 35.21 4.94 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 119.103 -1.039 . . . . 0.0 110.902 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -140.6 153.87 23.87 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 179.721 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.519 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 43.1 t -85.2 14.05 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.356 -1.085 . . . . 0.0 109.782 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.574 ' CZ ' ' CB ' ' A' ' 42' ' ' GLU . 2.1 tmm_? -127.9 -15.14 4.91 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.455 -0.778 . . . . 0.0 110.399 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.1 m 71.75 85.59 0.12 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.389 -0.819 . . . . 0.0 109.719 -179.679 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.574 ' CB ' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -152.42 -31.33 0.14 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.638 -0.664 . . . . 0.0 110.715 -179.805 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.639 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 6.2 p80 -123.64 118.79 28.09 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.891 -1.131 . . . . 0.0 110.729 179.522 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.59 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 24.6 t80 -80.62 104.06 10.89 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.307 0.575 . . . . 0.0 109.9 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.557 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -64.85 -22.21 66.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.206 -0.934 . . . . 0.0 109.95 -179.774 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.59 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.4 mt . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.139 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.429 ' CG1' HG23 ' A' ' 3' ' ' ILE . 87.2 t . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.294 0.569 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.534 ' HB3' ' CG1' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -125.77 45.49 2.6 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.283 -0.886 . . . . 0.0 110.116 -179.984 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.541 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.5 OUTLIER -143.97 153.62 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.325 -0.86 . . . . 0.0 110.342 -179.769 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.462 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -131.15 173.97 10.5 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.238 -0.914 . . . . 0.0 110.251 179.906 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -106.75 165.14 11.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.234 -0.916 . . . . 0.0 110.149 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.7 m -102.11 -141.17 0.35 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.254 -0.904 . . . . 0.0 110.216 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.5 t -141.25 -160.91 1.13 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.28 -0.888 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.2 28.5 1.41 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.26 -0.9 . . . . 0.0 110.241 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.34 30.85 1.54 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.228 -0.92 . . . . 0.0 110.177 179.962 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -145.44 14.56 1.43 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.97 . . . . 0.0 110.245 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -109.83 75.28 0.93 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.177 -0.952 . . . . 0.0 110.234 -179.967 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.32 -7.47 6.38 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -95.57 -60.28 1.69 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.281 -1.129 . . . . 0.0 110.076 -179.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.1 p -83.89 126.66 33.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.334 -0.854 . . . . 0.0 110.136 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.537 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.5 mt -90.58 -45.72 8.74 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.138 -0.976 . . . . 0.0 110.333 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.537 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.1 m80 -109.33 77.49 1.07 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.257 -0.902 . . . . 0.0 110.233 -179.573 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -174.5 -163.49 27.86 Favored Glycine 0 N--CA 1.488 2.16 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -128.73 153.15 47.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.328 -1.101 . . . . 0.0 110.285 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -83.07 152.45 25.35 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.305 -0.872 . . . . 0.0 110.124 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.541 ' CG2' HG12 ' A' ' 3' ' ' ILE . 1.0 OUTLIER -153.62 -173.99 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.144 -0.973 . . . . 0.0 109.603 -179.894 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.462 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 23.0 t80 -147.41 133.0 18.76 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.038 -1.039 . . . . 0.0 110.162 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.585 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.4 mm? -94.7 134.64 37.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.254 -0.904 . . . . 0.0 110.468 -179.882 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.534 ' CG1' ' HB3' ' A' ' 2' ' ' SER . 8.1 p -90.38 -27.16 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.344 -0.848 . . . . 0.0 110.599 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' A' ' 25' ' ' MET . 11.2 p30 -78.16 -15.13 59.12 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.106 -0.996 . . . . 0.0 108.757 179.362 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.3 ttm -144.74 65.56 1.27 Allowed 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.852 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 19.8 p -29.05 88.7 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 121.629 0.728 . . . . 0.0 111.751 -178.321 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 7.1 pt20 -160.38 176.15 12.0 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.627 -0.671 . . . . 0.0 109.601 179.488 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -81.68 138.82 35.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.452 -179.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.585 ' CD2' HD23 ' A' ' 22' ' ' LEU . 17.7 t80 -128.15 117.32 21.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.372 -0.83 . . . . 0.0 109.838 179.861 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -114.06 117.39 31.14 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.08 -1.013 . . . . 0.0 110.621 -179.671 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.465 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.0 ttm180 -91.78 129.8 37.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.945 . . . . 0.0 109.749 179.433 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 71.9 m -79.4 175.12 10.89 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.279 -0.888 . . . . 0.0 110.241 -179.869 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -79.81 112.85 17.49 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -0.891 . . . . 0.0 109.854 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 43.4 t -47.27 105.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.361 -0.837 . . . . 0.0 109.887 -179.94 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.47 -8.89 2.37 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.743 -1.343 . . . . 0.0 109.743 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.477 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.33 176.07 10.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.116 -1.226 . . . . 0.0 110.056 179.963 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.615 HG22 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -115.12 31.31 6.78 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.119 -0.988 . . . . 0.0 110.378 -179.49 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.06 155.31 26.43 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.5 p -84.76 43.07 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.275 -1.133 . . . . 0.0 109.789 179.61 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.555 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -160.27 22.21 0.16 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.412 -0.805 . . . . 0.0 109.918 -179.537 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 6.6 p 28.95 92.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.697 -0.627 . . . . 0.0 111.472 179.767 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.4 OUTLIER -154.2 -42.85 0.09 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.378 -0.826 . . . . 0.0 110.139 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.615 ' CE1' HG22 ' A' ' 37' ' ' THR . 1.4 p-80 -118.24 127.75 54.03 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.09 -1.006 . . . . 0.0 110.364 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.588 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 37.6 t80 -86.86 128.07 35.04 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.387 0.613 . . . . 0.0 110.508 -178.65 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -92.59 -35.2 13.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.385 -0.822 . . . . 0.0 109.964 -179.758 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.588 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.22 -179.713 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.254 0.549 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.461 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -147.26 147.16 30.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.916 . . . . 0.0 110.173 179.946 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.588 ' CG1' ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -147.8 156.73 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.28 -0.887 . . . . 0.0 110.161 -179.948 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.8 m -133.43 164.32 27.4 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.294 -0.879 . . . . 0.0 110.158 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 19' ' ' CYS . 10.6 tttt -126.41 155.05 42.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.205 -0.935 . . . . 0.0 110.181 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.2 m -99.91 -146.14 0.34 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.255 -0.903 . . . . 0.0 110.227 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.5 t -122.23 -164.42 1.16 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.294 -0.879 . . . . 0.0 110.221 179.912 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -87.13 11.52 13.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.227 -0.92 . . . . 0.0 110.321 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -121.98 26.35 8.63 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.24 -0.913 . . . . 0.0 110.188 179.938 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.4 14.16 4.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.297 -0.877 . . . . 0.0 110.138 179.935 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -102.47 66.5 0.98 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.931 . . . . 0.0 110.269 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.26 26.26 10.62 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -145.86 -55.8 0.29 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -1.133 . . . . 0.0 110.249 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.4 p -90.51 127.34 36.21 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.26 -0.9 . . . . 0.0 110.354 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.536 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 3.5 mt -90.52 -44.88 9.29 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.231 -0.918 . . . . 0.0 110.344 179.885 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 18.0 m80 -110.51 89.38 3.01 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.318 -0.864 . . . . 0.0 110.487 -179.168 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.451 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.23 -161.46 31.55 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 179.931 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -134.14 149.3 51.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.292 -1.122 . . . . 0.0 110.229 179.881 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.3 t -79.9 120.29 23.93 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.216 -0.928 . . . . 0.0 110.027 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.588 ' CG2' ' CG1' ' A' ' 3' ' ' ILE . 21.2 mm -122.32 168.64 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 110.224 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.469 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 18.3 t80 -139.47 129.94 25.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 109.994 -179.988 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.608 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 3.6 mm? -90.06 134.42 34.26 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.214 -0.929 . . . . 0.0 110.638 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.461 HG11 ' HB3' ' A' ' 2' ' ' SER . 11.3 p -90.48 -25.58 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.269 -0.894 . . . . 0.0 110.541 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.438 ' N ' HG12 ' A' ' 23' ' ' VAL . 20.2 m-20 -78.34 -14.45 59.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.086 -1.009 . . . . 0.0 108.82 179.323 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.3 ttm -147.47 66.66 1.13 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.992 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 58.8 p -29.21 88.57 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.675 0.75 . . . . 0.0 111.467 -178.437 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.39 146.38 15.26 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.481 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -55.81 161.55 2.15 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.132 -0.98 . . . . 0.0 110.388 -179.711 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.608 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 5.9 t80 -154.59 86.31 1.14 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.402 -0.811 . . . . 0.0 109.906 -179.908 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.2 m -82.8 104.71 13.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.188 -0.945 . . . . 0.0 110.53 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.483 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 11.5 tpp85 -81.7 123.17 28.5 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.212 -0.93 . . . . 0.0 110.118 179.698 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 97.7 m -79.79 172.78 13.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.328 -0.858 . . . . 0.0 110.145 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -79.81 128.81 33.88 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.891 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.3 t -58.54 105.84 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.249 -0.907 . . . . 0.0 110.084 -179.937 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.525 ' O ' ' CD1' ' A' ' 46' ' ' LEU . . . 145.17 -14.16 1.88 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.716 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.589 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.2 m-85 -79.75 154.24 28.67 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.344 -1.092 . . . . 0.0 109.903 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.632 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 5.1 t -109.42 46.58 0.99 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.954 -1.092 . . . . 0.0 110.782 -179.762 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.2 156.18 27.4 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.404 ' O ' ' CG2' ' A' ' 39' ' ' VAL . 10.6 p -87.11 37.2 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.261 -1.141 . . . . 0.0 109.753 179.609 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.57 ' CZ ' ' CB ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.09 22.36 0.16 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.418 -0.801 . . . . 0.0 109.839 -179.483 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.2 p 29.74 91.5 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.609 -0.682 . . . . 0.0 111.645 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.57 ' CB ' ' CZ ' ' A' ' 40' ' ' ARG . 0.7 OUTLIER -144.92 -36.91 0.3 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.552 -0.717 . . . . 0.0 109.906 179.382 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.632 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 6.0 p80 -124.21 117.78 25.35 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.164 -0.96 . . . . 0.0 109.9 178.798 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.592 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 46.2 t80 -79.58 103.09 9.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.73 -0.606 . . . . 0.0 110.218 -179.365 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.575 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -65.85 -28.47 69.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.43 -0.794 . . . . 0.0 110.15 -179.763 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.592 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.6 mt . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.342 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.485 HG23 ' N ' ' A' ' 2' ' ' SER . 12.9 p . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.313 0.578 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.485 ' N ' HG23 ' A' ' 1' ' ' VAL . 1.4 m -151.26 129.77 12.17 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.194 -0.941 . . . . 0.0 110.201 179.979 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.533 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.7 tt -122.95 155.52 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.34 -0.85 . . . . 0.0 110.167 -179.997 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.52 ' CB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -119.77 -167.8 1.49 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.128 -0.983 . . . . 0.0 110.32 -179.959 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.4 mttp -126.36 -179.89 4.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.214 -0.929 . . . . 0.0 110.468 -179.825 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 1.9 m -114.95 -161.25 0.77 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.288 -0.882 . . . . 0.0 110.18 179.972 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.7 t -132.29 -144.84 0.25 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.121 -0.987 . . . . 0.0 110.442 -179.826 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 79.4 p -79.61 2.74 21.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.308 -0.87 . . . . 0.0 110.392 -179.821 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -96.93 28.41 3.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 109.868 179.849 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.484 ' CG ' ' O ' ' A' ' 10' ' ' MET . 8.9 tmm? -116.75 5.4 13.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.395 -0.816 . . . . 0.0 110.323 -179.676 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -90.02 60.74 4.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.207 -0.933 . . . . 0.0 109.923 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -157.17 -36.06 0.02 OUTLIER Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.561 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 43.4 t80 -93.86 -54.99 3.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.149 -1.206 . . . . 0.0 110.698 -179.692 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 19.2 p -117.83 117.07 28.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.081 -1.012 . . . . 0.0 110.607 -179.641 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.572 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 17.5 mt -91.33 -50.28 5.9 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.391 -0.818 . . . . 0.0 110.449 179.725 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 6.8 m80 -98.45 79.03 2.46 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.498 -0.751 . . . . 0.0 110.342 -178.813 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.474 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.46 163.85 26.98 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -94.33 143.87 26.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.282 -1.128 . . . . 0.0 109.916 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 8.1 t -98.68 153.01 19.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.2 -0.938 . . . . 0.0 110.571 -179.747 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.574 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -159.88 -174.51 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.491 -0.755 . . . . 0.0 109.9 -179.932 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.52 ' HB3' ' CB ' ' A' ' 4' ' ' THR . 15.1 t80 -133.21 129.46 37.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.198 -0.938 . . . . 0.0 110.1 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.597 HD21 ' CD2' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -87.52 131.38 34.39 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.153 -0.967 . . . . 0.0 110.782 -179.714 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.9 p -90.7 -26.74 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.24 -0.913 . . . . 0.0 110.602 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -78.12 -14.52 59.45 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.111 -0.993 . . . . 0.0 108.927 179.264 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.537 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.3 mtt -148.19 67.32 1.09 Allowed 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.862 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.456 ' C ' ' O ' ' A' ' 25' ' ' MET . 64.1 p -29.87 87.83 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.59 0.71 . . . . 0.0 111.968 -178.446 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -158.18 165.43 34.93 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.583 -0.698 . . . . 0.0 109.843 179.497 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.43 113.48 14.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.485 -0.76 . . . . 0.0 110.441 -179.738 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.597 ' CD2' HD21 ' A' ' 22' ' ' LEU . 5.0 t80 -101.53 117.34 34.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.397 -0.815 . . . . 0.0 109.53 179.642 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.597 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.1 m -117.47 112.76 21.08 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.122 -0.986 . . . . 0.0 110.852 -179.181 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.474 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.4 tpp85 -86.97 110.17 19.86 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.309 -0.87 . . . . 0.0 109.629 179.267 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 84.9 m -79.53 -179.84 7.07 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.171 -0.956 . . . . 0.0 110.382 -179.602 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -82.72 115.85 21.83 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.28 -0.888 . . . . 0.0 110.291 -179.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.7 t -52.21 105.9 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.299 -0.876 . . . . 0.0 109.611 179.701 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 139.42 -4.7 2.84 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.782 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.605 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.27 163.92 24.54 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.019 -1.283 . . . . 0.0 109.567 179.756 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.582 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -97.71 27.22 4.51 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.832 -1.167 . . . . 0.0 110.077 -179.834 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.09 152.94 23.85 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 179.545 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.15 44.0 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.198 -1.178 . . . . 0.0 109.952 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.587 ' NH1' ' CG ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -160.14 20.29 0.16 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.307 -0.871 . . . . 0.0 110.531 -179.537 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.8 p 33.54 93.66 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.576 -0.702 . . . . 0.0 111.792 179.926 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.587 ' CG ' ' NH1' ' A' ' 40' ' ' ARG . 1.7 tm-20 -151.13 -40.32 0.12 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.531 -0.73 . . . . 0.0 109.655 179.127 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.582 ' CE1' HG23 ' A' ' 37' ' ' THR . 3.8 p80 -122.82 112.43 17.88 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.911 0.862 . . . . 0.0 108.714 178.622 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.593 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 20.4 t80 -78.54 108.7 12.11 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.674 0.75 . . . . 0.0 110.126 -178.441 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.536 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -66.15 -9.75 34.52 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.431 0.634 . . . . 0.0 109.982 -179.492 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.593 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.9 mt . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.203 -179.718 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 88.4 t . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.083 0.468 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.45 ' HB3' ' CG1' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -122.54 51.2 1.41 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.226 -0.921 . . . . 0.0 110.172 179.828 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.501 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.1 tt -138.8 154.69 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.277 -0.89 . . . . 0.0 110.146 -179.95 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.2 m -127.73 161.52 28.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 -179.991 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.03 178.79 7.71 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.272 -0.892 . . . . 0.0 110.31 -179.903 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 68.7 m -109.66 -147.53 0.42 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.253 -0.905 . . . . 0.0 110.075 179.936 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 t -133.99 -167.64 1.99 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.255 -0.903 . . . . 0.0 110.119 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.6 t -83.96 12.69 5.84 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.267 -0.896 . . . . 0.0 110.274 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -132.25 23.98 4.49 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.299 -0.876 . . . . 0.0 110.253 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -121.82 -5.27 9.11 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.246 -0.909 . . . . 0.0 110.213 -179.976 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -90.88 54.16 2.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.277 -0.89 . . . . 0.0 110.272 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -119.43 0.44 14.16 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -106.92 -64.92 1.13 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.197 -1.178 . . . . 0.0 110.26 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.2 p -84.53 124.54 31.51 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.209 -0.932 . . . . 0.0 110.351 -179.926 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.571 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.5 mt -90.07 -44.36 9.87 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.269 -0.895 . . . . 0.0 110.273 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.571 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 3.6 m80 -114.62 92.04 3.82 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.29 -0.881 . . . . 0.0 110.159 -179.719 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.448 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.53 -169.43 42.4 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.997 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -110.49 143.91 40.11 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.28 -1.129 . . . . 0.0 110.165 179.853 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.0 OUTLIER -95.92 128.69 43.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.316 -0.865 . . . . 0.0 110.419 -179.903 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.562 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -146.46 -171.82 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.305 -0.872 . . . . 0.0 110.008 179.878 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.448 ' O ' HG13 ' A' ' 3' ' ' ILE . 17.5 t80 -142.83 135.13 27.46 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.334 -0.854 . . . . 0.0 109.811 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.564 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.4 mm? -87.62 129.61 35.06 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.046 -1.034 . . . . 0.0 110.839 -179.589 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.45 ' CG1' ' HB3' ' A' ' 2' ' ' SER . 8.9 p -90.71 -24.98 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.247 -0.908 . . . . 0.0 110.454 179.746 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -78.31 -12.13 59.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.994 -1.066 . . . . 0.0 108.802 179.206 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.0 OUTLIER -151.78 68.83 0.9 Allowed 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 178.915 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 56.0 p -29.19 89.78 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.791 0.805 . . . . 0.0 111.412 -178.545 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.5 tt0 -159.88 148.13 17.16 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.621 -0.674 . . . . 0.0 109.562 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.52 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 15.9 p30 -61.46 126.46 27.43 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.253 -0.904 . . . . 0.0 110.42 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.564 ' CD2' HD23 ' A' ' 22' ' ' LEU . 9.8 t80 -118.85 133.82 55.58 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.35 -0.844 . . . . 0.0 109.705 179.696 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -135.95 113.92 11.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.096 -1.002 . . . . 0.0 110.594 -179.561 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.448 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.2 tpp180 -81.78 106.07 13.42 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.215 -0.928 . . . . 0.0 109.587 179.373 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.61 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 94.1 m -79.49 171.34 15.29 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.255 -0.903 . . . . 0.0 110.186 -179.763 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -78.91 129.45 34.53 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.222 -0.924 . . . . 0.0 109.662 179.873 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.8 t -66.12 -14.72 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.332 -0.855 . . . . 0.0 110.287 -179.542 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -69.17 -17.42 72.01 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.491 ' CE1' ' N ' ' A' ' 43' ' ' HIS . 1.5 m-85 -79.92 166.39 21.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.326 -1.102 . . . . 0.0 110.065 179.828 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.658 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 14.2 t -102.39 29.22 5.33 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.979 -1.076 . . . . 0.0 110.516 -179.788 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.42 160.28 31.63 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 179.778 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.8 p -84.7 43.73 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.121 -1.223 . . . . 0.0 109.897 179.649 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.567 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -148.99 12.18 0.85 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.381 -0.825 . . . . 0.0 110.279 -179.384 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.61 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 6.9 p 32.05 87.85 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.608 -0.683 . . . . 0.0 110.493 -179.67 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.567 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 2.1 tt0 -160.32 -33.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.214 -0.929 . . . . 0.0 111.023 -179.515 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.658 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 5.4 p80 -126.72 119.25 26.49 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.708 -1.245 . . . . 0.0 111.937 -179.677 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.546 ' CE2' ' C ' ' A' ' 46' ' ' LEU . 44.4 t80 -87.24 92.15 8.96 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.091 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.596 ' CE2' ' CD1' ' A' ' 46' ' ' LEU . 0.4 OUTLIER -66.85 -5.39 12.17 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.443 -0.786 . . . . 0.0 110.72 -179.012 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.596 ' CD1' ' CE2' ' A' ' 45' ' ' PHE . 2.2 mm? . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.072 -1.018 . . . . 0.0 110.192 -179.865 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.41 ' O ' HG21 ' A' ' 23' ' ' VAL . 61.7 t . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.229 0.538 . . . . 0.0 110.182 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.484 ' HA ' ' CB ' ' A' ' 23' ' ' VAL . 1.0 OUTLIER -160.04 -160.43 0.8 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.235 -0.915 . . . . 0.0 110.145 -179.95 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 2.2 tt -79.56 148.6 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.266 -0.896 . . . . 0.0 110.341 179.975 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -160.98 -178.32 6.72 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.297 -0.877 . . . . 0.0 110.636 179.68 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -97.8 -178.71 4.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.465 -0.772 . . . . 0.0 110.27 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 49.0 m -98.13 -93.98 0.23 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.274 -0.891 . . . . 0.0 110.287 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.45 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 172.45 -167.2 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.097 -1.002 . . . . 0.0 110.122 -179.927 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.426 ' O ' ' N ' ' A' ' 10' ' ' MET . 6.6 t -80.1 169.63 17.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -0.904 . . . . 0.0 110.096 179.927 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 8' ' ' SER . 25.7 t70 43.13 26.25 0.08 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.146 -0.971 . . . . 0.0 110.214 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.426 ' N ' ' O ' ' A' ' 8' ' ' SER . 1.3 ttt -123.6 3.03 8.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.247 -0.908 . . . . 0.0 110.226 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.449 ' OD1' ' SG ' ' A' ' 14' ' ' CYS . 8.7 m-80 -101.97 70.42 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.896 . . . . 0.0 110.035 179.883 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.61 -24.29 14.08 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.871 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -86.7 -64.32 1.17 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.171 -1.194 . . . . 0.0 110.112 -179.989 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -81.34 119.45 23.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.287 -0.883 . . . . 0.0 110.382 -179.677 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.557 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 5.5 mt -90.62 -46.15 8.46 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.196 -0.94 . . . . 0.0 110.676 -179.882 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.598 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 12.3 m80 -111.72 78.63 1.14 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.168 -0.957 . . . . 0.0 110.353 -178.932 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.404 ' HA3' ' HA ' ' A' ' 32' ' ' CYS . . . 178.72 -160.9 26.99 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.963 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -127.56 138.7 52.96 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.401 -1.058 . . . . 0.0 110.221 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -81.5 134.88 35.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.246 -0.909 . . . . 0.0 110.199 179.969 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.52 ' CD1' ' O ' ' A' ' 19' ' ' CYS . 24.3 mm -142.59 172.81 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.262 -0.899 . . . . 0.0 110.262 -179.908 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.477 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 8.8 t80 -137.03 138.25 40.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.242 -0.911 . . . . 0.0 109.58 179.866 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.578 HD23 ' CD2' ' A' ' 29' ' ' TYR . 3.3 mm? -100.51 136.42 40.42 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.973 -1.079 . . . . 0.0 111.28 -179.26 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.513 HG13 ' N ' ' A' ' 24' ' ' ASP . 10.7 p -90.72 -27.18 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.509 -0.744 . . . . 0.0 110.497 179.847 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.513 ' N ' HG13 ' A' ' 23' ' ' VAL . 4.5 m-20 -78.24 -17.21 56.99 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.122 -0.986 . . . . 0.0 108.886 179.426 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.532 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.9 mtm -143.38 64.86 1.33 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.726 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.465 ' C ' ' O ' ' A' ' 25' ' ' MET . 66.1 p -29.12 88.4 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.699 0.761 . . . . 0.0 111.733 -178.32 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.532 ' N ' ' O ' ' A' ' 25' ' ' MET . 4.4 pt20 -160.39 177.79 10.24 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.659 -0.651 . . . . 0.0 109.444 179.557 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -81.1 156.08 25.96 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.233 -0.917 . . . . 0.0 110.235 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.578 ' CD2' HD23 ' A' ' 22' ' ' LEU . 2.8 t80 -150.22 95.34 2.26 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.307 -0.871 . . . . 0.0 110.132 -179.959 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 4.0 m -102.36 106.9 17.75 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.195 -0.941 . . . . 0.0 110.105 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.404 ' C ' ' HD3' ' A' ' 31' ' ' ARG . 15.3 tpp85 -79.52 97.93 6.64 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.177 -0.952 . . . . 0.0 109.504 179.602 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 77.9 m -79.73 175.91 10.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.445 -0.785 . . . . 0.0 110.525 -179.39 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -79.85 124.76 28.93 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.395 -0.815 . . . . 0.0 109.618 179.864 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.1 t -65.16 -9.0 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.388 -0.82 . . . . 0.0 110.335 -179.423 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -78.48 -3.22 86.13 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 179.863 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.598 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.9 OUTLIER -79.9 168.22 19.53 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.036 -1.273 . . . . 0.0 109.684 179.75 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.596 HG21 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -108.22 32.09 5.06 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.929 -1.107 . . . . 0.0 110.784 -179.595 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -147.93 171.38 28.45 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.269 -1.532 . . . . 0.0 109.269 179.437 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.0 p -86.18 21.13 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.17 -1.194 . . . . 0.0 109.946 179.828 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.523 ' O ' ' CB ' ' A' ' 41' ' ' CYS . 41.0 ttp180 -137.48 -95.62 0.21 Allowed 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.285 -0.885 . . . . 0.0 110.03 -179.674 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.9 p 163.62 73.04 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.78 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.522 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 2.0 tt0 -133.71 -28.93 1.37 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.418 -0.801 . . . . 0.0 110.673 -179.48 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.596 ' CE1' HG21 ' A' ' 37' ' ' THR . 3.5 p80 -128.34 113.46 15.64 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.907 -1.121 . . . . 0.0 109.922 179.236 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.599 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 37.2 t80 -79.41 106.43 11.44 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.463 0.649 . . . . 0.0 110.041 -179.253 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.583 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.86 -29.46 70.41 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.286 -0.884 . . . . 0.0 109.936 -179.679 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.599 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.244 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.248 0.547 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.462 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.7 OUTLIER -110.72 81.45 1.44 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.253 -0.905 . . . . 0.0 110.114 179.922 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.532 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 2.8 tt -144.74 156.1 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.211 -0.931 . . . . 0.0 110.308 -179.816 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.26 157.16 25.36 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.902 . . . . 0.0 110.244 179.919 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -96.19 165.46 12.21 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.231 -0.918 . . . . 0.0 110.219 -179.987 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 84.3 m -109.26 -152.86 0.5 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 110.342 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.94 -170.45 2.24 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.268 -0.895 . . . . 0.0 110.294 -179.916 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 m -85.24 11.55 9.8 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.904 . . . . 0.0 110.097 179.864 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.36 16.23 11.37 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.9 . . . . 0.0 110.114 -179.903 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.67 20.86 9.36 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.254 -0.904 . . . . 0.0 110.286 -179.87 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.09 72.47 1.09 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.171 -0.956 . . . . 0.0 110.236 -179.988 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -120.51 2.04 12.45 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.454 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 24.7 t80 -119.65 -57.4 1.98 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.184 -1.186 . . . . 0.0 110.246 179.964 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.4 p -90.33 121.65 32.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.237 -0.914 . . . . 0.0 110.366 -179.951 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.523 ' N ' HD22 ' A' ' 15' ' ' LEU . 3.9 mt -90.72 -56.98 2.98 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.152 -0.968 . . . . 0.0 110.714 -179.853 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.593 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 13.2 m80 -100.21 83.74 2.72 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.259 -0.901 . . . . 0.0 110.395 -178.885 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.492 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 176.53 -160.4 27.9 Favored Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.846 -1.301 . . . . 0.0 109.846 -179.8 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.417 ' OE1' ' HA ' ' A' ' 18' ' ' GLN . 2.2 mm100 -124.7 147.43 48.6 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.356 -1.085 . . . . 0.0 110.192 -179.968 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.7 t -93.73 130.12 39.81 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.382 -0.824 . . . . 0.0 110.318 -179.961 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.593 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -142.66 -176.95 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.42 -0.8 . . . . 0.0 109.978 179.867 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.466 ' O ' HG13 ' A' ' 3' ' ' ILE . 9.7 t80 -143.47 124.81 14.66 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.152 -0.968 . . . . 0.0 109.957 -179.92 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.429 HD13 HD12 ' A' ' 3' ' ' ILE . 1.9 mp -79.49 128.36 33.26 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.003 -1.061 . . . . 0.0 111.317 -179.269 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.462 HG11 ' HB3' ' A' ' 2' ' ' SER . 5.5 p -90.38 -26.16 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.688 -0.633 . . . . 0.0 110.417 179.788 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -78.17 -11.89 59.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.099 -1.001 . . . . 0.0 108.659 178.951 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 10.0 ttm -150.55 68.24 0.96 Allowed 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.929 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 13.7 p -29.19 89.86 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 121.745 0.783 . . . . 0.0 111.344 -178.471 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.1 147.65 18.14 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.738 -0.602 . . . . 0.0 109.725 -179.965 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.518 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.0 m-20 -64.87 124.49 22.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.442 -0.786 . . . . 0.0 110.133 -179.953 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.473 ' O ' HG12 ' A' ' 20' ' ' ILE . 4.8 t80 -116.54 132.43 56.68 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.413 -0.805 . . . . 0.0 109.931 -179.866 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -129.64 112.63 13.87 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.092 -1.005 . . . . 0.0 110.374 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.492 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.7 OUTLIER -86.0 115.04 23.36 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.255 -0.903 . . . . 0.0 109.451 179.389 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 91.9 m -78.89 179.41 7.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.15 -0.969 . . . . 0.0 110.61 -179.408 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.463 ' OE2' ' CE1' ' A' ' 44' ' ' PHE . 22.3 tt0 -83.89 116.51 22.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.392 -0.818 . . . . 0.0 110.404 -179.543 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.1 t -52.43 101.67 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.192 -0.943 . . . . 0.0 109.555 179.523 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.472 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 147.9 -10.61 1.22 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.61 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.593 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.4 m-85 -78.78 160.21 27.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.897 -1.354 . . . . 0.0 109.465 179.769 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.6 HG23 ' CE1' ' A' ' 43' ' ' HIS . 1.0 OUTLIER -105.72 -4.62 20.74 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.841 -1.162 . . . . 0.0 111.125 -179.084 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.505 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -98.34 140.89 15.28 Favored Glycine 0 N--CA 1.488 2.11 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.778 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.425 ' C ' ' O ' ' A' ' 38' ' ' GLY . 8.5 p -44.85 -25.73 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.133 -1.216 . . . . 0.0 108.807 179.072 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.533 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 7.4 ttp180 -102.15 -130.67 0.25 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.218 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -151.72 75.64 1.16 Allowed 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 179.011 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.533 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 0.9 OUTLIER -123.82 -29.9 3.62 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.394 -0.816 . . . . 0.0 110.336 -179.264 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.6 ' CE1' HG23 ' A' ' 37' ' ' THR . 3.0 p80 -130.45 117.09 19.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.961 -1.087 . . . . 0.0 110.05 179.443 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.594 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 44.6 t80 -79.28 104.38 9.86 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 121.494 0.664 . . . . 0.0 110.002 -179.351 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.576 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.67 -32.87 74.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.466 -0.771 . . . . 0.0 110.172 -179.515 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.594 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.9 mt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.248 179.963 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 97.8 t . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.331 0.586 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.491 ' N ' HG12 ' A' ' 23' ' ' VAL . 16.5 t -80.06 84.44 5.79 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.12 -0.988 . . . . 0.0 110.222 -179.985 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.539 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.81 149.58 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.328 -0.858 . . . . 0.0 110.124 179.964 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -119.0 161.3 20.45 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 110.241 -179.949 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -110.38 165.9 11.41 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.333 -0.854 . . . . 0.0 110.206 179.957 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 72.5 m -112.96 -155.59 0.57 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.229 -0.919 . . . . 0.0 110.206 -179.991 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 m -135.61 -164.13 1.49 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.256 -0.903 . . . . 0.0 110.318 179.961 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.53 10.3 13.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 0.0 110.216 -179.983 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -123.13 19.23 9.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 0.0 110.181 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.79 23.06 2.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.893 . . . . 0.0 110.175 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.407 ' OD1' ' SG ' ' A' ' 14' ' ' CYS . 0.9 OUTLIER -106.25 68.3 0.76 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.221 -0.924 . . . . 0.0 110.206 -179.978 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -109.22 43.65 1.67 Allowed Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 179.948 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -156.93 -58.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.297 -1.119 . . . . 0.0 110.204 -179.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.6 p -91.15 118.87 30.79 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.265 -0.897 . . . . 0.0 110.295 -179.912 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.567 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.8 mt -90.43 -43.13 10.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.117 -0.99 . . . . 0.0 110.325 179.8 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.583 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 7.9 m80 -111.65 78.02 1.09 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.251 -0.905 . . . . 0.0 110.163 -179.486 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.41 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 176.07 -171.02 44.06 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -114.44 146.41 40.67 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.2 -1.176 . . . . 0.0 110.326 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.4 t -84.47 147.47 27.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.322 -0.861 . . . . 0.0 110.037 179.805 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.539 ' CG2' HG12 ' A' ' 3' ' ' ILE . 0.7 OUTLIER -155.35 -177.59 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.147 -0.971 . . . . 0.0 110.107 -179.805 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.473 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 14.8 t80 -142.36 132.66 24.88 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.282 -0.886 . . . . 0.0 109.98 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.593 HD21 ' CD2' ' A' ' 29' ' ' TYR . 1.5 mm? -94.47 134.5 36.94 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.126 -0.984 . . . . 0.0 111.016 -179.339 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.525 HG11 ' N ' ' A' ' 24' ' ' ASP . 10.7 p -90.92 -24.94 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.297 -0.877 . . . . 0.0 110.524 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.525 ' N ' HG11 ' A' ' 23' ' ' VAL . 3.3 p30 -78.56 -15.68 58.29 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.044 -1.035 . . . . 0.0 108.956 179.314 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.544 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.5 ttp -146.01 66.48 1.2 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 178.899 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.91 88.56 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 122.001 0.905 . . . . 0.0 111.877 -178.223 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 tt0 -160.86 173.79 14.82 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 121.318 0.58 . . . . 0.0 109.935 179.401 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -77.19 140.99 40.3 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.462 -0.774 . . . . 0.0 110.23 -179.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.593 ' CD2' HD21 ' A' ' 22' ' ' LEU . 9.8 t80 -135.64 113.94 11.51 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.356 -0.84 . . . . 0.0 110.031 179.894 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 15.4 m -117.85 116.97 28.03 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.045 -1.034 . . . . 0.0 110.41 -179.809 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.41 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.2 tpp85 -79.49 118.34 21.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.155 -0.966 . . . . 0.0 109.447 179.431 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 95.7 m -79.52 170.76 16.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.392 -0.818 . . . . 0.0 110.573 -179.329 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -79.48 117.14 20.16 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.358 -0.839 . . . . 0.0 109.968 179.974 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 36.4 t -50.13 103.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.296 -0.877 . . . . 0.0 109.686 179.966 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.74 -12.75 1.32 Allowed Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.67 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.32 172.14 14.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.203 -1.175 . . . . 0.0 109.648 179.85 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.593 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.72 29.78 6.91 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.906 -1.121 . . . . 0.0 110.524 179.974 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.55 160.08 31.5 Favored Glycine 0 N--CA 1.489 2.186 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.547 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 11.7 p -88.88 27.09 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.177 -1.19 . . . . 0.0 109.536 179.321 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.559 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -132.95 14.31 4.29 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.48 -0.762 . . . . 0.0 109.738 -179.667 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.9 p 32.62 87.63 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 121.467 0.651 . . . . 0.0 110.601 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.559 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 1.1 tp10 -156.09 -34.81 0.09 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.405 -0.809 . . . . 0.0 110.644 -179.61 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.593 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.4 p80 -120.46 119.21 32.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.882 -1.136 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.607 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 17.3 t80 -84.21 111.74 19.64 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-O 121.247 0.546 . . . . 0.0 109.859 -179.728 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.568 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -68.43 -23.71 64.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.285 -0.884 . . . . 0.0 109.655 -179.78 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.607 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.8 mt . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.269 -179.819 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.258 0.551 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.455 ' HB2' HG11 ' A' ' 23' ' ' VAL . 2.6 m -132.78 107.1 8.14 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.217 -0.927 . . . . 0.0 110.403 -179.95 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.53 ' CD1' ' HB ' ' A' ' 20' ' ' ILE . 1.7 tt -129.51 157.37 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.294 -0.879 . . . . 0.0 109.991 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.479 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -121.57 168.06 12.17 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.212 -0.93 . . . . 0.0 110.262 -179.913 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.29 159.51 14.9 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.206 -0.934 . . . . 0.0 110.234 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 65.1 m -104.59 -147.99 0.4 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.242 -0.911 . . . . 0.0 110.147 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -127.48 -171.4 2.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.247 -0.908 . . . . 0.0 110.212 -179.934 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.8 t -79.81 -55.42 5.0 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.253 -0.904 . . . . 0.0 110.167 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -63.07 -11.3 18.67 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.242 -0.911 . . . . 0.0 110.149 179.906 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.7 ttm -88.14 27.37 1.22 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.253 -0.905 . . . . 0.0 110.225 -179.986 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -121.85 69.89 0.94 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.219 -0.926 . . . . 0.0 110.232 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -119.7 3.29 13.44 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -108.77 -50.53 3.0 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.159 -1.201 . . . . 0.0 110.182 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 22.3 p -104.07 120.09 40.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.216 -0.928 . . . . 0.0 110.271 179.932 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.565 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 10.1 mt -90.17 -43.22 10.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.298 -0.876 . . . . 0.0 110.519 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.565 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.6 m80 -110.53 86.88 2.4 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.134 -0.979 . . . . 0.0 110.258 -179.503 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.448 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.68 -131.39 2.11 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.968 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -160.35 149.71 17.47 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.233 -1.157 . . . . 0.0 110.236 179.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.2 t -94.54 147.54 23.17 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.195 -0.941 . . . . 0.0 110.194 179.948 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.637 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 19.0 pt -157.7 167.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.302 -0.874 . . . . 0.0 110.063 179.96 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.479 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 12.4 t80 -120.36 118.84 31.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.205 -0.934 . . . . 0.0 110.065 -179.983 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.59 HD13 ' CD2' ' A' ' 29' ' ' TYR . 11.3 mt -83.45 135.89 34.51 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.242 -0.912 . . . . 0.0 110.766 -179.751 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.524 HG12 ' N ' ' A' ' 24' ' ' ASP . 7.2 p -88.32 -29.0 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.398 -0.814 . . . . 0.0 110.078 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.524 ' N ' HG12 ' A' ' 23' ' ' VAL . 2.6 p30 -78.41 -22.8 47.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.208 -0.933 . . . . 0.0 108.716 179.191 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.1 mmt -134.23 61.14 1.68 Allowed 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 178.526 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.466 ' C ' ' O ' ' A' ' 25' ' ' MET . 3.2 p -28.74 86.2 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 121.576 0.703 . . . . 0.0 111.883 -178.46 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 pt20 -161.21 167.56 25.83 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.576 -0.702 . . . . 0.0 109.556 179.526 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' ' OD1' ' A' ' 28' ' ' ASN . 7.0 p30 -82.51 90.58 6.77 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.327 -0.858 . . . . 0.0 109.787 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.637 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 5.4 t80 -79.7 131.92 36.07 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.405 -0.809 . . . . 0.0 110.283 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -120.58 113.21 19.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.169 -0.957 . . . . 0.0 110.368 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.503 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . 3.0 tpm_? -81.73 116.95 21.67 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.193 -0.942 . . . . 0.0 109.461 179.452 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 66.9 m -79.06 173.63 12.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.279 -0.888 . . . . 0.0 110.136 -179.793 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -79.42 111.65 15.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.284 -0.885 . . . . 0.0 109.909 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.3 t -49.15 103.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.446 -0.784 . . . . 0.0 109.727 -179.959 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 141.71 -7.28 2.46 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -179.741 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.558 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.25 179.97 7.09 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.175 -1.191 . . . . 0.0 109.796 179.853 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -116.5 23.91 11.71 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.915 -1.116 . . . . 0.0 110.731 -179.629 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -149.65 157.78 27.38 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.545 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.6 p -85.78 40.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.248 -1.149 . . . . 0.0 109.797 179.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.56 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.03 21.07 0.16 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.452 -0.78 . . . . 0.0 109.973 -179.522 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 8.8 p 32.32 84.85 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.665 -0.647 . . . . 0.0 110.745 -179.702 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.56 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 23.8 tt0 -146.01 -41.53 0.21 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.405 -0.809 . . . . 0.0 109.967 -179.878 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.8 p-80 -119.43 128.69 54.26 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.11 -0.994 . . . . 0.0 110.372 179.598 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.6 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 34.4 t80 -86.68 130.32 34.53 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 121.383 0.611 . . . . 0.0 110.434 -178.504 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.544 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -91.64 -37.29 13.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 109.849 -179.878 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.6 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.3 mt . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.201 -179.663 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 42.2 t . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.26 0.553 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.98 114.33 8.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.264 -0.897 . . . . 0.0 110.336 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.51 ' CD1' ' HB ' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -128.19 150.25 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.259 -0.901 . . . . 0.0 110.086 179.841 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.48 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -118.77 -163.61 0.97 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.206 -0.934 . . . . 0.0 110.173 179.93 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -130.74 154.4 48.0 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.13 -0.981 . . . . 0.0 110.352 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 94.6 m -83.81 -165.35 1.1 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.408 -0.807 . . . . 0.0 110.239 179.926 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.48 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.4 OUTLIER -125.69 -158.41 0.84 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.301 -0.874 . . . . 0.0 110.114 179.812 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.48 ' N ' ' OG ' ' A' ' 7' ' ' SER . 2.8 m -79.93 168.97 18.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.154 -0.967 . . . . 0.0 110.126 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 50.48 20.94 0.76 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.206 -0.934 . . . . 0.0 110.235 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tpp -122.85 -15.52 7.38 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.201 -0.937 . . . . 0.0 110.181 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -89.16 52.48 2.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.315 -0.866 . . . . 0.0 110.354 -179.941 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -109.63 1.94 30.63 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.437 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 45.9 t80 -93.4 -57.3 2.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.203 -1.175 . . . . 0.0 110.128 179.999 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.3 p -97.54 119.74 36.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.271 -0.893 . . . . 0.0 110.111 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.545 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.3 mt -90.24 -45.18 9.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.221 -0.924 . . . . 0.0 110.303 -179.999 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.568 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 6.5 m80 -108.59 85.71 2.16 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.297 -0.877 . . . . 0.0 110.224 -179.591 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.466 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 169.82 -174.75 44.05 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.03 145.76 30.97 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.268 -1.136 . . . . 0.0 110.311 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 5.6 t -96.08 130.07 43.19 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.365 -0.834 . . . . 0.0 110.385 -179.932 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.579 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.7 177.53 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.372 -0.83 . . . . 0.0 110.102 179.994 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.48 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 13.8 t80 -128.0 135.14 49.49 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.289 -0.882 . . . . 0.0 109.703 179.707 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.608 HD21 ' CD2' ' A' ' 29' ' ' TYR . 1.2 mm? -92.86 132.86 36.64 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.979 -1.076 . . . . 0.0 111.149 -179.309 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.463 HG13 ' N ' ' A' ' 24' ' ' ASP . 9.1 p -90.87 -31.7 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.461 -0.775 . . . . 0.0 110.586 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.463 ' N ' HG13 ' A' ' 23' ' ' VAL . 48.1 t0 -78.06 -19.67 53.82 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.124 -0.985 . . . . 0.0 108.78 179.403 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 27' ' ' GLN . 35.8 mtt -137.19 61.56 1.62 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.608 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 89.5 p -29.21 87.79 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 121.614 0.721 . . . . 0.0 111.584 -178.499 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.557 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.4 pt20 -160.73 171.46 18.81 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.66 -0.65 . . . . 0.0 109.648 179.689 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -79.72 115.86 19.56 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.447 -0.783 . . . . 0.0 110.292 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.608 ' CD2' HD21 ' A' ' 22' ' ' LEU . 5.7 t80 -105.67 141.47 37.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.349 -0.844 . . . . 0.0 109.717 179.804 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 14.3 m -141.58 112.05 7.02 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.017 -1.052 . . . . 0.0 110.694 -179.562 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.466 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.5 OUTLIER -81.04 112.84 18.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.207 -0.933 . . . . 0.0 109.427 179.291 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 95.8 m -79.36 172.4 13.85 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.307 -0.871 . . . . 0.0 110.519 -179.507 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -79.39 114.03 18.0 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.441 -0.787 . . . . 0.0 109.965 -179.849 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.1 t -46.08 102.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.27 -0.894 . . . . 0.0 109.709 179.961 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.36 -13.1 1.4 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -179.666 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.568 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -79.28 176.03 10.05 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.162 -1.199 . . . . 0.0 109.852 179.892 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.604 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -117.29 26.33 9.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.906 -1.121 . . . . 0.0 110.784 -179.78 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -147.66 160.5 28.32 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.819 -1.313 . . . . 0.0 109.819 179.607 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.508 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 69.9 t -86.8 19.14 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.325 -1.103 . . . . 0.0 109.818 179.59 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.543 ' CD ' ' O ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -140.23 21.72 2.41 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.522 -0.736 . . . . 0.0 109.672 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 5.9 p 32.31 93.04 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 CA-C-O 121.493 0.663 . . . . 0.0 111.118 179.711 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.527 ' HB3' ' NH2' ' A' ' 40' ' ' ARG . 30.1 tt0 -156.61 -38.04 0.08 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.358 -0.839 . . . . 0.0 110.232 179.714 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.604 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.2 p-80 -117.36 129.59 55.96 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.029 -1.044 . . . . 0.0 110.611 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.606 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.5 t80 -88.13 130.28 35.08 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.433 0.635 . . . . 0.0 110.376 -178.737 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.582 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -94.39 -33.45 13.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.454 -0.779 . . . . 0.0 110.277 -179.65 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.606 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.2 mt . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.291 -179.745 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.444 ' O ' ' CG2' ' A' ' 1' ' ' VAL . 6.2 p . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.195 0.522 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.438 ' HB3' HG13 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -139.26 49.56 1.83 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.323 -0.861 . . . . 0.0 110.227 179.998 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.539 HG12 ' CG2' ' A' ' 20' ' ' ILE . 9.5 tt -83.37 166.48 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.315 -0.866 . . . . 0.0 110.185 -179.987 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.48 ' O ' HG21 ' A' ' 20' ' ' ILE . 4.2 m -137.98 165.47 26.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.197 -0.939 . . . . 0.0 110.547 -179.631 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -91.83 154.39 18.93 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.241 -0.912 . . . . 0.0 110.223 179.892 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.7 m -91.71 -141.15 0.18 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.32 -0.863 . . . . 0.0 110.259 -179.984 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.519 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.5 OUTLIER -159.47 -155.2 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.286 -0.884 . . . . 0.0 109.962 -179.931 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.519 ' N ' ' OG ' ' A' ' 7' ' ' SER . 0.1 OUTLIER -79.67 166.47 21.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.063 -1.023 . . . . 0.0 109.871 179.936 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 50.84 20.86 0.83 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.083 -1.01 . . . . 0.0 110.19 -179.822 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.99 14.23 5.76 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.175 -0.953 . . . . 0.0 110.202 -179.866 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.4 ' OD1' ' N ' ' A' ' 11' ' ' ASN . 10.3 m-20 -118.35 -141.11 0.36 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.236 -0.915 . . . . 0.0 110.389 -179.878 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.14 49.57 3.03 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.286 -1.526 . . . . 0.0 109.286 -179.817 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.488 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 8.6 t80 -155.0 -70.27 0.12 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.314 -1.109 . . . . 0.0 109.938 -179.819 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -87.87 125.99 34.78 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.072 -1.017 . . . . 0.0 110.33 179.74 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.524 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 3.9 mt -90.19 -49.04 6.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.19 -0.943 . . . . 0.0 110.142 179.765 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.524 ' ND1' ' HB2' ' A' ' 15' ' ' LEU . 10.4 m80 -104.83 77.21 1.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.219 -0.926 . . . . 0.0 110.112 -179.838 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.48 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -176.98 -178.97 47.14 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.868 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.53 140.46 41.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.255 -1.144 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 8.4 t -79.76 147.66 31.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.197 -0.939 . . . . 0.0 109.828 179.854 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.539 ' CG2' HG12 ' A' ' 3' ' ' ILE . 0.3 OUTLIER -154.22 -170.0 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.152 -0.968 . . . . 0.0 110.001 -179.693 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.475 ' O ' HG13 ' A' ' 3' ' ' ILE . 8.6 t80 -147.88 128.39 14.07 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.077 -1.014 . . . . 0.0 109.857 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.584 HD21 ' CD2' ' A' ' 29' ' ' TYR . 0.8 OUTLIER -84.19 131.78 34.73 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.196 -0.94 . . . . 0.0 111.103 -179.31 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.438 HG13 ' HB3' ' A' ' 2' ' ' SER . 8.6 p -90.54 -28.31 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.343 -0.848 . . . . 0.0 110.587 179.732 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.52 ' OD2' ' CD1' ' A' ' 22' ' ' LEU . 1.9 p30 -78.43 -15.25 58.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.019 -1.05 . . . . 0.0 108.789 179.229 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -144.45 65.55 1.28 Allowed 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 178.733 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.487 ' C ' ' O ' ' A' ' 25' ' ' MET . 40.3 p -29.15 89.38 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.702 0.763 . . . . 0.0 111.542 -178.355 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 pt20 -157.81 168.89 25.9 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.737 -0.602 . . . . 0.0 109.419 179.51 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -77.22 124.96 28.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.283 -0.886 . . . . 0.0 110.594 -179.615 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.584 ' CD2' HD21 ' A' ' 22' ' ' LEU . 35.5 t80 -110.83 158.39 18.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.402 -0.811 . . . . 0.0 109.77 179.73 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.9 m -158.1 108.38 2.13 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.058 -1.026 . . . . 0.0 110.503 -179.95 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.48 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.8 tpp180 -81.29 115.04 20.48 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.88 . . . . 0.0 109.666 179.681 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 97.5 m -79.4 175.06 10.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.167 -0.958 . . . . 0.0 110.521 -179.56 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -79.46 117.94 20.88 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.367 -0.833 . . . . 0.0 110.383 -179.792 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -49.94 99.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.283 -0.886 . . . . 0.0 109.914 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 152.35 -16.84 0.77 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.847 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.472 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.0 OUTLIER -79.55 172.92 13.14 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.147 -1.207 . . . . 0.0 110.023 179.947 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.598 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -113.29 31.47 6.44 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.017 -1.052 . . . . 0.0 110.518 -179.636 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.32 162.9 33.62 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.448 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.468 ' O ' ' OH ' ' A' ' 13' ' ' TYR . 2.4 m -84.34 14.73 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.345 -1.091 . . . . 0.0 109.733 179.546 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.56 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -128.26 18.18 6.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.386 -0.821 . . . . 0.0 109.852 -179.444 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.6 p 27.33 91.06 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 CA-C-O 121.402 0.62 . . . . 0.0 111.369 179.493 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.554 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 10.8 tm-20 -156.6 -37.79 0.08 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.398 -0.814 . . . . 0.0 110.284 179.752 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.598 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 3.1 p-80 -114.86 128.44 56.29 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.008 -1.058 . . . . 0.0 110.523 179.887 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.625 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 15.7 t80 -86.63 126.33 34.44 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.459 0.647 . . . . 0.0 109.842 -179.009 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.584 ' O ' ' CG ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -85.27 12.47 8.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.447 -0.783 . . . . 0.0 109.955 -179.329 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.625 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.5 mt . . . . . 0 C--N 1.302 -1.479 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.395 -179.748 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 17.3 t . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 121.31 0.576 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.531 ' CB ' HG13 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -157.22 156.56 32.77 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.31 -0.869 . . . . 0.0 109.959 179.871 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.538 ' CD1' HG21 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -153.68 164.94 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.238 -0.914 . . . . 0.0 110.267 -179.802 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.448 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 3.7 m -148.52 167.16 26.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 0.0 110.219 179.984 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.41 168.99 9.04 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 110.027 179.908 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 57.0 m -86.49 -166.3 1.51 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.177 -0.952 . . . . 0.0 110.169 -179.937 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.84 -64.85 0.69 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.313 -0.867 . . . . 0.0 110.314 -179.963 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.44 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 0.5 OUTLIER -153.69 -71.17 0.14 Allowed 'General case' 0 C--N 1.291 -1.946 0 O-C-N 121.78 -0.575 . . . . 0.0 110.377 -179.961 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -62.72 -11.18 15.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.205 -0.934 . . . . 0.0 110.218 -179.972 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.438 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -104.27 39.5 1.64 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.258 -0.901 . . . . 0.0 110.159 179.898 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.44 ' OD1' ' O ' ' A' ' 8' ' ' SER . 41.4 p-10 -137.74 21.44 2.88 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.284 -0.885 . . . . 0.0 110.337 -179.885 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -100.18 75.14 0.44 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.971 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -160.28 -58.43 0.06 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.264 -1.139 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -97.25 118.2 33.15 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.342 -0.849 . . . . 0.0 110.605 -179.718 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.58 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.7 mt -75.77 -40.69 54.84 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 109.887 179.706 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.583 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 6.4 m80 -119.85 89.36 3.11 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.414 -0.804 . . . . 0.0 110.584 -179.096 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.45 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 171.08 -177.81 43.83 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 179.791 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -108.06 153.46 23.09 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.294 -1.121 . . . . 0.0 110.306 179.86 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -92.05 133.66 35.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.377 -0.827 . . . . 0.0 110.539 -179.809 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.538 HG21 ' CD1' ' A' ' 3' ' ' ILE . 9.4 mm -142.71 178.67 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.35 -0.844 . . . . 0.0 109.883 179.968 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.448 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 20.6 t80 -147.68 129.45 15.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.986 -1.071 . . . . 0.0 110.252 179.952 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.613 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 2.9 mm? -88.65 131.78 34.84 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.267 -0.896 . . . . 0.0 110.749 -179.662 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.531 HG13 ' CB ' ' A' ' 2' ' ' SER . 8.4 p -90.57 -23.19 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.341 -0.849 . . . . 0.0 110.612 179.88 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.529 ' N ' HG12 ' A' ' 23' ' ' VAL . 9.6 t70 -78.59 -12.43 60.02 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.003 -1.061 . . . . 0.0 108.806 179.28 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -151.01 68.9 0.95 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.957 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.489 ' C ' ' O ' ' A' ' 25' ' ' MET . 40.1 p -29.02 89.52 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.791 0.805 . . . . 0.0 111.308 -178.419 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.55 148.09 17.69 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.726 -0.609 . . . . 0.0 109.367 -179.883 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.52 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.2 m-80 -60.68 146.21 46.46 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.197 -0.94 . . . . 0.0 110.399 -179.635 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.613 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 3.5 t80 -142.73 102.85 4.12 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.441 -0.787 . . . . 0.0 109.991 179.984 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.9 m -108.62 119.03 38.33 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.108 -0.995 . . . . 0.0 110.278 -179.951 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.45 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -78.98 137.33 37.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.107 -0.996 . . . . 0.0 109.216 179.476 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.621 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.8 m -79.54 169.3 18.23 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.281 -0.887 . . . . 0.0 110.025 -179.528 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.529 ' O ' ' N ' ' A' ' 35' ' ' GLY . 9.6 tt0 -78.59 112.26 15.49 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.309 -0.869 . . . . 0.0 108.709 179.21 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.465 ' C ' ' O ' ' A' ' 33' ' ' GLU . 38.3 t -36.12 93.17 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 121.479 0.657 . . . . 0.0 110.475 -179.071 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 149.72 -15.77 1.07 Allowed Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.649 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.4 m-85 -81.12 169.24 17.66 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.137 -1.213 . . . . 0.0 109.922 179.939 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.622 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 5.2 t -122.55 45.55 2.35 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.968 -1.082 . . . . 0.0 111.171 -179.77 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.53 156.08 27.32 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.963 -1.255 . . . . 0.0 109.963 179.568 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.466 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 79.2 t -89.07 21.27 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.327 -1.102 . . . . 0.0 109.487 179.288 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.551 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 6.5 ttp180 -122.78 -19.23 6.28 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.568 -0.708 . . . . 0.0 109.978 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.621 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.7 m 69.51 70.26 0.25 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.172 -0.955 . . . . 0.0 110.234 179.281 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.551 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -141.03 -29.25 0.66 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.19 -0.944 . . . . 0.0 111.255 -179.838 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.622 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 6.0 p80 -125.63 120.46 30.84 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.623 -1.298 . . . . 0.0 111.214 179.963 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.591 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 51.6 t80 -82.57 103.14 11.88 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.295 0.569 . . . . 0.0 109.678 179.773 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.572 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.59 -30.34 71.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.239 -0.913 . . . . 0.0 110.237 -179.29 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.591 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.2 mt . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.13 -0.981 . . . . 0.0 110.147 -179.986 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.24 0.543 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.456 ' HB3' HG13 ' A' ' 23' ' ' VAL . 6.3 t -101.8 54.46 0.81 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.171 -0.956 . . . . 0.0 110.205 -179.979 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.464 ' O ' HG21 ' A' ' 3' ' ' ILE . 0.9 OUTLIER -80.63 141.18 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.29 -0.881 . . . . 0.0 110.216 -179.933 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.402 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -101.33 158.53 15.98 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.306 -179.97 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -108.17 151.49 25.85 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.302 -0.874 . . . . 0.0 110.019 179.864 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 61.3 m -97.81 -159.86 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.269 -0.895 . . . . 0.0 110.365 -179.94 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.7 t -145.12 -146.47 0.19 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.204 -0.935 . . . . 0.0 110.198 179.996 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.435 ' O ' ' N ' ' A' ' 10' ' ' MET . 23.7 t -79.87 168.02 19.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.224 -0.922 . . . . 0.0 110.134 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' A' ' 8' ' ' SER . 20.0 t0 42.08 26.93 0.06 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.262 -0.899 . . . . 0.0 110.288 179.954 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.435 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -125.78 -0.86 7.33 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.261 -0.9 . . . . 0.0 110.321 -179.892 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.422 ' O ' ' CG ' ' A' ' 11' ' ' ASN . 24.4 p-10 -140.03 105.53 5.09 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.169 -0.957 . . . . 0.0 110.194 -179.976 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.45 20.79 6.9 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.902 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.44 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 71.0 t80 -110.62 -55.57 2.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.189 -1.183 . . . . 0.0 110.273 -179.899 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.2 p -93.52 123.27 36.72 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.274 -0.891 . . . . 0.0 110.268 -179.818 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.541 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -90.18 -43.65 10.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.111 -0.993 . . . . 0.0 110.416 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.562 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 9.2 m80 -107.87 85.89 2.2 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.265 -0.897 . . . . 0.0 110.233 -179.513 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.462 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.93 -165.1 36.1 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.983 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -121.28 134.79 55.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.38 -1.07 . . . . 0.0 110.31 -179.955 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 10.7 t -84.47 141.76 30.55 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 110.125 179.903 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.545 HD13 ' CD1' ' A' ' 29' ' ' TYR . 9.5 pt -157.7 -167.38 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.183 -0.948 . . . . 0.0 110.059 -179.778 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.501 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 12.1 t80 -144.18 133.54 23.23 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.269 -0.895 . . . . 0.0 110.086 179.984 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.59 HD22 ' CD2' ' A' ' 29' ' ' TYR . 1.6 mm? -87.66 132.62 34.03 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.138 -0.976 . . . . 0.0 110.671 -179.642 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.456 HG13 ' HB3' ' A' ' 2' ' ' SER . 4.8 p -90.71 -22.31 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.256 -0.903 . . . . 0.0 110.674 179.797 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.416 ' OD2' HD11 ' A' ' 22' ' ' LEU . 12.5 p30 -78.46 -9.63 59.38 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.014 -1.054 . . . . 0.0 108.913 179.26 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -157.35 70.85 0.62 Allowed 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.146 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.501 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 12.5 p -29.32 89.43 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 121.768 0.794 . . . . 0.0 111.307 -178.587 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.18 149.61 17.7 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.704 -0.623 . . . . 0.0 109.478 -179.7 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.509 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 3.3 t-20 -61.09 135.13 57.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.215 -0.928 . . . . 0.0 110.227 -179.857 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.59 ' CD2' HD22 ' A' ' 22' ' ' LEU . 7.2 t80 -129.07 126.24 38.99 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.445 -0.785 . . . . 0.0 109.74 -179.936 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 8.2 m -123.47 112.78 17.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.98 . . . . 0.0 110.718 -179.554 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.462 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 8.9 tpp85 -79.51 111.35 15.7 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.272 -0.893 . . . . 0.0 109.686 179.568 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 68.5 m -79.32 167.74 20.49 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.222 -0.924 . . . . 0.0 110.027 -179.871 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -79.82 106.36 11.78 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.295 -0.878 . . . . 0.0 110.225 -179.727 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.6 m -47.25 107.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 O-C-N 121.399 -0.813 . . . . 0.0 109.674 179.583 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.13 -10.77 2.04 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.305 -1.518 . . . . 0.0 109.305 -179.369 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.562 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -78.66 178.97 7.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.197 -1.178 . . . . 0.0 109.692 179.862 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.598 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -106.7 -43.92 4.58 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 118.538 -1.265 . . . . 0.0 110.584 -179.989 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.73 158.03 42.5 Favored Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.635 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.8 p -84.99 44.88 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.12 -1.224 . . . . 0.0 109.696 179.756 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.26 27.21 0.17 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.407 -0.808 . . . . 0.0 109.746 -179.438 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 15.2 p 31.33 93.47 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.63 -0.669 . . . . 0.0 111.026 179.778 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 9.9 tm-20 -159.24 -41.77 0.06 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.481 -0.762 . . . . 0.0 110.035 179.938 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.598 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 0.6 OUTLIER -120.14 129.47 54.17 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.06 -1.025 . . . . 0.0 110.669 179.83 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.574 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 35.6 t80 -88.76 125.15 34.75 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.404 -178.758 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.529 ' CB ' HG23 ' A' ' 37' ' ' THR . 0.2 OUTLIER -98.05 -11.83 22.53 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.362 -0.836 . . . . 0.0 110.45 -179.534 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.574 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 6.3 mt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.052 -1.03 . . . . 0.0 110.241 -179.711 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.464 ' O ' HG21 ' A' ' 23' ' ' VAL . 46.6 t . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.215 0.531 . . . . 0.0 110.138 . . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.482 ' CA ' ' HB ' ' A' ' 23' ' ' VAL . 3.1 m -160.3 174.44 14.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.316 -0.865 . . . . 0.0 109.898 179.979 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.471 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 2.7 tt -79.6 148.67 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.233 -0.917 . . . . 0.0 109.803 179.595 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.444 ' CG2' ' N ' ' A' ' 5' ' ' LYS . 4.9 t -160.25 -150.12 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.144 -0.972 . . . . 0.0 110.759 -179.928 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 20' ' ' ILE . 35.6 mtpt -117.28 174.96 5.83 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.417 -0.802 . . . . 0.0 110.28 -179.806 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 14.3 m -113.37 -11.16 13.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.276 -0.89 . . . . 0.0 110.257 -179.802 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.558 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 1.1 m 79.69 -175.26 0.07 Allowed 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.662 -0.649 . . . . 0.0 110.654 179.99 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.472 ' O ' ' ND2' ' A' ' 11' ' ' ASN . 0.2 OUTLIER -78.97 -39.2 34.99 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.299 -0.876 . . . . 0.0 111.363 -179.108 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -84.36 46.13 1.19 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.941 -1.099 . . . . 0.0 109.68 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.53 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -155.17 24.2 0.42 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.429 -0.794 . . . . 0.0 109.815 -179.226 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.472 ' ND2' ' O ' ' A' ' 8' ' ' SER . 15.5 p30 -118.78 -158.24 0.72 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.108 -0.995 . . . . 0.0 109.922 -179.905 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.38 44.6 0.43 Allowed Glycine 0 N--CA 1.488 2.155 0 N-CA-C 109.267 -1.533 . . . . 0.0 109.267 -179.903 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -159.7 -44.38 0.05 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.392 -1.064 . . . . 0.0 110.002 -179.676 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -106.37 131.45 53.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.569 -0.707 . . . . 0.0 109.934 -179.588 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.581 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.1 mt -90.78 -42.58 10.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.346 -0.846 . . . . 0.0 110.438 179.667 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.581 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.8 m80 -113.52 79.24 1.22 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.2 -0.938 . . . . 0.0 110.235 -179.567 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 178.53 -166.83 36.94 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.951 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -131.33 149.18 52.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.282 -1.129 . . . . 0.0 110.239 -179.995 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.7 t -95.87 146.08 24.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.23 -0.919 . . . . 0.0 110.073 179.993 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.648 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 15.1 pt -156.11 -173.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.253 -0.904 . . . . 0.0 110.234 -179.795 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.471 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 12.7 t80 -131.67 145.79 51.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.306 -0.871 . . . . 0.0 109.859 179.782 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.585 HD22 ' CG ' ' A' ' 29' ' ' TYR . 1.4 mm? -103.64 137.75 41.26 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.054 -1.029 . . . . 0.0 111.366 -179.33 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 24' ' ' ASP . 9.3 p -91.16 -27.66 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 110.855 179.865 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.515 ' N ' HG13 ' A' ' 23' ' ' VAL . 10.7 m-20 -77.79 -17.68 57.23 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.071 -1.018 . . . . 0.0 108.831 179.666 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 27' ' ' GLN . 7.0 mtt -144.48 64.38 1.3 Allowed 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 178.698 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 25' ' ' MET . 58.9 p -29.31 86.24 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.711 0.767 . . . . 0.0 111.814 -178.461 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.6 pt20 -161.29 -175.8 5.04 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.605 -0.684 . . . . 0.0 109.467 179.677 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -81.86 145.35 30.42 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.263 -0.898 . . . . 0.0 109.97 179.645 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.648 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 12.3 t80 -141.02 108.67 5.62 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.357 -0.839 . . . . 0.0 109.82 -179.682 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 25.4 m -103.33 112.88 25.96 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.254 -0.904 . . . . 0.0 110.797 -179.499 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -90.33 95.46 10.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.157 -0.964 . . . . 0.0 109.736 179.492 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 92.8 m -79.71 178.91 7.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.224 -0.922 . . . . 0.0 110.057 -179.91 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.51 131.32 36.01 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.237 -0.914 . . . . 0.0 109.803 179.864 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.4 t -66.64 -18.33 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.333 -0.854 . . . . 0.0 110.353 -179.494 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.13 -7.13 49.76 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 179.93 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -90.43 168.32 11.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.219 -1.165 . . . . 0.0 110.233 -179.913 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.595 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -110.86 34.03 4.24 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.119 -0.988 . . . . 0.0 110.497 179.797 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.43 156.93 28.29 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.643 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.524 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 77.0 t -85.07 44.96 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.288 -1.125 . . . . 0.0 109.568 179.54 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.552 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.83 20.92 0.17 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.347 -0.845 . . . . 0.0 109.97 -179.375 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.3 p 26.71 90.94 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 121.485 0.66 . . . . 0.0 111.574 179.631 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.552 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.6 tt0 -155.57 -34.62 0.09 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.835 . . . . 0.0 110.597 179.749 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.595 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.3 p80 -121.89 119.9 32.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.977 -1.077 . . . . 0.0 110.683 179.725 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.561 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 35.4 t80 -83.02 119.34 24.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.718 -0.614 . . . . 0.0 109.743 179.938 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.551 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.4 OUTLIER -89.14 -21.19 23.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.393 -0.817 . . . . 0.0 110.343 -179.435 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.561 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.4 mt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.349 -179.636 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 63.2 t . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.247 0.546 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.474 ' CB ' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -113.99 41.45 2.24 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.212 -0.93 . . . . 0.0 110.102 179.915 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.543 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 5.0 tt -81.69 156.41 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.304 -0.873 . . . . 0.0 110.344 179.939 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.462 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 5.6 t -136.94 -150.67 0.37 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.311 -0.868 . . . . 0.0 110.063 179.87 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.423 ' N ' ' CG2' ' A' ' 4' ' ' THR . 11.1 ttpt -107.67 -178.64 3.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.476 -0.765 . . . . 0.0 110.266 179.986 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 79.5 m -111.95 -154.32 0.54 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.3 -0.875 . . . . 0.0 110.171 -179.947 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.506 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.4 OUTLIER -137.49 -156.57 0.7 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.243 -0.911 . . . . 0.0 110.095 -179.91 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.506 ' N ' ' OG ' ' A' ' 7' ' ' SER . 21.9 t -79.81 167.66 20.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.181 -0.949 . . . . 0.0 110.04 179.93 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 53.11 19.18 1.35 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.176 -0.953 . . . . 0.0 110.173 -179.86 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -119.67 4.51 11.07 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.345 -0.847 . . . . 0.0 110.199 -179.986 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -111.3 90.53 3.36 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.241 -0.912 . . . . 0.0 110.236 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -144.76 40.56 1.14 Allowed Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.983 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -148.13 -57.43 0.23 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.201 -1.176 . . . . 0.0 110.271 179.941 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 28.4 p -97.13 118.86 34.51 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.174 -0.954 . . . . 0.0 110.128 -179.958 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.587 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 12.1 mt -89.27 -40.3 12.92 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.246 -0.909 . . . . 0.0 110.307 -179.974 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.587 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -114.35 81.98 1.64 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.046 -1.034 . . . . 0.0 110.193 -179.651 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -178.28 -173.77 43.97 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.968 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -101.43 144.41 30.26 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.286 -1.126 . . . . 0.0 110.413 -179.985 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 14.8 t -98.35 125.53 43.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.287 -0.883 . . . . 0.0 110.262 -179.959 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.574 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.0 -175.74 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.453 -0.779 . . . . 0.0 110.139 -179.954 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.475 ' O ' HG13 ' A' ' 3' ' ' ILE . 11.8 t80 -138.27 125.96 22.25 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.165 -0.959 . . . . 0.0 110.107 179.975 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.573 HD22 ' CD2' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -80.3 129.8 34.75 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.174 -0.954 . . . . 0.0 110.838 -179.584 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.474 HG12 ' CB ' ' A' ' 2' ' ' SER . 5.0 p -90.59 -28.07 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.391 -0.818 . . . . 0.0 110.438 179.731 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -78.27 -13.52 59.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.069 -1.019 . . . . 0.0 108.719 179.097 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.531 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -147.45 66.31 1.13 Allowed 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.902 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.492 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.9 p -29.29 89.8 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.757 0.789 . . . . 0.0 111.436 -178.604 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -159.08 147.63 18.17 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.693 -0.629 . . . . 0.0 109.481 -179.998 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.513 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.3 m-20 -63.77 109.9 1.88 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.304 -0.872 . . . . 0.0 110.084 -179.987 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.573 ' CD2' HD22 ' A' ' 22' ' ' LEU . 6.2 t80 -98.01 141.25 31.2 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.238 -0.914 . . . . 0.0 109.684 179.871 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 19.5 m -141.95 113.25 7.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.089 -1.007 . . . . 0.0 110.586 -179.497 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -81.5 104.46 11.95 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.197 -0.94 . . . . 0.0 109.625 179.511 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 94.8 m -79.5 168.29 19.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.331 -0.856 . . . . 0.0 110.186 -179.65 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -78.8 127.44 32.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.188 -0.945 . . . . 0.0 109.504 179.783 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.4 t -66.93 -10.3 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.346 -0.846 . . . . 0.0 110.613 -179.19 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -79.44 -5.94 89.09 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 179.835 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.58 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -83.14 178.65 8.01 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.195 -1.18 . . . . 0.0 110.194 -179.95 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -111.85 28.5 8.69 Favored 'General case' 0 N--CA 1.498 1.974 0 C-N-CA 119.046 -1.062 . . . . 0.0 110.16 179.663 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.22 157.75 29.1 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 179.527 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -84.68 43.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -1.162 . . . . 0.0 109.723 179.522 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.556 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -157.03 18.71 0.3 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.463 -0.773 . . . . 0.0 110.135 -179.405 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 13.7 p 29.76 91.4 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.432 -0.793 . . . . 0.0 111.566 179.393 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.543 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.7 tt0 -158.62 -37.74 0.06 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -0.925 . . . . 0.0 110.42 179.507 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 0.6 OUTLIER -119.0 125.13 48.67 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.049 -1.032 . . . . 0.0 110.523 179.83 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.587 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.6 t80 -88.2 126.56 35.21 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.467 0.651 . . . . 0.0 109.865 -179.173 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.543 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -92.71 -28.39 16.67 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.471 -0.768 . . . . 0.0 110.164 -179.394 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.587 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.4 mt . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.45 -179.689 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.275 0.559 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.488 ' O ' ' CG1' ' A' ' 23' ' ' VAL . 0.8 OUTLIER -142.79 113.18 7.27 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.313 -0.867 . . . . 0.0 110.148 -179.992 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.523 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 2.4 tt -107.95 177.69 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.302 -0.874 . . . . 0.0 110.234 -179.941 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.466 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -153.46 169.65 22.64 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.243 -0.911 . . . . 0.0 110.139 -179.936 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.71 167.51 9.85 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 110.196 -179.988 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 39.9 m -102.14 -149.45 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 110.217 179.994 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -139.8 -169.65 2.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.227 -0.921 . . . . 0.0 110.064 -179.979 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 78.4 p -82.46 9.82 8.43 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.938 . . . . 0.0 110.221 179.999 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -123.34 20.29 9.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.19 -0.944 . . . . 0.0 110.209 -179.953 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 9.8 ttt -146.05 22.31 1.39 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.227 -0.92 . . . . 0.0 110.301 -179.971 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -118.19 94.97 4.69 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.305 -0.872 . . . . 0.0 110.203 179.942 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -155.12 28.64 0.64 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.933 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -122.98 -61.74 1.41 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.21 -1.17 . . . . 0.0 110.261 179.94 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.6 p -90.8 119.26 30.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.204 -0.935 . . . . 0.0 110.351 -179.816 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.579 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.4 mt -80.89 -42.9 20.7 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.326 -0.859 . . . . 0.0 109.999 179.794 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.579 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.2 m80 -118.36 80.98 1.61 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.355 -0.841 . . . . 0.0 110.36 -179.421 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.4 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -170.31 165.94 39.19 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.943 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.459 ' HB2' ' HB3' ' A' ' 31' ' ' ARG . 1.4 mt-30 -80.89 148.92 29.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.212 -1.17 . . . . 0.0 110.149 179.946 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 15.3 t -103.38 119.64 39.27 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.34 -0.85 . . . . 0.0 110.255 179.911 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.571 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -142.35 -175.69 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.205 -0.934 . . . . 0.0 110.372 179.959 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.461 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 6.3 t80 -143.51 126.68 16.54 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.241 -0.912 . . . . 0.0 109.696 179.89 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.465 HD12 ' CB ' ' A' ' 29' ' ' TYR . 1.6 mp -79.46 132.11 36.26 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.191 -0.943 . . . . 0.0 111.011 -179.529 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.488 ' CG1' ' O ' ' A' ' 2' ' ' SER . 8.6 p -90.31 -29.37 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.487 -0.758 . . . . 0.0 110.241 179.942 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.454 ' N ' HG13 ' A' ' 23' ' ' VAL . 3.2 p30 -78.31 -15.69 58.48 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.129 -0.982 . . . . 0.0 108.735 179.042 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.524 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -142.57 64.43 1.37 Allowed 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.037 -1.098 . . . . 0.0 108.037 178.642 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.475 ' C ' ' O ' ' A' ' 25' ' ' MET . 44.8 p -29.14 89.64 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.725 0.774 . . . . 0.0 111.476 -178.52 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.524 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.03 146.7 16.03 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.713 -0.617 . . . . 0.0 109.484 179.93 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.492 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 7.6 p30 -63.6 110.1 1.89 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 110.189 -179.953 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.472 ' HB3' HG12 ' A' ' 20' ' ' ILE . 5.4 t80 -99.39 134.6 42.03 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.367 -0.833 . . . . 0.0 109.729 179.889 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.2 m -130.22 114.48 15.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.082 -1.011 . . . . 0.0 110.566 -179.682 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.459 ' HB3' ' HB2' ' A' ' 18' ' ' GLN . 3.6 tpp180 -79.81 130.98 35.78 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.162 -0.961 . . . . 0.0 109.531 179.525 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 12.2 m -79.78 159.53 26.52 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.222 -0.924 . . . . 0.0 110.121 -179.689 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 35' ' ' GLY . 9.9 tt0 -79.17 107.28 11.82 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.24 -0.912 . . . . 0.0 109.481 179.694 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.415 ' C ' ' O ' ' A' ' 33' ' ' GLU . 37.3 t -42.87 97.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.638 -0.664 . . . . 0.0 110.02 -179.558 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 152.78 -16.07 0.72 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.958 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.572 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.5 m-85 -79.67 169.23 18.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.077 -1.249 . . . . 0.0 110.11 179.964 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.579 HG22 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -113.44 31.86 6.19 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.997 -1.064 . . . . 0.0 110.711 -179.764 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -152.46 157.22 27.15 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.671 -1.371 . . . . 0.0 109.671 179.676 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.4 p -87.86 20.63 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.271 -1.135 . . . . 0.0 109.965 179.814 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.589 ' CZ ' ' CB ' ' A' ' 42' ' ' GLU . 4.3 tmm_? -124.05 -20.36 5.36 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.191 179.851 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.2 m 72.79 82.53 0.13 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.326 -0.859 . . . . 0.0 109.945 179.75 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.589 ' CB ' ' CZ ' ' A' ' 40' ' ' ARG . 0.9 OUTLIER -155.54 -30.7 0.1 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.453 -0.78 . . . . 0.0 111.047 -179.871 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.579 ' CE1' HG22 ' A' ' 37' ' ' THR . 5.7 p80 -122.15 121.51 37.06 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.69 -1.256 . . . . 0.0 110.881 179.783 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.587 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.6 t80 -83.66 108.65 16.88 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.243 0.544 . . . . 0.0 109.891 -179.884 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.573 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -69.74 -16.84 63.39 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.318 -0.864 . . . . 0.0 109.958 -179.707 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.587 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.307 -179.835 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 45.4 t . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.165 0.507 . . . . 0.0 110.122 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -160.14 156.09 26.15 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.251 -0.905 . . . . 0.0 110.216 179.985 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.541 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -124.93 160.72 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.254 -0.904 . . . . 0.0 110.169 179.823 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.449 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -135.97 -178.39 5.12 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.264 -0.897 . . . . 0.0 110.079 -179.559 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -84.5 -177.72 6.7 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.237 -0.914 . . . . 0.0 110.028 179.9 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 63.1 m -108.85 -104.14 0.36 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.182 -0.949 . . . . 0.0 110.396 -179.923 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.482 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.1 OUTLIER 174.07 -164.35 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.954 -1.091 . . . . 0.0 110.195 -179.886 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.482 ' N ' ' OG ' ' A' ' 7' ' ' SER . 0.7 OUTLIER -82.75 169.68 15.9 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.178 -0.951 . . . . 0.0 110.121 179.895 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.404 ' C ' ' O ' ' A' ' 8' ' ' SER . 12.1 m-20 43.17 26.41 0.09 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.247 -0.908 . . . . 0.0 110.2 -179.917 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.415 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.8 OUTLIER -124.68 4.33 8.2 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.24 -0.913 . . . . 0.0 110.334 -179.88 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -106.69 82.58 1.73 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.215 -0.928 . . . . 0.0 110.218 179.943 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -137.34 25.55 3.0 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.973 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -125.17 -52.74 1.63 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.227 -1.16 . . . . 0.0 110.241 -179.967 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 20.1 p -106.82 120.47 42.11 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.337 -0.852 . . . . 0.0 110.43 -179.974 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.568 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.7 mt -89.83 -43.39 10.67 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.256 -0.902 . . . . 0.0 110.432 -179.973 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.573 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 5.0 m80 -110.26 88.5 2.78 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.278 -0.889 . . . . 0.0 110.077 -179.482 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.429 ' C ' ' OE1' ' A' ' 18' ' ' GLN . . . 174.91 -126.61 1.2 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 -179.873 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.579 ' NE2' ' CG ' ' A' ' 31' ' ' ARG . 14.6 pm0 -160.5 134.72 7.26 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.433 -1.04 . . . . 0.0 110.248 179.642 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.6 OUTLIER -81.45 148.9 29.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.262 -0.899 . . . . 0.0 110.374 -179.692 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.543 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -159.57 -172.22 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.235 -0.915 . . . . 0.0 109.643 179.913 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.459 ' O ' HG13 ' A' ' 3' ' ' ILE . 4.5 t80 -151.81 128.92 11.12 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.076 -1.015 . . . . 0.0 110.271 -179.636 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 26' ' ' SER . 36.4 mt -79.34 130.39 35.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.146 -0.971 . . . . 0.0 110.866 -179.696 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.6 p -90.3 -34.05 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.157 -0.964 . . . . 0.0 109.968 179.361 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.447 ' OD1' ' HB2' ' A' ' 25' ' ' MET . 3.0 p30 -78.23 -20.88 50.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.152 -0.967 . . . . 0.0 108.586 179.101 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.506 ' O ' ' C ' ' A' ' 26' ' ' SER . 3.9 ttm -136.78 61.5 1.63 Allowed 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.559 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.506 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -29.52 92.66 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 122.106 0.955 . . . . 0.0 111.206 -178.608 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -158.73 141.25 14.24 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.933 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -55.81 113.88 1.67 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.104 -0.997 . . . . 0.0 110.504 -179.511 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.543 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 4.4 t80 -105.93 120.98 43.13 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.349 -0.844 . . . . 0.0 109.789 179.73 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -127.17 111.41 13.95 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.113 -0.992 . . . . 0.0 110.18 179.804 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.579 ' CG ' ' NE2' ' A' ' 18' ' ' GLN . 13.2 tpp180 -84.64 103.88 14.14 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.129 -0.982 . . . . 0.0 110.036 179.777 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 73.6 m -80.57 173.98 12.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.323 -0.861 . . . . 0.0 110.28 -179.842 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -79.89 133.46 36.23 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.277 -0.889 . . . . 0.0 109.896 179.892 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.8 t -71.35 -26.38 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.282 -0.887 . . . . 0.0 110.469 -179.531 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.45 -12.12 31.19 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.805 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.573 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.0 OUTLIER -79.57 178.4 8.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.182 -1.187 . . . . 0.0 110.279 -179.974 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.583 HG22 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -110.39 25.28 11.95 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.128 -0.982 . . . . 0.0 110.267 179.61 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -158.28 157.52 28.39 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.652 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.517 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 70.7 t -84.67 44.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.219 -1.165 . . . . 0.0 109.823 179.715 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.562 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.4 OUTLIER -157.32 20.04 0.29 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.441 -0.787 . . . . 0.0 109.972 -179.523 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.1 p 28.24 89.75 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.429 0.633 . . . . 0.0 111.399 179.724 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.562 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.8 tm-20 -153.63 -37.03 0.1 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.432 -0.793 . . . . 0.0 110.143 179.865 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.583 ' CE1' HG22 ' A' ' 37' ' ' THR . 6.3 p80 -119.59 121.52 39.51 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.0 110.221 179.209 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.582 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 24.7 t80 -84.95 120.16 26.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.696 -0.627 . . . . 0.0 110.064 -179.505 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.527 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -87.14 -12.16 47.86 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.479 -0.763 . . . . 0.0 109.916 -179.572 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.582 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.8 mt . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 117.926 -1.035 . . . . 0.0 110.274 -179.882 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.0 m . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.331 0.586 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.521 ' CB ' HG12 ' A' ' 23' ' ' VAL . 0.4 OUTLIER -98.72 42.43 1.1 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.253 -0.904 . . . . 0.0 110.105 -179.924 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.514 ' CD1' ' HB ' ' A' ' 20' ' ' ILE . 3.0 tt -142.74 161.71 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.313 -0.867 . . . . 0.0 110.179 179.96 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.473 ' N ' HG12 ' A' ' 3' ' ' ILE . 1.3 m -143.57 162.25 36.37 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.223 -0.923 . . . . 0.0 110.221 179.755 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 mtmp? -86.56 167.73 14.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.222 -0.924 . . . . 0.0 110.178 -179.882 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 75.5 m -90.59 -178.39 5.29 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.305 -0.872 . . . . 0.0 110.233 179.983 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.7 t -108.25 -153.17 0.5 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.923 . . . . 0.0 110.265 -179.895 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.5 172.04 11.29 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.341 -0.849 . . . . 0.0 110.304 -179.991 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t0 45.26 25.3 0.19 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.222 -0.924 . . . . 0.0 110.157 -179.953 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.439 ' HE3' ' HB2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -124.16 2.86 8.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.178 -0.951 . . . . 0.0 110.291 179.992 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -101.55 47.63 0.9 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.273 -0.892 . . . . 0.0 110.261 -179.985 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -120.44 16.0 9.84 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.997 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.0 t80 -105.45 -53.23 2.69 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -1.161 . . . . 0.0 110.276 179.972 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 23.4 p -109.89 118.05 35.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.264 -0.897 . . . . 0.0 110.31 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.561 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -90.35 -43.11 10.54 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.233 -0.917 . . . . 0.0 110.338 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 8.3 m80 -107.85 83.94 1.88 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.31 -0.869 . . . . 0.0 110.015 -179.538 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.469 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 175.73 -161.22 29.89 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.813 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -121.78 133.98 54.92 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.251 -1.147 . . . . 0.0 110.119 179.827 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -85.61 140.34 30.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.226 -0.921 . . . . 0.0 110.318 -179.831 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.641 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 32.8 pt -157.65 -167.95 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 110.075 -179.949 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.52 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 11.2 t80 -147.08 139.69 24.88 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.907 . . . . 0.0 110.04 -179.919 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.601 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.5 mm? -92.2 134.52 34.8 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.105 -0.997 . . . . 0.0 110.743 -179.725 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.521 HG12 ' CB ' ' A' ' 2' ' ' SER . 7.5 p -90.66 -28.32 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.239 -0.913 . . . . 0.0 110.658 179.997 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.515 ' OD1' ' N ' ' A' ' 25' ' ' MET . 58.0 p30 -78.17 -12.98 60.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.922 -1.111 . . . . 0.0 108.892 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -146.41 65.78 1.19 Allowed 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.777 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.52 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 20.5 p -30.03 87.93 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.64 0.733 . . . . 0.0 111.928 -178.466 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.7 tt0 -158.59 168.05 27.93 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.581 -0.7 . . . . 0.0 109.763 179.531 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.48 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 2.0 p-10 -76.52 127.47 32.89 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.398 -0.814 . . . . 0.0 110.373 -179.86 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.641 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 6.3 t80 -122.31 119.83 32.29 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.422 -0.798 . . . . 0.0 109.816 179.906 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 22.2 m -123.79 115.15 20.89 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.128 -0.983 . . . . 0.0 110.51 -179.561 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.469 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 8.1 tpp85 -80.97 115.71 20.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.263 -0.898 . . . . 0.0 109.675 179.528 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 87.4 m -79.68 168.84 18.82 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.237 -0.914 . . . . 0.0 110.512 -179.667 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -79.84 115.44 19.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.415 -0.803 . . . . 0.0 110.216 -179.866 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.2 t -54.83 110.06 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.347 -0.846 . . . . 0.0 109.778 179.748 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 138.9 -8.23 3.3 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.701 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.22 177.09 9.09 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.158 -1.201 . . . . 0.0 109.908 179.943 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.606 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.62 29.88 7.33 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.92 -1.112 . . . . 0.0 110.115 -179.913 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.01 155.77 26.92 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.384 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 39' ' ' VAL . 14.8 p -85.12 44.27 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.24 -1.153 . . . . 0.0 109.628 179.547 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.554 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.22 22.26 0.16 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.491 -0.755 . . . . 0.0 109.909 -179.374 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 11.8 p 29.63 90.28 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.612 -0.68 . . . . 0.0 111.351 179.625 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.554 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.6 tm-20 -151.85 -45.04 0.11 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.162 -0.961 . . . . 0.0 110.415 179.943 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.606 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 3.0 p-80 -117.85 129.62 55.76 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.074 -1.017 . . . . 0.0 110.817 179.883 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.635 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 14.8 t80 -87.03 126.44 34.75 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.399 0.619 . . . . 0.0 109.978 -178.794 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.576 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -84.92 2.48 42.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.473 -0.767 . . . . 0.0 109.954 -179.598 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.635 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.4 mt . . . . . 0 C--N 1.302 -1.496 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.31 -179.518 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.8 m . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.275 0.56 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.454 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 40.8 t -106.91 102.62 11.96 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.27 -0.894 . . . . 0.0 110.2 179.909 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.589 ' CG1' ' CG2' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -100.02 156.66 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.326 -0.859 . . . . 0.0 110.349 179.974 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.491 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 3.2 m -137.25 166.72 23.09 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.141 179.955 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.9 mttt -106.61 156.08 18.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.214 -0.929 . . . . 0.0 110.35 -179.945 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 90.7 m -81.8 -160.82 0.38 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.276 -0.89 . . . . 0.0 110.149 -179.948 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.0 t -131.81 -159.62 0.98 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.252 -0.905 . . . . 0.0 110.221 179.967 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.0 m -80.33 171.23 15.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.263 -0.898 . . . . 0.0 110.214 179.967 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 46.5 24.02 0.27 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.279 -0.888 . . . . 0.0 110.238 -179.951 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.11 7.73 7.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.218 -0.926 . . . . 0.0 110.28 -179.981 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -115.22 96.79 5.85 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.223 -0.923 . . . . 0.0 110.229 -179.93 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.56 39.19 1.31 Allowed Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.995 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.431 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 82.6 t80 -142.42 -53.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -1.143 . . . . 0.0 110.262 -179.932 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.3 p -100.86 118.34 36.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.458 -179.833 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.547 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.8 mt -90.49 -43.05 10.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.248 -0.907 . . . . 0.0 110.328 179.838 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.547 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.3 m80 -108.24 83.13 1.73 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.269 -0.894 . . . . 0.0 110.289 -179.403 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.434 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 179.33 -134.26 2.25 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.999 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -160.28 142.6 13.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -1.136 . . . . 0.0 110.387 179.981 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -83.37 135.51 34.68 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.192 -0.943 . . . . 0.0 110.036 179.739 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.589 ' CG2' ' CG1' ' A' ' 3' ' ' ILE . 37.9 mm -143.13 169.74 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.155 -0.966 . . . . 0.0 110.257 -179.643 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.491 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 23.6 t80 -131.45 140.2 49.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.021 -1.049 . . . . 0.0 110.052 179.813 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.577 HD23 ' CD2' ' A' ' 29' ' ' TYR . 3.2 mm? -102.63 138.61 39.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.125 -0.985 . . . . 0.0 110.927 -179.57 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.518 HG11 ' N ' ' A' ' 24' ' ' ASP . 7.5 p -90.4 -28.29 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.279 -0.888 . . . . 0.0 110.479 179.936 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.518 ' N ' HG11 ' A' ' 23' ' ' VAL . 15.4 t70 -78.23 -17.81 56.23 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.087 -1.008 . . . . 0.0 108.769 179.351 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.576 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -139.57 62.78 1.51 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.685 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.6 p -29.21 85.54 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 121.565 0.698 . . . . 0.0 112.003 -178.284 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.576 ' N ' ' O ' ' A' ' 25' ' ' MET . 9.9 pt20 -161.39 -177.29 5.89 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.577 -0.702 . . . . 0.0 109.385 179.354 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -82.14 163.94 21.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.27 -0.894 . . . . 0.0 110.254 179.937 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.577 ' CD2' HD23 ' A' ' 22' ' ' LEU . 8.6 t80 -150.91 90.45 1.62 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.282 -0.886 . . . . 0.0 109.97 179.875 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.7 m -91.84 101.67 14.26 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.292 -0.88 . . . . 0.0 110.388 -179.735 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.434 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.9 OUTLIER -79.28 118.39 21.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.194 -0.941 . . . . 0.0 109.654 179.589 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 82.1 m -79.73 170.45 16.5 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.373 -0.83 . . . . 0.0 110.36 -179.738 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -79.78 116.22 19.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.356 -0.84 . . . . 0.0 110.118 -179.931 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 t -53.65 105.48 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.266 -0.896 . . . . 0.0 109.678 179.897 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.94 -10.7 1.85 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.663 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.547 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.15 178.6 7.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.12 -1.223 . . . . 0.0 109.673 179.876 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.613 HG21 ' CE1' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -109.65 25.77 11.42 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 118.793 -1.163 . . . . 0.0 110.57 -179.799 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.42 160.28 31.62 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 179.29 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 11.5 p -87.09 38.13 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.115 -1.226 . . . . 0.0 109.622 179.382 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.544 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -146.31 14.01 1.26 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.562 -0.711 . . . . 0.0 109.65 -179.684 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 8.0 p 31.07 93.29 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.515 -0.74 . . . . 0.0 111.242 179.757 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.544 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.1 tm-20 -159.5 -38.38 0.06 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.509 -0.745 . . . . 0.0 110.022 179.612 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.613 ' CE1' HG21 ' A' ' 37' ' ' THR . 2.1 p-80 -120.28 125.6 48.5 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 122.166 0.984 . . . . 0.0 110.538 179.78 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.595 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.2 t80 -85.59 127.48 34.47 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.338 0.589 . . . . 0.0 109.88 -179.026 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.539 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -86.89 -35.48 18.95 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.359 -0.838 . . . . 0.0 110.023 -179.5 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.595 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.7 mt . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.295 -179.775 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.4 m . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.183 0.516 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.49 ' CB ' HG12 ' A' ' 23' ' ' VAL . 1.3 m -115.18 120.08 38.53 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.274 -0.891 . . . . 0.0 110.228 -179.996 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.526 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 0.9 OUTLIER -143.9 154.74 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.281 -0.887 . . . . 0.0 110.186 -179.938 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.02 164.07 18.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.264 -0.898 . . . . 0.0 110.311 179.98 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.4 168.06 9.56 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.295 -0.878 . . . . 0.0 110.204 179.993 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 71.8 m -107.84 -170.93 1.77 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.213 -0.929 . . . . 0.0 110.223 179.99 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -116.85 -155.17 0.58 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.339 -0.851 . . . . 0.0 110.184 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.81 170.26 16.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.206 -0.933 . . . . 0.0 110.184 179.986 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.3 15.1 3.2 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.226 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.94 15.06 9.99 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.0 110.305 -179.977 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.71 114.17 16.28 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.225 -0.922 . . . . 0.0 110.088 179.985 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.15 27.71 0.19 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 -179.944 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -131.02 -47.59 1.01 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.246 -1.149 . . . . 0.0 110.204 179.914 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 17.1 p -102.78 123.38 46.34 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.296 -0.877 . . . . 0.0 110.134 179.901 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.483 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 4.2 mt -90.5 -52.33 4.96 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.276 -0.89 . . . . 0.0 110.406 -179.823 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.502 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 10.5 m80 -99.04 82.81 2.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.37 -0.831 . . . . 0.0 110.358 -179.267 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.471 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 178.69 -135.31 2.57 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.93 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.455 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 5.0 pt20 -160.34 145.82 14.99 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -1.102 . . . . 0.0 110.23 179.863 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 41.9 t -89.43 131.13 35.64 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -0.876 . . . . 0.0 110.051 179.963 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.635 ' CD1' ' CD1' ' A' ' 29' ' ' TYR . 20.5 pt -143.46 -172.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.374 -0.829 . . . . 0.0 110.085 -179.865 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.522 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 14.9 t80 -142.66 132.53 24.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.242 -0.911 . . . . 0.0 109.868 179.861 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.583 HD23 ' CD2' ' A' ' 29' ' ' TYR . 2.5 mm? -86.49 131.57 34.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.14 -0.975 . . . . 0.0 110.612 -179.726 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.49 HG12 ' CB ' ' A' ' 2' ' ' SER . 5.9 p -90.32 -25.04 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.257 -0.902 . . . . 0.0 110.504 179.919 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -78.38 -4.74 49.7 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.024 -1.048 . . . . 0.0 108.858 179.015 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.2 ttt -159.12 68.5 0.44 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 179.183 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.522 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 17.9 p -29.51 88.79 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.708 0.766 . . . . 0.0 111.471 -178.484 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.0 OUTLIER -160.49 148.44 16.3 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.629 -0.669 . . . . 0.0 109.462 -179.963 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.513 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.6 t-20 -59.08 148.93 29.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.283 -0.886 . . . . 0.0 109.853 179.921 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.635 ' CD1' ' CD1' ' A' ' 20' ' ' ILE . 5.4 t80 -145.82 114.43 6.8 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.161 -0.962 . . . . 0.0 110.328 -179.517 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.6 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.7 m -108.3 111.46 23.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.056 -1.028 . . . . 0.0 110.241 -179.964 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.471 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 1.6 tpp180 -85.61 114.48 22.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.253 -0.904 . . . . 0.0 110.017 179.717 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 96.6 m -79.82 175.99 10.13 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.315 -0.865 . . . . 0.0 110.509 -179.921 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -81.16 115.82 20.76 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.273 -0.892 . . . . 0.0 110.249 -179.944 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 59.7 t -52.16 105.84 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.194 -0.942 . . . . 0.0 109.909 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 146.62 -13.57 1.56 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 -179.872 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.502 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.54 174.34 11.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.35 -1.088 . . . . 0.0 109.951 179.886 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.66 ' CG2' ' CE1' ' A' ' 43' ' ' HIS . 0.4 OUTLIER -106.01 -32.45 8.29 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 118.86 -1.136 . . . . 0.0 111.117 -179.674 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.506 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -92.13 159.51 25.42 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.928 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.85 44.41 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.247 -1.149 . . . . 0.0 109.531 179.455 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.569 ' O ' ' HG2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -159.6 27.11 0.19 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.544 -0.722 . . . . 0.0 109.789 -179.339 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.2 p 28.5 91.94 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.606 -0.684 . . . . 0.0 111.472 179.577 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.553 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 15.4 tm-20 -157.47 -37.96 0.07 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.36 -0.838 . . . . 0.0 110.199 179.599 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.66 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 6.0 p80 -125.29 128.47 48.29 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.048 -1.032 . . . . 0.0 111.159 179.678 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.573 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 89.4 t80 -93.93 112.81 24.71 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.724 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.576 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -94.94 -10.54 30.76 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.266 -0.896 . . . . 0.0 110.197 -179.102 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.573 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 7.5 mt . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.213 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.57 ' HB2' HG11 ' A' ' 23' ' ' VAL . 94.0 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.265 0.555 . . . . 0.0 110.084 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.821 HG12 HG22 ' A' ' 20' ' ' ILE . 9.4 tt -141.23 169.58 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.349 -0.844 . . . . 0.0 110.066 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.518 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 4.0 m -141.35 167.27 22.56 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.303 -0.873 . . . . 0.0 110.423 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -80.98 -170.43 2.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.2 -0.937 . . . . 0.0 110.151 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 99.5 m -116.08 172.67 7.02 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.206 -0.934 . . . . 0.0 110.255 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 t -110.91 -151.28 0.48 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.339 -0.851 . . . . 0.0 110.32 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.8 m -84.62 172.76 11.32 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.336 -0.853 . . . . 0.0 110.318 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 45.29 24.84 0.17 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.36 -0.838 . . . . 0.0 110.296 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.5 2.17 10.16 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.187 -0.945 . . . . 0.0 110.211 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -103.67 76.47 1.4 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 110.126 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -135.02 27.83 3.12 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -135.64 -60.49 0.74 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.236 -1.155 . . . . 0.0 110.199 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -91.47 120.28 32.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.323 -0.861 . . . . 0.0 110.145 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.8 mt -90.08 -41.88 11.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.19 -0.944 . . . . 0.0 110.493 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.597 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.8 m80 -114.4 85.09 2.17 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.258 -0.901 . . . . 0.0 110.098 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.505 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.03 178.18 42.11 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -99.75 140.61 33.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.311 -1.111 . . . . 0.0 110.143 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 1.004 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -85.43 134.32 34.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.311 -0.868 . . . . 0.0 110.278 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.004 HD13 ' O ' ' A' ' 19' ' ' CYS . 0.4 OUTLIER -139.4 -174.34 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.825 0 O-C-N 121.204 -0.935 . . . . 0.0 109.58 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.493 ' O ' HG13 ' A' ' 3' ' ' ILE . 11.3 t80 -149.31 123.46 9.5 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.919 -1.113 . . . . 0.0 110.504 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.734 HD12 ' NE2' ' A' ' 27' ' ' GLN . 21.0 mt -79.52 132.11 36.23 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.236 -0.915 . . . . 0.0 110.947 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.57 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.7 p -90.09 -33.36 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.244 -0.91 . . . . 0.0 109.864 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -78.29 -20.92 50.53 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.231 -0.918 . . . . 0.0 108.58 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.523 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.1 tpt -133.06 60.27 1.71 Allowed 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.479 ' C ' ' O ' ' A' ' 25' ' ' MET . 3.6 p -29.21 89.45 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.667 0.746 . . . . 0.0 111.611 -178.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.734 ' NE2' HD12 ' A' ' 22' ' ' LEU . 2.6 pt20 -159.85 170.44 21.43 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.712 -0.617 . . . . 0.0 109.431 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -81.15 116.23 20.96 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.261 -0.899 . . . . 0.0 110.508 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HD2' HD11 ' A' ' 22' ' ' LEU . 4.3 t80 -109.96 103.92 12.76 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.394 -0.816 . . . . 0.0 109.475 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 65.9 m -108.26 114.67 28.72 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.191 -0.943 . . . . 0.0 110.395 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.505 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.8 tpp85 -79.54 120.73 24.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.896 . . . . 0.0 109.401 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.561 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 95.5 m -78.98 171.84 14.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.138 -0.976 . . . . 0.0 110.471 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -79.38 121.24 24.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.391 -0.818 . . . . 0.0 110.037 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 32.6 t -52.51 104.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.222 -0.924 . . . . 0.0 109.73 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.612 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 144.56 -10.77 1.94 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.34 172.02 14.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.214 -1.168 . . . . 0.0 109.843 179.794 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.909 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -113.39 31.67 6.31 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.891 -1.13 . . . . 0.0 111.066 -179.253 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.43 155.44 26.59 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.56 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.5 p -85.69 43.5 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.308 -1.113 . . . . 0.0 109.475 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.574 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -156.64 20.14 0.33 Allowed 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.565 -0.709 . . . . 0.0 109.787 -179.353 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.561 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 5.2 p 27.57 90.73 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.685 -0.634 . . . . 0.0 111.614 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.574 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 10.4 tm-20 -154.89 -36.51 0.09 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.469 -0.769 . . . . 0.0 110.197 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.909 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.9 p80 -120.42 119.51 33.26 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.016 -1.053 . . . . 0.0 110.626 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.597 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 41.3 t80 -82.78 114.79 21.35 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.332 0.587 . . . . 0.0 110.045 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.532 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -77.98 -35.07 50.59 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.315 -0.866 . . . . 0.0 110.105 -179.69 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.612 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.6 mt . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.338 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.546 ' HB2' ' CG1' ' A' ' 23' ' ' VAL . 1.4 p . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.291 0.567 . . . . 0.0 110.121 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.685 ' CG1' HG22 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -155.93 166.58 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.363 -0.836 . . . . 0.0 110.464 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.4 m -149.11 172.22 15.15 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.365 -0.835 . . . . 0.0 110.142 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.67 175.54 5.41 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.229 -0.92 . . . . 0.0 110.227 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 93.7 m -117.09 176.63 5.04 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.291 -0.881 . . . . 0.0 110.26 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -155.96 17.22 0.36 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 0.0 110.672 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.0 m -151.79 -70.39 0.16 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.187 -0.946 . . . . 0.0 110.246 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -80.25 12.9 2.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.161 -0.962 . . . . 0.0 110.552 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.544 ' HB3' ' CB ' ' A' ' 6' ' ' CYS . 22.2 ptm -78.89 -27.69 43.98 Favored 'General case' 0 C--N 1.308 -1.232 0 O-C-N 121.106 -0.996 . . . . 0.0 110.186 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.5 p30 -100.69 44.89 0.99 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.213 -0.929 . . . . 0.0 110.184 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -129.16 -39.11 0.31 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.8 t80 -94.08 -65.04 1.01 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.194 -1.18 . . . . 0.0 110.403 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.583 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 25.2 p -91.24 119.73 31.56 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.162 -0.961 . . . . 0.0 110.269 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.6 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.8 mt -87.59 -40.96 13.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.195 -0.94 . . . . 0.0 110.254 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.6 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.8 m80 -113.53 88.03 2.75 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.16 -0.963 . . . . 0.0 110.091 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.83 -168.43 41.27 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -117.24 134.62 54.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -1.117 . . . . 0.0 110.052 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 3.8 t -79.84 146.8 32.04 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.228 -0.92 . . . . 0.0 109.94 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.809 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.2 mt -152.35 -176.83 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.152 -0.967 . . . . 0.0 109.841 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.508 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 20.6 t80 -147.99 117.88 7.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.111 -0.993 . . . . 0.0 109.971 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.593 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.2 mm? -79.93 130.15 35.06 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.098 -1.001 . . . . 0.0 110.195 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.546 ' CG1' ' HB2' ' A' ' 2' ' ' SER . 7.2 p -89.34 -26.05 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.245 -0.909 . . . . 0.0 110.153 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -78.39 -13.77 59.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.163 -0.96 . . . . 0.0 108.683 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.534 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -148.1 66.91 1.09 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 178.922 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.489 ' C ' ' O ' ' A' ' 25' ' ' MET . 80.7 p -29.15 89.14 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 121.761 0.791 . . . . 0.0 111.743 -178.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.534 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -156.8 144.36 19.08 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.607 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.452 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 9.1 t30 -62.85 108.04 1.11 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.194 -0.941 . . . . 0.0 110.455 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.809 ' CD1' HD12 ' A' ' 20' ' ' ILE . 5.7 t80 -94.31 106.06 18.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.327 -0.858 . . . . 0.0 110.017 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.583 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 1.8 m -111.74 110.07 20.24 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 110.344 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.2 tpp180 -80.05 103.62 10.06 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.169 -0.957 . . . . 0.0 109.668 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 79.3 m -79.54 171.69 14.81 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.305 -0.872 . . . . 0.0 110.247 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -79.33 126.66 31.09 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.234 -0.916 . . . . 0.0 109.836 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 12.7 t -65.99 -15.15 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 110.114 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.27 -15.62 68.05 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.529 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.5 m-85 -79.75 169.86 17.34 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.219 -1.165 . . . . 0.0 109.955 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.67 HG23 ' NE2' ' A' ' 43' ' ' HIS . 15.2 t -101.43 26.48 7.19 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 118.874 -1.131 . . . . 0.0 110.655 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.08 160.64 31.81 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 39' ' ' VAL . 10.7 p -85.04 43.76 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.1 -1.235 . . . . 0.0 109.716 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.655 ' NH2' ' CE1' ' A' ' 43' ' ' HIS . 1.1 ttp180 -150.29 13.8 0.77 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.464 -0.772 . . . . 0.0 110.224 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.3 p 29.56 88.52 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.494 -0.754 . . . . 0.0 110.886 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.561 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 3.4 tt0 -154.85 -36.9 0.09 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.267 -0.895 . . . . 0.0 110.385 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.67 ' NE2' HG23 ' A' ' 37' ' ' THR . 26.5 p-80 -127.88 124.05 36.53 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.025 -1.047 . . . . 0.0 111.327 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.543 ' CE2' ' C ' ' A' ' 46' ' ' LEU . 87.3 t80 -90.63 89.78 7.68 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.598 ' HB3' ' CB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -64.51 -21.67 66.75 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.365 -0.834 . . . . 0.0 110.322 -179.094 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.543 ' C ' ' CE2' ' A' ' 44' ' ' PHE . 7.2 mt . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.211 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.649 ' HB2' HG11 ' A' ' 23' ' ' VAL . 6.6 m . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.24 0.543 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.635 HD11 ' HB ' ' A' ' 20' ' ' ILE . 1.3 tt -112.21 150.79 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.487 ' HG1' ' HD1' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -116.23 161.53 18.85 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.272 -0.893 . . . . 0.0 110.204 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.0 tptt -85.09 158.62 20.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.172 -0.955 . . . . 0.0 110.186 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 75.6 m -90.13 -173.46 3.85 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.326 -0.859 . . . . 0.0 110.252 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.7 t -124.96 -152.2 0.51 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.869 . . . . 0.0 110.203 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.34 170.73 10.31 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.297 -0.877 . . . . 0.0 110.1 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.2 t70 52.68 19.57 1.29 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.244 -0.91 . . . . 0.0 110.232 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -118.15 5.33 11.98 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.333 -0.855 . . . . 0.0 110.276 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -105.84 76.21 1.17 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.203 -0.935 . . . . 0.0 110.215 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -125.87 -27.19 1.17 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.834 -1.307 . . . . 0.0 109.834 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.41 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 72.4 t80 -81.43 -52.77 6.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -1.179 . . . . 0.0 110.469 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 28.0 p -99.61 119.77 38.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.259 -0.901 . . . . 0.0 110.511 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.573 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.8 mt -90.49 -43.49 10.21 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.191 -0.943 . . . . 0.0 110.367 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 7.1 m80 -110.98 86.28 2.28 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.223 -0.923 . . . . 0.0 110.219 -179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.503 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 173.83 177.41 43.01 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -97.6 148.27 23.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.24 -1.153 . . . . 0.0 110.059 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -97.75 134.65 40.63 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.25 -0.906 . . . . 0.0 110.231 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.764 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -148.85 -172.36 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 110.048 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.487 ' HD1' ' HG1' ' A' ' 4' ' ' THR . 17.7 t80 -142.19 133.38 26.18 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.174 -0.954 . . . . 0.0 110.067 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.632 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.1 mm? -86.26 130.88 34.37 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.08 -1.012 . . . . 0.0 110.604 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.649 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.5 p -90.51 -25.7 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.265 -0.897 . . . . 0.0 110.47 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.602 ' OD1' HG13 ' A' ' 23' ' ' VAL . 22.1 m-20 -78.37 -11.69 59.96 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.106 -0.996 . . . . 0.0 108.792 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -151.18 67.9 0.92 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.017 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 25' ' ' MET . 67.2 p -29.3 90.1 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.673 0.749 . . . . 0.0 111.282 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -159.42 148.6 18.23 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.521 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 8.8 p30 -64.04 116.71 6.15 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.247 -0.908 . . . . 0.0 110.284 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.632 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.8 t80 -105.86 138.45 42.03 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.26 -0.9 . . . . 0.0 109.775 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 6.8 m -135.55 120.64 18.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.022 -1.049 . . . . 0.0 110.702 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.503 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -94.28 119.21 32.72 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.213 -0.929 . . . . 0.0 109.524 179.303 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.531 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 91.7 m -79.45 173.82 12.2 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.304 -0.873 . . . . 0.0 110.514 -179.574 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.54 117.57 20.6 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.354 -0.841 . . . . 0.0 109.927 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.1 t -49.09 102.07 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.242 -0.911 . . . . 0.0 109.761 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.539 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 147.16 -12.24 1.41 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.3 167.18 21.27 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.176 -1.191 . . . . 0.0 109.698 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . 1.04 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.95 35.0 3.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.959 -1.088 . . . . 0.0 110.91 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.503 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.25 158.99 30.39 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 39' ' ' VAL . 6.5 p -88.04 29.43 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.224 -1.162 . . . . 0.0 109.866 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -145.91 20.31 1.45 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.444 -0.785 . . . . 0.0 109.749 -179.607 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.531 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 6.4 p 30.55 94.56 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 CA-C-O 121.529 0.681 . . . . 0.0 111.308 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -155.07 -37.0 0.09 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.514 -0.741 . . . . 0.0 110.097 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 1.04 ' CD2' HG23 ' A' ' 37' ' ' THR . 22.6 p-80 -121.72 117.63 27.11 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.14 -0.975 . . . . 0.0 110.295 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 39.9 t80 -80.32 111.46 16.72 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.36 0.6 . . . . 0.0 109.991 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.532 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -74.05 -31.94 63.1 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.435 -0.791 . . . . 0.0 110.133 -179.659 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.247 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.755 ' HB3' HG11 ' A' ' 23' ' ' VAL . 29.2 t . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.233 0.54 . . . . 0.0 110.219 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.675 HD11 ' HB ' ' A' ' 20' ' ' ILE . 5.7 tt -79.56 156.04 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.232 -0.917 . . . . 0.0 110.386 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.484 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.2 OUTLIER -124.29 -171.45 2.34 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.356 -0.84 . . . . 0.0 110.162 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 20' ' ' ILE . 14.1 mtpt -125.94 158.42 35.24 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.296 -0.877 . . . . 0.0 110.231 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.495 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 23.2 m -86.7 -150.62 0.16 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.878 . . . . 0.0 110.146 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -149.96 -155.35 0.62 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.218 -0.926 . . . . 0.0 110.125 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.9 m -90.32 27.92 1.56 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.245 -0.91 . . . . 0.0 110.124 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.444 ' O ' ' OD1' ' A' ' 9' ' ' ASP . 56.2 t0 -144.87 31.42 1.15 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.28 -0.888 . . . . 0.0 110.201 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.2 tpp -152.39 17.51 0.63 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.331 -0.856 . . . . 0.0 110.208 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -106.54 81.92 1.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -133.69 4.4 4.72 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -115.22 -56.63 2.34 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.254 -1.145 . . . . 0.0 110.113 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.581 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -96.55 116.48 29.16 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.167 -0.958 . . . . 0.0 110.516 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.621 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.3 mt -87.37 -40.36 14.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.389 -0.819 . . . . 0.0 110.129 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.9 m80 -118.0 87.22 2.67 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.317 -0.864 . . . . 0.0 110.325 -179.128 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.468 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -178.31 -169.28 38.92 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.445 ' O ' ' CD1' ' A' ' 20' ' ' ILE . 8.6 mm-40 -106.85 134.82 49.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.304 -1.115 . . . . 0.0 110.306 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.495 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -92.14 126.82 37.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.28 -0.887 . . . . 0.0 110.116 179.794 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.761 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -147.67 -169.64 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.233 -0.917 . . . . 0.0 110.511 -179.61 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.5 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 10.2 t80 -145.7 133.13 20.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.38 -0.825 . . . . 0.0 109.705 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.622 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.5 mm? -86.75 131.85 34.02 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.737 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.755 HG11 ' HB3' ' A' ' 2' ' ' SER . 4.5 p -90.7 -22.76 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.235 -0.915 . . . . 0.0 110.741 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -78.14 -9.51 59.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.069 -1.019 . . . . 0.0 108.893 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -157.11 71.02 0.64 Allowed 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.061 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.5 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 40.6 p -29.26 89.89 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.689 0.757 . . . . 0.0 111.227 -178.486 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -157.37 147.78 21.03 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.769 -0.582 . . . . 0.0 109.517 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.529 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.0 m120 -64.01 122.98 17.83 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.325 -0.86 . . . . 0.0 110.433 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.622 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.8 t80 -112.52 131.24 55.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.359 -0.838 . . . . 0.0 109.762 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.581 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.4 m -131.64 112.14 12.31 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.159 -0.963 . . . . 0.0 110.624 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.468 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 16.7 tpp85 -84.86 134.58 34.28 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.265 -0.897 . . . . 0.0 110.03 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.631 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 6.1 t -79.71 164.07 24.02 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.252 -0.905 . . . . 0.0 110.066 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 14.9 tt0 -79.58 110.69 15.14 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.285 -0.884 . . . . 0.0 109.495 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.427 ' C ' ' O ' ' A' ' 33' ' ' GLU . 37.6 t -43.36 96.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.503 -0.748 . . . . 0.0 109.719 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.842 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 151.52 -14.73 0.82 Allowed Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.581 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.4 m-85 -79.04 -178.33 6.06 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.109 -1.23 . . . . 0.0 109.826 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.672 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.3 OUTLIER -106.03 -57.37 2.05 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.036 -1.04 . . . . 0.0 110.662 -179.683 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.452 ' H ' ' CE1' ' A' ' 43' ' ' HIS . . . -85.41 152.86 26.99 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 39' ' ' VAL . 44.1 t -76.23 2.17 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.237 -1.155 . . . . 0.0 109.96 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.593 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 4.5 tmm_? -80.28 -10.0 59.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.336 -0.852 . . . . 0.0 109.878 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.631 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 11.2 m 59.95 66.9 0.92 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.392 -0.817 . . . . 0.0 110.476 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.593 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER -152.59 -28.25 0.16 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.067 -1.021 . . . . 0.0 111.965 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.672 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.1 p80 -122.78 121.21 35.74 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.56 -1.338 . . . . 0.0 111.659 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.638 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.8 t80 -80.14 110.46 15.57 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.869 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.564 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -74.93 -14.66 60.67 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.104 -0.998 . . . . 0.0 109.958 -179.72 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.842 HD12 ' O ' ' A' ' 35' ' ' GLY . 6.0 mt . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.275 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.716 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.257 0.551 . . . . 0.0 110.076 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.548 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -160.19 167.88 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.291 -0.881 . . . . 0.0 110.403 -179.656 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.517 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.2 m -144.98 162.4 37.01 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.427 -0.796 . . . . 0.0 110.039 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -119.08 157.73 27.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.252 -0.905 . . . . 0.0 110.133 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 86.3 m -91.91 -124.55 0.08 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.294 -0.879 . . . . 0.0 109.976 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.2 t -146.77 -154.38 0.55 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.972 -1.08 . . . . 0.0 110.122 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -85.04 -59.04 2.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.233 -0.917 . . . . 0.0 110.338 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -83.44 11.89 6.31 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.269 -0.895 . . . . 0.0 110.356 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 8.5 tpt -100.0 -4.42 30.07 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.264 -0.898 . . . . 0.0 110.202 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.441 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 39.4 t-20 -120.89 67.87 0.87 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.232 -0.918 . . . . 0.0 110.144 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.67 24.72 16.03 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.469 ' O ' ' NH1' ' A' ' 40' ' ' ARG . 7.5 t80 -110.19 -50.04 3.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.239 -1.154 . . . . 0.0 110.231 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 1.9 m -89.04 138.16 31.66 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.428 -0.795 . . . . 0.0 110.392 -179.355 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.578 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.6 mt -91.44 -46.96 7.71 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.564 -0.71 . . . . 0.0 110.2 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.578 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.4 m80 -119.44 91.66 3.6 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.332 -0.855 . . . . 0.0 110.217 -179.02 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.13 -167.13 39.64 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -127.19 164.02 22.58 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.283 -1.127 . . . . 0.0 110.272 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.84 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.4 OUTLIER -96.23 135.2 38.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.282 -0.886 . . . . 0.0 110.315 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.84 HD13 ' O ' ' A' ' 19' ' ' CYS . 17.2 mm -134.58 173.35 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.351 -0.843 . . . . 0.0 109.825 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.517 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 19.7 t80 -144.51 127.84 16.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.923 -1.111 . . . . 0.0 110.399 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.582 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.5 mm? -89.78 133.76 34.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.258 -0.901 . . . . 0.0 110.485 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.716 HG11 ' CB ' ' A' ' 2' ' ' SER . 12.6 p -90.42 -30.55 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.171 -0.955 . . . . 0.0 110.462 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.426 ' OD1' HD12 ' A' ' 22' ' ' LEU . 3.4 p30 -78.3 -18.18 55.58 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.115 -0.991 . . . . 0.0 108.814 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.503 ' O ' ' N ' ' A' ' 27' ' ' GLN . 18.0 ttt -138.13 62.27 1.57 Allowed 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.493 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.56 92.0 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 122.119 0.961 . . . . 0.0 111.148 -178.532 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.512 ' HG3' ' N ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER -159.95 147.63 16.73 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.366 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 6.5 m120 -67.52 105.85 1.97 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.263 -0.898 . . . . 0.0 110.121 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.582 ' HB2' HD23 ' A' ' 22' ' ' LEU . 5.7 t80 -87.61 90.62 8.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.424 -0.797 . . . . 0.0 110.233 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 7.5 m -82.05 115.25 21.11 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 110.553 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -94.75 111.2 22.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.205 -0.934 . . . . 0.0 110.108 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.504 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 79.4 m -79.93 178.07 8.47 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.243 -0.911 . . . . 0.0 110.376 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -80.15 146.27 31.9 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.324 -0.86 . . . . 0.0 109.854 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.414 ' O ' HG12 ' A' ' 34' ' ' VAL . 5.1 t -76.28 29.59 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.143 -0.973 . . . . 0.0 111.818 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.689 ' O ' HD12 ' A' ' 46' ' ' LEU . . . -126.52 -5.06 6.12 Favored Glycine 0 N--CA 1.487 2.044 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.005 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.577 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 15.9 m-85 -95.4 157.51 15.86 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.354 -1.086 . . . . 0.0 109.57 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.65 HG23 ' NE2' ' A' ' 43' ' ' HIS . 10.2 t -108.85 43.47 1.25 Allowed 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 118.468 -1.293 . . . . 0.0 110.633 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.84 161.5 32.84 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.515 ' O ' HG13 ' A' ' 39' ' ' VAL . 8.8 p -87.55 35.64 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.081 -1.247 . . . . 0.0 109.568 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 0.5 OUTLIER -143.1 8.11 1.63 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.472 -0.767 . . . . 0.0 110.279 -179.428 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.504 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 2.5 p 34.02 78.8 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.379 -0.826 . . . . 0.0 111.012 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 33.5 tt0 -142.24 -33.65 0.47 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.406 -0.809 . . . . 0.0 110.159 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.65 ' NE2' HG23 ' A' ' 37' ' ' THR . 19.3 p-80 -118.76 114.61 22.95 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.995 -1.065 . . . . 0.0 109.485 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.593 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 27.0 t80 -78.68 98.07 6.08 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 121.776 0.798 . . . . 0.0 109.323 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.575 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.2 OUTLIER -64.57 -9.15 17.19 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 121.751 -0.593 . . . . 0.0 110.537 -179.015 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.689 HD12 ' O ' ' A' ' 35' ' ' GLY . 8.1 mt . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.724 ' HB3' HG11 ' A' ' 23' ' ' VAL . 3.0 t . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.277 0.561 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.623 HD11 ' HB ' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.79 152.22 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.278 -0.889 . . . . 0.0 110.146 179.928 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.47 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -124.03 -165.14 1.31 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.245 -0.909 . . . . 0.0 110.187 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -106.58 -175.33 2.76 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.232 -0.917 . . . . 0.0 110.207 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 80.5 m -105.23 -155.83 0.55 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 110.356 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -147.42 -138.31 0.09 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.278 -0.889 . . . . 0.0 110.006 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.3 4.82 14.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.054 -1.028 . . . . 0.0 110.059 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -107.19 17.55 22.79 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.324 -0.86 . . . . 0.0 109.823 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.478 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 7.0 ptm -79.49 -26.61 41.58 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.359 -0.838 . . . . 0.0 110.639 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -96.16 58.19 1.81 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.144 -0.972 . . . . 0.0 110.307 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -146.89 13.17 1.49 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.559 ' CE1' ' HA ' ' A' ' 40' ' ' ARG . 8.4 t80 -157.28 -57.8 0.08 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.168 -1.196 . . . . 0.0 110.312 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.3 p -107.97 114.75 28.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.192 -0.943 . . . . 0.0 110.933 -179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.614 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.2 mt -90.13 -42.48 11.05 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.435 -0.791 . . . . 0.0 109.886 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.614 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -111.26 76.91 1.0 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.231 -0.918 . . . . 0.0 110.134 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -172.46 179.5 43.97 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.476 ' HB2' ' HB3' ' A' ' 31' ' ' ARG . 3.0 mt-30 -93.39 148.07 22.39 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.3 -1.118 . . . . 0.0 110.186 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -109.07 121.02 44.26 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.271 -0.893 . . . . 0.0 110.371 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.769 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -144.3 179.52 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.385 -0.822 . . . . 0.0 110.087 -179.819 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 20.9 t80 -127.48 133.68 49.87 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.146 -0.971 . . . . 0.0 110.124 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.719 HD23 ' CB ' ' A' ' 29' ' ' TYR . 0.6 OUTLIER -89.17 133.58 34.35 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.243 -0.911 . . . . 0.0 110.545 -179.967 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.724 HG11 ' HB3' ' A' ' 2' ' ' SER . 8.8 p -90.24 -26.34 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.238 -0.914 . . . . 0.0 110.44 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -78.56 -15.72 58.24 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.056 -1.028 . . . . 0.0 108.821 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -145.47 65.93 1.23 Allowed 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.829 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.494 ' C ' ' O ' ' A' ' 25' ' ' MET . 32.5 p -29.02 89.21 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 CA-C-O 121.648 0.737 . . . . 0.0 111.464 -178.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.3 OUTLIER -159.8 170.14 22.11 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.671 -0.643 . . . . 0.0 109.552 179.731 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.52 100.85 8.78 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.306 -0.871 . . . . 0.0 110.351 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.719 ' CB ' HD23 ' A' ' 22' ' ' LEU . 12.2 t80 -86.99 130.14 34.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.327 -0.858 . . . . 0.0 109.453 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 7.6 m -130.55 116.75 18.58 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.875 -1.14 . . . . 0.0 110.855 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.476 ' HB3' ' HB2' ' A' ' 18' ' ' GLN . 8.0 tpp85 -79.23 128.68 33.61 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.132 -0.98 . . . . 0.0 109.113 179.21 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.623 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 5.7 m -79.67 159.0 26.87 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.15 -0.969 . . . . 0.0 110.133 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 34' ' ' VAL . 31.3 tt0 -78.36 107.85 11.29 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.258 -0.901 . . . . 0.0 109.166 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.442 HG23 ' H ' ' A' ' 34' ' ' VAL . 39.6 t -40.99 101.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 121.697 -0.627 . . . . 0.0 110.436 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.84 ' O ' HD23 ' A' ' 46' ' ' LEU . . . 140.76 -8.42 2.79 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.565 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -84.79 173.01 11.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.029 -1.277 . . . . 0.0 110.486 -179.798 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.916 HG23 ' CE1' ' A' ' 43' ' ' HIS . 3.9 t -127.57 38.37 4.06 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 118.895 -1.122 . . . . 0.0 111.155 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.534 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -151.35 155.16 25.99 Favored Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.417 -1.373 . . . . 0.0 109.976 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.64 HG12 ' O ' ' A' ' 39' ' ' VAL . 79.6 t -83.55 12.68 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.379 -1.071 . . . . 0.0 109.844 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.574 ' HD3' ' N ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -123.26 -7.74 8.19 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.412 -0.805 . . . . 0.0 109.431 179.638 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.623 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 26.8 m 58.77 65.73 1.18 Allowed 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -178.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -135.32 -30.83 1.01 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.561 -0.712 . . . . 0.0 110.868 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.916 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.1 p80 -120.2 123.75 44.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.756 -1.215 . . . . 0.0 111.349 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.619 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 43.9 t80 -86.7 104.25 15.92 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.382 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.93 ' CE2' HD11 ' A' ' 46' ' ' LEU . 0.2 OUTLIER -71.82 -3.19 20.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.396 -0.815 . . . . 0.0 110.163 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.93 HD11 ' CE2' ' A' ' 45' ' ' PHE . 2.1 mm? . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.344 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.469 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 3.2 m . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.325 0.583 . . . . 0.0 110.356 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.821 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -141.56 122.66 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.138 -0.976 . . . . 0.0 110.659 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.533 ' HB ' ' CB ' ' A' ' 21' ' ' TYR . 4.2 m -90.96 167.28 12.52 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.387 -0.821 . . . . 0.0 109.765 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -122.34 169.29 11.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.274 -0.891 . . . . 0.0 110.13 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 62.8 m -110.61 -144.33 0.39 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.31 -0.869 . . . . 0.0 110.18 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 t -139.84 -166.27 2.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.229 -0.919 . . . . 0.0 110.111 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.18 7.48 13.53 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.208 -0.933 . . . . 0.0 110.283 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.12 25.81 10.07 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.213 -0.929 . . . . 0.0 110.224 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.436 ' SD ' ' SG ' ' A' ' 6' ' ' CYS . 31.8 ttm -144.67 28.11 1.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.225 -0.922 . . . . 0.0 110.196 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -110.42 27.6 9.47 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.243 -0.91 . . . . 0.0 110.167 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.15 -17.28 79.53 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -83.63 -50.08 8.55 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.251 -1.146 . . . . 0.0 110.327 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -105.79 120.9 42.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.254 -0.904 . . . . 0.0 110.408 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.59 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.6 mt -90.31 -42.29 11.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.336 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.1 m80 -111.17 86.45 2.32 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.173 -0.955 . . . . 0.0 110.1 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.456 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 168.93 -163.0 36.8 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -123.62 152.87 41.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.306 -1.114 . . . . 0.0 110.06 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 6.8 t -92.16 146.88 23.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.0 110.282 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.822 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -153.43 -174.08 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.278 -0.889 . . . . 0.0 109.803 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.533 ' CB ' ' HB ' ' A' ' 4' ' ' THR . 27.0 t80 -148.7 130.49 15.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.077 -1.015 . . . . 0.0 109.835 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.696 HD22 HD12 ' A' ' 3' ' ' ILE . 1.6 mm? -92.14 132.52 36.55 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.036 -1.04 . . . . 0.0 111.041 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.469 ' HB ' ' O ' ' A' ' 2' ' ' SER . 6.1 t -90.74 -27.22 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.33 -0.856 . . . . 0.0 110.382 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -77.52 -19.9 55.06 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.986 -1.072 . . . . 0.0 108.393 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.529 ' O ' ' N ' ' A' ' 27' ' ' GLN . 19.9 mtm -141.99 62.04 1.44 Allowed 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.487 ' C ' ' O ' ' A' ' 25' ' ' MET . 2.6 p -29.18 89.76 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.803 0.811 . . . . 0.0 111.494 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.529 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.32 147.85 17.91 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.734 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 5.9 m-80 -57.13 129.55 42.25 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.152 -0.967 . . . . 0.0 110.379 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.822 ' CD1' HD12 ' A' ' 20' ' ' ILE . 6.6 t80 -120.75 107.97 13.4 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.523 -0.736 . . . . 0.0 109.831 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 4.5 m -113.03 112.71 24.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.118 -0.988 . . . . 0.0 110.409 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.456 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 7.2 tpm_? -79.66 116.78 20.05 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.216 -0.928 . . . . 0.0 109.69 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.485 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 96.8 m -79.26 175.61 10.43 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.226 -0.921 . . . . 0.0 110.021 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -79.25 110.93 14.98 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.229 -0.919 . . . . 0.0 109.724 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.422 HG23 ' H ' ' A' ' 34' ' ' VAL . 39.1 t -44.77 101.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.396 -0.815 . . . . 0.0 109.672 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 146.2 -8.66 1.46 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.478 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.02 176.67 9.44 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.915 -1.344 . . . . 0.0 109.895 -179.967 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.606 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -113.99 28.69 8.56 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.897 -1.127 . . . . 0.0 110.472 -179.724 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -158.15 156.27 27.22 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.578 ' O ' HG13 ' A' ' 39' ' ' VAL . 10.0 p -84.63 42.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.326 -1.102 . . . . 0.0 109.839 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.581 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.27 22.93 0.16 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.341 -0.849 . . . . 0.0 109.849 -179.476 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.501 ' C ' ' O ' ' A' ' 40' ' ' ARG . 5.4 p 28.33 93.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.664 -0.647 . . . . 0.0 111.676 179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.581 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 13.4 tm-20 -154.81 -42.1 0.09 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.39 -0.819 . . . . 0.0 110.067 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.606 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.9 p-80 -118.53 128.35 54.49 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.099 -1.001 . . . . 0.0 110.419 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.611 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 36.8 t80 -87.78 128.08 35.32 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.422 0.63 . . . . 0.0 110.16 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.582 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -89.43 -37.33 14.89 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.387 -0.82 . . . . 0.0 110.087 -179.477 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.611 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.001 -0.999 . . . . 0.0 110.151 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.481 ' HB2' HG11 ' A' ' 23' ' ' VAL . 6.5 m . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.238 0.542 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 1.121 ' CD1' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -107.67 140.85 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 110.098 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.482 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -107.35 170.64 7.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 110.151 179.892 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -104.99 171.82 7.11 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.186 -0.947 . . . . 0.0 110.232 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.468 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 62.5 m -90.6 -143.62 0.17 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.287 -0.883 . . . . 0.0 110.106 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.5 p -158.17 -72.72 0.09 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.235 -0.916 . . . . 0.0 110.328 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.0 m -154.39 -75.14 0.11 Allowed 'General case' 0 C--N 1.292 -1.9 0 O-C-N 121.666 -0.646 . . . . 0.0 110.162 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -62.26 -12.1 18.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.881 . . . . 0.0 110.231 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.1 tpt -91.38 19.41 6.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.202 -0.936 . . . . 0.0 110.185 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.426 ' OD1' ' HB3' ' A' ' 6' ' ' CYS . 4.4 m-20 -126.39 81.09 1.97 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.285 -0.884 . . . . 0.0 110.221 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.09 59.92 0.43 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.535 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 63.8 t80 -160.11 -55.43 0.06 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.283 -1.128 . . . . 0.0 110.253 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.4 p -96.46 118.92 33.98 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.3 -0.875 . . . . 0.0 110.567 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.541 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.1 mt -90.66 -47.37 7.7 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.259 -0.901 . . . . 0.0 110.215 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 10.1 m80 -106.78 82.28 1.68 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.37 -0.831 . . . . 0.0 110.201 -179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.488 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 178.08 -171.02 43.44 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.4 mm-40 -109.36 133.48 53.01 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.198 -1.177 . . . . 0.0 110.168 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.587 ' C ' HG23 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -87.61 135.18 33.46 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.315 -0.865 . . . . 0.0 110.184 179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.121 HD12 ' CD1' ' A' ' 3' ' ' ILE . 26.9 pt -157.46 -168.07 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.214 -0.929 . . . . 0.0 110.235 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.56 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 8.4 t80 -141.3 139.44 33.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.209 -0.932 . . . . 0.0 110.004 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.747 HD23 ' CB ' ' A' ' 29' ' ' TYR . 0.7 OUTLIER -94.92 137.39 34.05 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.229 -0.919 . . . . 0.0 110.979 -179.525 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.481 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.3 p -90.14 -27.23 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.346 -0.846 . . . . 0.0 110.371 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.409 ' O ' ' SD ' ' A' ' 25' ' ' MET . 42.1 t0 -78.36 -15.42 58.72 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.165 -0.959 . . . . 0.0 108.814 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.2 OUTLIER -145.08 65.03 1.27 Allowed 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 179.01 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.56 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 49.7 p -29.41 87.72 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 121.623 0.725 . . . . 0.0 111.753 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 25' ' ' MET . 4.1 pt20 -160.89 175.79 12.14 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.584 -0.698 . . . . 0.0 109.544 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -82.18 111.24 18.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 110.339 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 1.094 ' CD1' HD11 ' A' ' 20' ' ' ILE . 10.0 t80 -100.11 118.75 37.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.343 -0.848 . . . . 0.0 109.706 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 20.7 m -119.66 111.51 18.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.06 -1.025 . . . . 0.0 110.641 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.488 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 13.5 tpp180 -81.03 117.88 22.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.195 -0.94 . . . . 0.0 109.485 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.48 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 98.0 m -79.37 170.47 16.55 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 110.349 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -79.61 114.0 18.2 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.322 -0.861 . . . . 0.0 110.183 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.401 HG23 ' H ' ' A' ' 34' ' ' VAL . 44.2 t -47.21 100.86 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.328 -0.858 . . . . 0.0 109.802 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 149.47 -13.37 1.05 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.711 -1.356 . . . . 0.0 109.711 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.2 m-85 -79.19 170.43 16.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.2 -1.177 . . . . 0.0 109.631 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . 1.056 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -109.98 32.79 4.83 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.829 -1.169 . . . . 0.0 110.886 -179.67 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.554 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.65 159.9 31.37 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 39' ' ' VAL . 10.0 p -88.8 33.59 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.234 -1.156 . . . . 0.0 109.482 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.6 OUTLIER -142.91 17.89 1.96 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.461 -0.774 . . . . 0.0 109.595 -179.602 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.515 ' C ' ' O ' ' A' ' 40' ' ' ARG . 2.2 p 27.83 86.81 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.123 0 CA-C-O 121.442 0.639 . . . . 0.0 111.131 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 12.4 tm-20 -151.81 -34.79 0.13 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.451 -0.781 . . . . 0.0 110.4 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 1.056 ' CD2' HG23 ' A' ' 37' ' ' THR . 23.9 p-80 -120.91 117.64 27.85 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.034 -1.041 . . . . 0.0 110.364 179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.617 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 28.0 t80 -80.23 109.38 14.65 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.313 0.578 . . . . 0.0 109.991 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.567 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -70.45 -16.69 62.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.91 . . . . 0.0 109.682 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.617 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.7 mt . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.279 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.532 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 121.358 0.599 . . . . 0.0 109.91 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 1.097 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -155.78 165.13 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.347 -0.846 . . . . 0.0 110.209 -179.887 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.485 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 2.8 m -142.13 166.02 25.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.938 . . . . 0.0 110.027 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -85.72 163.21 18.37 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -0.875 . . . . 0.0 110.265 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.789 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 21.3 m -93.92 -145.17 0.24 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.231 -0.918 . . . . 0.0 110.209 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.0 t -151.94 -150.2 0.33 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 110.092 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.436 ' O ' ' N ' ' A' ' 10' ' ' MET . 0.3 OUTLIER -84.37 168.71 15.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.291 -0.88 . . . . 0.0 110.209 179.881 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 8' ' ' SER . 0.4 OUTLIER 42.12 27.15 0.07 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.267 -0.896 . . . . 0.0 110.231 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.452 ' SD ' ' HB3' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -122.68 -4.15 8.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.176 -0.953 . . . . 0.0 110.229 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -116.84 69.73 0.76 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.276 -0.89 . . . . 0.0 110.209 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -129.82 29.56 3.73 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.533 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 47.0 t80 -124.47 -57.25 1.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.333 -1.098 . . . . 0.0 110.295 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.609 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 26.7 p -91.45 122.75 34.32 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.283 -0.885 . . . . 0.0 110.34 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.553 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 5.6 mt -90.44 -45.46 8.97 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.259 -0.901 . . . . 0.0 110.238 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.553 ' ND1' ' HB2' ' A' ' 15' ' ' LEU . 7.1 m80 -109.07 87.44 2.49 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.309 -0.869 . . . . 0.0 110.159 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.488 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 177.98 -175.58 47.57 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -107.99 137.83 45.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.204 -1.174 . . . . 0.0 110.253 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.789 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 1.5 t -86.72 139.6 30.59 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.0 110.225 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.097 HD12 HD11 ' A' ' 3' ' ' ILE . 24.2 pt -157.33 -173.19 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.249 -0.907 . . . . 0.0 109.96 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.485 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 5.7 t80 -144.64 128.54 17.41 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.141 -0.975 . . . . 0.0 110.306 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.659 HD11 ' HD2' ' A' ' 29' ' ' TYR . 15.9 mt -79.54 133.55 36.47 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.339 -0.851 . . . . 0.0 110.779 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.532 HG11 ' HB3' ' A' ' 2' ' ' SER . 12.4 p -89.5 -30.91 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.889 . . . . 0.0 109.916 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -78.49 -20.07 51.65 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.136 -0.978 . . . . 0.0 108.684 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.558 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.0 mtm -136.78 61.72 1.62 Allowed 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 25' ' ' MET . 35.0 p -29.37 87.68 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 CA-C-O 121.7 0.762 . . . . 0.0 111.508 -178.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -160.64 148.17 15.89 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.48 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.7 t30 -62.62 114.97 3.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.196 -0.94 . . . . 0.0 110.304 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 1.07 ' CD1' HD11 ' A' ' 20' ' ' ILE . 4.1 t80 -106.54 121.78 44.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.408 -0.808 . . . . 0.0 109.687 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.609 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 19.9 m -117.52 112.12 20.17 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.078 -1.014 . . . . 0.0 110.478 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.488 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 1.9 tpp180 -81.89 117.52 22.21 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.207 -0.933 . . . . 0.0 109.635 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.463 ' HB3' ' HB3' ' A' ' 41' ' ' CYS . 65.8 m -79.36 170.85 15.99 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.229 -0.919 . . . . 0.0 110.488 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -79.46 113.16 17.38 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.335 -0.853 . . . . 0.0 110.194 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.5 t -48.67 106.71 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.44 -0.787 . . . . 0.0 109.955 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.26 -10.92 2.26 Favored Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -79.53 177.14 9.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.177 -1.19 . . . . 0.0 109.975 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.678 HG21 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -110.12 -43.26 3.99 Favored 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 118.732 -1.187 . . . . 0.0 111.21 -179.524 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.59 158.79 43.68 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.269 -1.532 . . . . 0.0 109.269 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.761 HG12 ' O ' ' A' ' 39' ' ' VAL . 80.9 t -84.7 44.45 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.247 -1.149 . . . . 0.0 109.513 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.575 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.28 26.65 0.17 Allowed 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.481 -0.762 . . . . 0.0 109.61 -179.372 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 10.9 p 30.78 93.12 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.512 -0.743 . . . . 0.0 111.335 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 6.6 tm-20 -160.17 -42.7 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 110.388 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.678 ' CE1' HG21 ' A' ' 37' ' ' THR . 0.0 OUTLIER -120.1 136.73 54.49 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 122.177 0.989 . . . . 0.0 110.8 -179.76 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 69.4 t80 -97.32 137.09 36.85 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.142 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.592 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -121.77 13.11 10.69 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 110.605 -179.431 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.6 mt . . . . . 0 N--CA 1.492 1.639 0 O-C-N 120.938 -1.101 . . . . 0.0 110.303 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.508 ' HB3' HG21 ' A' ' 23' ' ' VAL . 4.9 t . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.269 0.557 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.789 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.73 150.8 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.91 . . . . 0.0 110.34 -179.78 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.493 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.3 m -131.41 170.74 14.25 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.388 -0.82 . . . . 0.0 110.205 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -109.26 179.6 4.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.214 -0.929 . . . . 0.0 110.185 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.3 m -106.92 -154.58 0.52 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 110.355 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.0 t -136.23 -145.72 0.22 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.095 -1.003 . . . . 0.0 110.647 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 41.2 t -79.79 -70.67 0.5 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.31 -0.869 . . . . 0.0 110.421 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -76.33 2.96 11.96 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.264 -0.897 . . . . 0.0 110.366 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.18 14.95 25.88 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.13 -0.981 . . . . 0.0 110.191 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -140.95 120.08 12.87 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.31 -0.869 . . . . 0.0 110.245 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.48 62.57 0.19 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.593 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 52.1 t80 -151.45 -57.11 0.15 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.273 -1.134 . . . . 0.0 110.145 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.542 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 23.5 p -85.66 124.85 32.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.263 -0.898 . . . . 0.0 110.319 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.6 mt -89.99 -42.53 11.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.273 -0.892 . . . . 0.0 110.256 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.597 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.7 m80 -113.91 92.85 4.12 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.281 -0.887 . . . . 0.0 110.147 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.48 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 167.53 -132.6 2.64 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.439 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 0.8 OUTLIER -158.81 149.49 19.98 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -1.103 . . . . 0.0 110.285 -179.945 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -89.68 146.2 24.69 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.297 -0.877 . . . . 0.0 110.364 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.789 HG22 ' CG1' ' A' ' 3' ' ' ILE . 1.1 mt -153.03 -166.54 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.296 -0.877 . . . . 0.0 109.579 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.493 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 16.7 t80 -152.65 125.7 8.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.088 -1.007 . . . . 0.0 110.135 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.692 HD22 HD12 ' A' ' 3' ' ' ILE . 1.3 mm? -88.44 132.22 34.56 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.2 -0.937 . . . . 0.0 110.611 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.508 HG21 ' HB3' ' A' ' 2' ' ' SER . 9.4 p -90.38 -24.11 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.243 -0.911 . . . . 0.0 110.462 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.51 -13.69 59.71 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.107 -0.996 . . . . 0.0 108.703 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.537 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.0 tpp -150.0 67.88 0.99 Allowed 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 25' ' ' MET . 12.5 p -29.28 89.44 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.715 0.769 . . . . 0.0 111.536 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.11 147.85 16.58 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.725 -0.609 . . . . 0.0 109.377 179.9 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.515 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 10.8 m-20 -59.79 127.92 34.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.157 -0.964 . . . . 0.0 110.248 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.782 ' CD1' HD12 ' A' ' 20' ' ' ILE . 8.7 t80 -117.82 109.94 17.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.269 -0.894 . . . . 0.0 110.207 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.542 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -112.76 110.23 20.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.23 -0.919 . . . . 0.0 110.163 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.48 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -81.4 123.76 28.84 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.23 -0.919 . . . . 0.0 109.817 179.585 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.525 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 78.7 m -79.73 178.58 8.06 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.324 -0.86 . . . . 0.0 110.251 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -80.69 114.74 19.79 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.25 -0.906 . . . . 0.0 110.176 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.419 HG23 ' H ' ' A' ' 34' ' ' VAL . 42.4 t -47.33 103.0 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.334 -0.854 . . . . 0.0 109.796 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.752 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 145.4 -11.46 1.77 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.579 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.9 OUTLIER -79.54 167.38 20.84 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.127 -1.219 . . . . 0.0 109.923 179.994 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . 1.066 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -108.21 33.96 3.86 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.048 -1.032 . . . . 0.0 110.555 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.488 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.5 156.32 27.6 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.48 ' O ' HG22 ' A' ' 39' ' ' VAL . 7.6 p -87.51 33.27 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.2 -1.176 . . . . 0.0 109.834 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.593 ' HG3' ' CE1' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -148.68 20.02 1.03 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.349 -0.845 . . . . 0.0 109.677 -179.65 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.525 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 7.1 p 30.77 94.42 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.65 0.738 . . . . 0.0 111.603 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 6.2 tm-20 -153.8 -36.69 0.1 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.551 -0.718 . . . . 0.0 109.96 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 1.066 ' CD2' HG23 ' A' ' 37' ' ' THR . 18.6 p-80 -122.82 116.28 23.41 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.233 -0.917 . . . . 0.0 109.624 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.626 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 23.9 t80 -79.62 107.94 12.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.763 -0.586 . . . . 0.0 110.486 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.559 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -67.43 -30.55 70.32 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.397 -0.814 . . . . 0.0 109.428 179.663 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.752 HD12 ' O ' ' A' ' 35' ' ' GLY . 4.5 mt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.188 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.875 ' HB2' HG11 ' A' ' 23' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.363 0.601 . . . . 0.0 110.225 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.794 ' CG1' HG22 ' A' ' 20' ' ' ILE . 1.1 tp -144.18 154.47 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.305 -0.872 . . . . 0.0 110.16 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.506 ' O ' ' N ' ' A' ' 21' ' ' TYR . 3.1 m -140.47 168.19 20.37 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.262 -0.898 . . . . 0.0 110.119 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.44 179.55 6.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.176 -0.953 . . . . 0.0 110.302 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 86.4 m -105.22 164.76 11.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.262 -0.898 . . . . 0.0 110.276 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.8 t -102.34 -152.38 0.44 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.326 -0.859 . . . . 0.0 110.141 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.414 ' O ' ' N ' ' A' ' 10' ' ' MET . 0.8 OUTLIER -83.81 171.55 13.02 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.34 -0.85 . . . . 0.0 110.076 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 8' ' ' SER . 3.0 t0 42.42 27.87 0.1 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.185 -0.947 . . . . 0.0 110.191 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.414 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -126.21 3.99 7.1 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.276 -0.89 . . . . 0.0 110.15 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -110.35 86.73 2.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.263 -0.898 . . . . 0.0 110.265 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.01 64.64 0.39 Allowed Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -154.19 -60.62 0.13 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.263 -1.139 . . . . 0.0 110.165 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 40' ' ' ARG . 25.4 p -96.28 117.18 30.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.278 -0.889 . . . . 0.0 110.43 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.589 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.3 mt -69.22 -42.66 75.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.49 -0.756 . . . . 0.0 109.784 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.3 m80 -117.25 80.63 1.52 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.439 -0.788 . . . . 0.0 110.388 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.416 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -177.33 152.76 12.39 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.211 -1.556 . . . . 0.0 109.211 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.545 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -80.85 169.81 17.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.125 -1.22 . . . . 0.0 110.563 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -107.22 130.12 54.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.241 -0.912 . . . . 0.0 110.798 -179.579 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.894 HD13 ' HD2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -132.79 -165.89 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.363 -0.836 . . . . 0.0 109.494 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.506 ' N ' ' O ' ' A' ' 4' ' ' THR . 12.5 t80 -149.57 135.16 18.49 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.054 -1.029 . . . . 0.0 109.871 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.59 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.2 mm? -95.77 134.05 39.16 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.15 -0.969 . . . . 0.0 111.234 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.875 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.0 p -90.73 -25.16 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.434 -0.791 . . . . 0.0 110.385 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.88 -14.53 59.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.096 -1.003 . . . . 0.0 108.82 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.548 ' O ' ' N ' ' A' ' 27' ' ' GLN . 5.5 ttm -147.31 67.38 1.14 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 25' ' ' MET . 17.2 p -29.81 87.68 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.599 0.714 . . . . 0.0 111.922 -178.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.0 OUTLIER -157.83 170.67 21.81 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.67 -0.644 . . . . 0.0 109.782 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -79.4 125.18 29.2 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.413 -0.804 . . . . 0.0 110.582 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.894 ' HD2' HD13 ' A' ' 20' ' ' ILE . 30.1 t80 -105.7 167.49 9.73 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.392 -0.817 . . . . 0.0 109.46 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.493 ' HA ' ' CD1' ' A' ' 20' ' ' ILE . 2.4 m -152.13 117.66 5.35 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.028 -1.045 . . . . 0.0 110.683 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.883 ' H ' HD11 ' A' ' 20' ' ' ILE . 4.8 tpp85 -84.89 125.79 32.93 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.104 -0.998 . . . . 0.0 108.896 179.06 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.3 m -79.69 163.62 24.39 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.129 -0.982 . . . . 0.0 110.334 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.508 ' O ' ' N ' ' A' ' 35' ' ' GLY . 10.2 tt0 -78.19 111.91 14.62 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.754 -0.779 . . . . 0.0 109.287 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.434 ' C ' ' O ' ' A' ' 33' ' ' GLU . 35.3 t -41.86 94.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.578 -0.701 . . . . 0.0 109.985 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.642 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 153.73 -17.2 0.65 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.565 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.6 m-85 -79.37 167.92 20.2 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.081 -1.247 . . . . 0.0 109.92 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . 1.035 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -113.86 37.01 3.41 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.139 -1.025 . . . . 0.0 110.924 -179.491 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.428 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.91 157.38 28.87 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.7 p -88.99 27.56 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.277 -1.131 . . . . 0.0 109.551 179.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.566 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 12.1 ttp180 -127.16 -18.87 4.46 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.539 -0.726 . . . . 0.0 110.276 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.7 m 68.45 78.83 0.22 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.156 -0.965 . . . . 0.0 109.829 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.566 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -152.18 -32.56 0.14 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.473 -0.767 . . . . 0.0 110.984 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 1.035 ' CD2' HG23 ' A' ' 37' ' ' THR . 20.4 p-80 -123.17 118.95 28.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.894 -1.129 . . . . 0.0 110.922 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 40.6 t80 -81.64 105.18 12.58 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.322 0.582 . . . . 0.0 109.798 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.522 ' CD1' ' C ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -64.78 -27.37 68.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.288 -0.883 . . . . 0.0 110.095 -179.567 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.642 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.7 mt . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.348 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.242 0.544 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.547 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.9 tt -121.19 152.79 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.315 -0.865 . . . . 0.0 110.063 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.482 ' CB ' ' HB3' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -110.01 169.69 8.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.902 . . . . 0.0 110.271 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -117.87 159.69 22.67 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.285 -0.884 . . . . 0.0 110.103 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.51 ' CB ' ' HG ' ' A' ' 19' ' ' CYS . 61.4 m -110.65 -151.26 0.47 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.113 -0.992 . . . . 0.0 110.34 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.7 t -152.99 -151.07 0.36 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.291 -0.88 . . . . 0.0 110.086 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.42 ' O ' ' C ' ' A' ' 9' ' ' ASP . 79.2 p -86.99 165.38 15.89 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.182 -0.949 . . . . 0.0 110.119 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.42 ' C ' ' O ' ' A' ' 8' ' ' SER . 2.2 m-20 41.48 31.01 0.16 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.214 -0.929 . . . . 0.0 110.301 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.78 -14.38 9.01 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.344 -0.847 . . . . 0.0 110.362 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -148.65 107.4 3.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.0 110.428 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -104.44 52.82 0.72 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.336 -1.506 . . . . 0.0 109.336 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -126.58 -55.37 1.42 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -1.106 . . . . 0.0 110.447 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.3 p -96.59 117.23 30.52 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.132 -0.98 . . . . 0.0 110.619 -179.628 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.621 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 14.4 mt -82.26 -39.52 22.89 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.365 -0.835 . . . . 0.0 109.839 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.6 m80 -121.41 84.35 2.23 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.443 -0.786 . . . . 0.0 110.243 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -177.02 175.8 47.82 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -93.22 141.49 28.37 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.269 -1.136 . . . . 0.0 110.276 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.518 ' C ' HD13 ' A' ' 20' ' ' ILE . 7.9 t -98.79 124.12 43.46 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.353 -0.842 . . . . 0.0 110.144 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.826 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.55 -173.7 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.389 -0.82 . . . . 0.0 110.141 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.482 ' HB3' ' CB ' ' A' ' 4' ' ' THR . 10.8 t80 -138.99 136.53 35.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.832 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.651 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.3 mm? -92.41 133.94 35.41 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.02 -1.05 . . . . 0.0 111.009 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.1 p -90.46 -27.7 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.356 -0.84 . . . . 0.0 110.563 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -78.36 -17.79 56.0 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.082 -1.011 . . . . 0.0 108.964 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.548 ' O ' ' N ' ' A' ' 27' ' ' GLN . 14.8 mtt -142.62 64.9 1.36 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.48 ' C ' ' O ' ' A' ' 25' ' ' MET . 11.8 p -29.18 88.69 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.716 0.769 . . . . 0.0 111.553 -178.368 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.7 pt20 -160.32 171.8 18.48 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.655 -0.653 . . . . 0.0 109.636 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -80.08 122.7 27.1 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.385 -0.822 . . . . 0.0 110.478 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.651 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.3 t80 -113.07 129.75 56.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.507 -0.746 . . . . 0.0 109.429 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.7 m -129.84 113.32 14.52 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.99 -1.069 . . . . 0.0 110.874 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -79.57 133.38 36.45 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.282 -0.886 . . . . 0.0 109.097 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 10.8 m -78.99 160.26 27.27 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.235 -0.916 . . . . 0.0 109.985 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.516 ' O ' ' N ' ' A' ' 35' ' ' GLY . 12.1 tt0 -78.54 112.99 16.17 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.294 -0.879 . . . . 0.0 109.023 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.436 ' C ' ' O ' ' A' ' 33' ' ' GLU . 24.0 t -40.76 94.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.586 -0.696 . . . . 0.0 110.3 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.901 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 153.41 -18.89 0.7 Allowed Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 3.6 m-85 -82.2 166.19 19.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -1.162 . . . . 0.0 109.902 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.772 HG23 ' NE2' ' A' ' 43' ' ' HIS . 9.1 t -121.38 47.81 1.78 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.973 -1.079 . . . . 0.0 111.158 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.63 157.62 29.07 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.7 p -88.59 23.83 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.345 -1.091 . . . . 0.0 109.421 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.588 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 11.2 ttp180 -126.51 -19.66 4.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.578 -0.701 . . . . 0.0 110.291 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.8 m 68.18 68.54 0.33 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.12 -0.987 . . . . 0.0 110.263 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.588 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 5.3 tm-20 -137.99 -27.87 0.89 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.367 -0.833 . . . . 0.0 110.992 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.772 ' NE2' HG23 ' A' ' 37' ' ' THR . 20.8 p-80 -126.95 121.82 32.81 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.762 -1.211 . . . . 0.0 111.111 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.627 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.3 t80 -83.16 101.18 11.03 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.54 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.1 OUTLIER -64.31 -14.33 55.4 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.208 -0.933 . . . . 0.0 110.149 -179.362 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.901 HD12 ' O ' ' A' ' 35' ' ' GLY . 6.9 mt . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.228 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.851 ' N ' HG11 ' A' ' 23' ' ' VAL . 2.8 m . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.312 0.577 . . . . 0.0 110.646 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.828 HD11 ' CG2' ' A' ' 20' ' ' ILE . 0.9 OUTLIER -80.11 164.6 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.245 -0.91 . . . . 0.0 109.873 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.544 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 2.3 m -148.7 166.34 28.67 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.11 -0.994 . . . . 0.0 110.259 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.65 162.02 13.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.234 -0.916 . . . . 0.0 110.163 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.8 m -93.19 -150.25 0.28 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.266 -0.896 . . . . 0.0 110.194 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 t -147.37 -155.42 0.62 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.264 -0.898 . . . . 0.0 110.22 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.34 172.11 14.19 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.29 -0.881 . . . . 0.0 110.205 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.5 t0 47.83 23.71 0.49 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.218 -0.926 . . . . 0.0 110.276 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.14 9.65 6.26 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.255 -0.903 . . . . 0.0 110.234 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.403 ' OD1' ' SG ' ' A' ' 14' ' ' CYS . 0.9 OUTLIER -119.52 76.84 1.16 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -0.912 . . . . 0.0 110.402 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -121.74 -8.95 7.21 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -91.67 -49.19 6.42 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.252 -1.146 . . . . 0.0 110.165 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.581 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.0 p -101.46 121.13 41.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.405 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.601 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.4 mt -90.03 -40.18 12.47 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -0.927 . . . . 0.0 110.402 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.601 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.6 m80 -114.19 89.93 3.22 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.204 -0.935 . . . . 0.0 110.12 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 171.1 -167.1 40.27 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -117.68 162.85 17.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.368 -1.078 . . . . 0.0 110.298 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.879 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -98.16 137.97 36.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.262 -0.899 . . . . 0.0 110.185 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.879 HD13 ' O ' ' A' ' 19' ' ' CYS . 15.9 mm -142.38 172.71 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.319 -0.863 . . . . 0.0 110.169 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.544 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 32.1 t80 -134.4 136.02 43.02 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.103 -0.998 . . . . 0.0 109.849 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.562 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 3.4 mm? -99.54 132.37 44.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.019 -1.051 . . . . 0.0 111.043 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.851 HG11 ' N ' ' A' ' 2' ' ' SER . 11.5 p -90.77 -24.58 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.6 -0.688 . . . . 0.0 110.722 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -78.05 -15.14 59.17 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.027 -1.046 . . . . 0.0 108.801 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.544 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -147.17 67.17 1.14 Allowed 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.641 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.492 ' C ' ' O ' ' A' ' 25' ' ' MET . 61.9 p -28.97 88.63 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.762 0.792 . . . . 0.0 111.403 -178.278 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.65 149.0 16.36 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.974 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.528 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.5 t30 -59.3 157.33 11.02 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.303 -0.873 . . . . 0.0 109.886 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.582 ' CD1' ' N ' ' A' ' 30' ' ' CYS . 12.9 t80 -138.87 159.77 41.34 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.312 -0.867 . . . . 0.0 109.699 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.582 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 28.6 m -153.47 107.61 3.06 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.07 -1.019 . . . . 0.0 110.595 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.483 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 1.3 tpp180 -82.43 121.35 26.62 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.252 -0.905 . . . . 0.0 109.468 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.519 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 75.8 m -79.46 170.75 16.12 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.219 -0.926 . . . . 0.0 110.549 -179.451 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -79.51 114.47 18.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.399 -0.813 . . . . 0.0 110.052 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 47.2 t -47.54 103.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.392 -0.818 . . . . 0.0 109.75 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 145.93 -10.66 1.62 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.477 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.39 176.16 9.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.112 -1.228 . . . . 0.0 109.84 179.905 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.669 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -115.03 31.56 6.61 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.98 -1.075 . . . . 0.0 110.878 -179.432 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.26 159.84 31.17 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.54 ' O ' HG22 ' A' ' 39' ' ' VAL . 12.7 p -86.98 37.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -1.122 . . . . 0.0 109.545 179.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.579 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -150.7 15.06 0.76 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.463 -0.773 . . . . 0.0 110.005 -179.441 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.519 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 9.4 p 32.67 87.19 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.67 -0.644 . . . . 0.0 110.6 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.579 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 1.5 tt0 -151.2 -38.76 0.12 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.403 -0.81 . . . . 0.0 110.286 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.669 ' CE1' HG23 ' A' ' 37' ' ' THR . 1.6 p-80 -120.53 128.5 53.16 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.04 -1.038 . . . . 0.0 110.703 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.608 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 25.0 t80 -86.76 128.3 35.02 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.424 0.63 . . . . 0.0 110.155 -178.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.593 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -95.38 6.26 49.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.429 -0.794 . . . . 0.0 110.118 -179.391 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 C--N 1.302 -1.48 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.443 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.558 ' HB3' HG11 ' A' ' 23' ' ' VAL . 1.3 t . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.296 0.57 . . . . 0.0 110.287 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 1.001 ' CD1' HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -122.56 152.91 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.308 -0.87 . . . . 0.0 110.139 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.509 ' N ' HG13 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -125.97 172.78 9.65 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.229 -0.919 . . . . 0.0 110.267 -179.972 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.91 166.25 12.27 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.244 -0.91 . . . . 0.0 110.19 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 21.6 m -92.8 -143.76 0.22 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.211 -0.931 . . . . 0.0 110.186 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 t -137.12 -178.85 5.39 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 110.131 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.6 m -81.76 8.56 9.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.25 -0.906 . . . . 0.0 110.171 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -125.84 21.49 7.59 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.243 -0.911 . . . . 0.0 110.238 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.67 21.86 2.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.226 -0.922 . . . . 0.0 110.188 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -113.58 91.33 3.6 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.224 -0.922 . . . . 0.0 110.163 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -158.99 49.4 0.41 Allowed Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -144.98 -65.75 0.33 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -1.145 . . . . 0.0 110.191 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.632 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 24.6 p -83.64 125.68 32.08 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.224 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -89.48 -41.4 12.08 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.19 -0.944 . . . . 0.0 110.369 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.597 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.7 m80 -112.5 77.21 1.03 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.117 -0.989 . . . . 0.0 110.209 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -170.08 178.5 42.87 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -107.19 140.08 40.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.295 -1.121 . . . . 0.0 110.36 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -82.28 139.85 33.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.218 -0.927 . . . . 0.0 109.965 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.082 HD11 ' CD1' ' A' ' 29' ' ' TYR . 26.3 pt -156.21 -163.58 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.199 -0.938 . . . . 0.0 110.205 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.605 ' O ' HD12 ' A' ' 3' ' ' ILE . 5.3 t80 -153.48 141.61 20.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.156 -0.965 . . . . 0.0 109.882 -179.741 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.682 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.7 mm? -92.48 136.02 33.57 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.187 -0.946 . . . . 0.0 110.875 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.558 HG11 ' HB3' ' A' ' 2' ' ' SER . 7.7 p -90.94 -27.81 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.387 -0.821 . . . . 0.0 110.706 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' A' ' 25' ' ' MET . 58.3 p30 -78.46 -12.85 60.03 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.91 -1.118 . . . . 0.0 109.002 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 51.2 mtt -147.98 65.82 1.1 Allowed 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.575 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 69.0 p -29.68 89.25 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.703 0.763 . . . . 0.0 111.51 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.26 147.88 16.36 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.864 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.524 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 20.4 p30 -58.36 132.92 55.11 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.127 -0.983 . . . . 0.0 110.141 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 1.082 ' CD1' HD11 ' A' ' 20' ' ' ILE . 10.3 t80 -128.27 123.25 33.66 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.316 -0.865 . . . . 0.0 110.276 -179.611 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.632 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 1.7 m -113.74 115.2 27.44 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.09 -1.006 . . . . 0.0 110.172 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -86.18 100.6 12.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.13 -0.981 . . . . 0.0 109.569 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.583 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 86.6 m -79.52 172.68 13.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.319 -0.863 . . . . 0.0 110.239 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -79.53 127.64 32.38 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.324 -0.86 . . . . 0.0 109.859 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.9 t -71.49 -13.64 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.353 -0.842 . . . . 0.0 110.236 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -74.85 -7.45 80.86 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.535 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -79.78 177.5 8.85 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.183 -1.187 . . . . 0.0 110.091 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.613 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.59 27.57 9.52 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.922 -1.112 . . . . 0.0 110.13 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -159.07 157.76 28.81 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.321 -1.512 . . . . 0.0 109.321 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.808 HG12 ' O ' ' A' ' 39' ' ' VAL . 67.1 t -84.84 43.52 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.186 -1.185 . . . . 0.0 109.705 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.558 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -155.85 16.26 0.36 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.274 -0.891 . . . . 0.0 110.258 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.583 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 9.0 p 32.17 89.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.59 -0.694 . . . . 0.0 110.639 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.558 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 1.8 tt0 -155.95 -41.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.326 -0.859 . . . . 0.0 110.121 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.613 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.4 p-80 -118.37 126.36 51.94 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.066 -1.022 . . . . 0.0 110.512 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.608 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.4 t80 -87.5 129.02 35.22 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.553 -0.717 . . . . 0.0 109.986 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.557 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -92.64 -32.43 14.77 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.432 -0.793 . . . . 0.0 110.091 -179.412 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.8 mt . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.313 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.657 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.197 0.523 . . . . 0.0 110.221 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.715 HD12 HD23 ' A' ' 22' ' ' LEU . 0.9 OUTLIER -109.86 149.94 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.254 -0.904 . . . . 0.0 110.247 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -115.53 179.46 3.96 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.256 -0.903 . . . . 0.0 110.215 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.62 170.81 8.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.242 -0.911 . . . . 0.0 110.199 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 97.8 m -108.48 -167.98 1.3 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.249 -0.907 . . . . 0.0 110.352 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.4 t -130.12 -138.97 0.22 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.058 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 33.0 t -79.71 5.61 12.95 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.09 -1.006 . . . . 0.0 110.133 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -97.33 8.7 44.06 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.283 -0.886 . . . . 0.0 110.018 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.464 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 22.3 ptt? -79.59 -14.06 59.08 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.323 -0.86 . . . . 0.0 110.455 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -107.96 90.15 3.21 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.21 -0.931 . . . . 0.0 110.087 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -171.4 -35.43 0.03 OUTLIER Glycine 0 N--CA 1.487 2.096 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -107.99 -62.82 1.39 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.219 -1.165 . . . . 0.0 110.418 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.526 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.1 p -87.31 117.93 26.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.196 -0.94 . . . . 0.0 110.483 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.763 ' HB2' ' CD2' ' A' ' 16' ' ' HIS . 15.3 mt -78.88 -42.8 26.4 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.293 -0.88 . . . . 0.0 109.985 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.763 ' CD2' ' HB2' ' A' ' 15' ' ' LEU . 7.3 m-70 -119.32 86.75 2.61 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.416 -0.803 . . . . 0.0 110.368 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -179.47 171.1 42.83 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -96.86 162.7 13.29 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.239 -1.153 . . . . 0.0 110.495 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -109.78 132.15 54.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.368 -0.833 . . . . 0.0 110.532 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.661 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -147.3 167.91 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.4 -0.812 . . . . 0.0 109.932 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.493 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 7.0 t80 -120.04 120.44 36.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.131 -0.981 . . . . 0.0 110.178 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.758 HD11 ' CD2' ' A' ' 29' ' ' TYR . 11.1 mt -83.7 136.1 34.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.154 -0.966 . . . . 0.0 110.862 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.657 HG11 ' HB3' ' A' ' 2' ' ' SER . 14.8 p -88.66 -29.5 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.466 -0.771 . . . . 0.0 110.1 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -78.63 -21.86 47.81 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.178 -0.951 . . . . 0.0 108.752 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.574 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -134.34 61.13 1.68 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 178.65 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.47 ' C ' ' O ' ' A' ' 25' ' ' MET . 7.3 p -28.89 85.53 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.523 0.678 . . . . 0.0 111.906 -178.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.574 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -161.35 164.74 29.84 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.613 -0.679 . . . . 0.0 109.633 179.522 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -79.51 91.95 5.22 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.407 -0.808 . . . . 0.0 109.701 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.758 ' CD2' HD11 ' A' ' 22' ' ' LEU . 5.9 t80 -79.8 135.6 36.52 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.414 -0.804 . . . . 0.0 109.826 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.526 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -122.23 117.11 25.38 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.092 -1.005 . . . . 0.0 110.591 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.479 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -80.41 136.74 36.41 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.177 -0.952 . . . . 0.0 109.413 179.16 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 6.3 m -80.38 166.25 21.46 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.178 -0.951 . . . . 0.0 109.764 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.521 ' O ' ' N ' ' A' ' 35' ' ' GLY . 17.9 tt0 -78.41 110.06 13.14 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.122 -0.986 . . . . 0.0 108.772 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' A' ' 33' ' ' GLU . 26.0 t -37.49 93.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 CA-C-O 121.422 0.63 . . . . 0.0 110.412 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.754 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 149.87 -15.17 1.04 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.505 ' CD2' ' O ' ' A' ' 43' ' ' HIS . 1.5 m-85 -80.51 173.95 12.09 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.177 -1.19 . . . . 0.0 110.198 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.796 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.6 OUTLIER -125.47 45.68 2.54 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.055 -1.028 . . . . 0.0 110.835 -179.745 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.444 ' HA3' ' CE1' ' A' ' 43' ' ' HIS . . . -160.03 153.42 24.39 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.3 p -88.23 20.03 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.269 -1.136 . . . . 0.0 109.761 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.594 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 3.1 tmm_? -125.25 -16.78 5.85 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.442 -0.787 . . . . 0.0 110.073 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.8 m 69.79 83.76 0.15 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.312 -0.868 . . . . 0.0 109.919 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.594 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -156.72 -31.11 0.09 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.388 -0.82 . . . . 0.0 111.247 -179.738 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.796 ' CD2' HG23 ' A' ' 37' ' ' THR . 15.8 p-80 -123.89 123.65 40.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.634 -1.291 . . . . 0.0 111.084 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.628 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 28.1 t80 -82.9 105.82 14.21 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.129 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -65.03 -16.16 63.14 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.187 -0.945 . . . . 0.0 109.778 -179.781 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.754 HD12 ' O ' ' A' ' 35' ' ' GLY . 5.7 mt . . . . . 0 N--CA 1.488 1.459 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.28 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.652 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.209 0.528 . . . . 0.0 110.239 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 1.033 HD11 HD12 ' A' ' 20' ' ' ILE . 2.5 tt -133.44 161.16 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.296 -0.877 . . . . 0.0 110.194 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.468 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.2 OUTLIER -126.94 -177.99 4.24 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.209 -0.932 . . . . 0.0 110.326 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.77 171.24 7.61 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.226 -0.921 . . . . 0.0 110.275 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 64.4 m -107.25 -163.08 0.88 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.286 -0.884 . . . . 0.0 110.223 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.56 -167.08 1.67 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.322 -0.861 . . . . 0.0 110.207 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.6 t -83.61 9.27 11.89 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.164 -0.96 . . . . 0.0 110.31 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -134.36 26.09 3.8 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.226 -0.921 . . . . 0.0 110.334 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 ttm -143.94 16.03 1.74 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.262 -0.899 . . . . 0.0 110.217 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.1 p-10 -111.75 57.87 0.63 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -0.906 . . . . 0.0 110.279 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -110.81 62.12 0.29 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.435 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 64.2 t80 -160.18 -50.27 0.05 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.381 -1.07 . . . . 0.0 110.196 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -104.39 119.89 39.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.346 -0.846 . . . . 0.0 110.324 -179.785 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.533 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 5.6 mt -90.49 -48.29 7.19 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.228 -0.92 . . . . 0.0 110.127 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.577 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 11.2 m80 -103.73 69.39 0.97 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.368 -0.833 . . . . 0.0 110.25 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -174.14 -170.59 37.62 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -114.84 137.59 51.78 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.199 -1.177 . . . . 0.0 110.337 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.661 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -85.31 146.91 26.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.262 -0.899 . . . . 0.0 110.045 179.801 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.033 HD12 HD11 ' A' ' 3' ' ' ILE . 8.1 pt -159.46 -174.57 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.282 -0.886 . . . . 0.0 110.272 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 5.9 t80 -135.97 120.54 18.24 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.283 -0.885 . . . . 0.0 109.825 179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.785 HD11 ' CD2' ' A' ' 29' ' ' TYR . 13.2 mt -79.71 131.69 36.01 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.242 -0.911 . . . . 0.0 110.975 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.652 HG11 ' CB ' ' A' ' 2' ' ' SER . 7.7 p -87.49 -27.98 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 109.839 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -78.65 -20.63 49.84 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 108.739 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.562 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -140.18 63.69 1.47 Allowed 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.79 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.485 ' C ' ' O ' ' A' ' 25' ' ' MET . 20.1 p -29.12 87.55 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 121.682 0.753 . . . . 0.0 111.503 -178.663 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.562 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.97 148.85 15.71 Favored 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.652 -0.655 . . . . 0.0 109.371 179.937 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.518 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 7.7 p30 -64.44 105.05 0.86 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.316 -0.865 . . . . 0.0 109.762 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.944 ' CD1' HD11 ' A' ' 20' ' ' ILE . 4.9 t80 -99.75 144.66 28.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.343 -0.848 . . . . 0.0 110.018 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 42.9 m -137.44 115.33 11.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.011 -1.056 . . . . 0.0 110.581 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -80.87 114.94 20.09 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.221 -0.925 . . . . 0.0 109.683 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.471 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 91.2 m -79.6 172.99 13.03 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.21 -0.932 . . . . 0.0 110.44 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -79.44 118.41 21.3 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.371 -0.831 . . . . 0.0 109.964 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.2 t -50.87 106.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.301 -0.874 . . . . 0.0 109.763 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.665 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 143.97 -10.76 2.08 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.577 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.37 168.45 19.49 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.159 -1.2 . . . . 0.0 109.829 179.855 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.916 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.71 30.58 6.18 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.952 -1.093 . . . . 0.0 110.791 -179.742 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.12 154.61 25.66 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.496 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.6 p -84.87 44.22 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.297 -1.119 . . . . 0.0 109.759 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.575 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.55 22.58 0.18 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.461 -0.774 . . . . 0.0 109.759 -179.571 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.518 ' HG ' ' HA ' ' A' ' 14' ' ' CYS . 2.9 p 27.78 92.05 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 CA-C-O 121.387 0.613 . . . . 0.0 111.452 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -153.29 -37.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.442 -0.786 . . . . 0.0 110.278 179.833 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.916 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.9 p80 -121.92 116.48 24.45 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.194 -0.941 . . . . 0.0 110.451 179.495 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.572 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 38.0 t80 -79.89 115.47 19.5 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.477 0.656 . . . . 0.0 109.882 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.543 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -82.93 -26.24 31.62 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.295 -0.878 . . . . 0.0 110.038 -179.557 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.665 HD12 ' O ' ' A' ' 35' ' ' GLY . 4.5 mt . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.172 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.602 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.209 0.528 . . . . 0.0 110.222 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.543 HD11 ' HB ' ' A' ' 20' ' ' ILE . 1.8 tt -121.42 156.3 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.266 -0.896 . . . . 0.0 110.248 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.702 ' O ' HG22 ' A' ' 20' ' ' ILE . 4.9 t -141.56 -150.59 0.32 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.334 -0.854 . . . . 0.0 110.087 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.666 ' N ' HG23 ' A' ' 4' ' ' THR . 7.6 mttt -118.18 -174.82 2.73 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.502 -0.749 . . . . 0.0 110.446 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.506 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 67.4 m -109.97 -150.04 0.45 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.344 -0.848 . . . . 0.0 110.201 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.12 -170.69 1.93 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.27 -0.893 . . . . 0.0 110.17 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.78 15.54 11.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.238 -0.913 . . . . 0.0 110.224 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -128.9 31.36 4.94 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.215 -0.928 . . . . 0.0 110.181 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.4 ttt -148.21 20.03 1.09 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.267 -0.896 . . . . 0.0 110.337 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -101.82 75.02 1.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.897 . . . . 0.0 110.145 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -136.15 20.54 3.57 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -119.49 -58.56 1.9 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.12 -1.223 . . . . 0.0 110.297 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.721 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 26.0 p -97.06 121.71 39.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.321 -0.862 . . . . 0.0 110.349 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.561 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.8 mt -90.79 -45.55 8.75 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.222 -0.924 . . . . 0.0 110.382 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.57 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 6.3 m80 -108.81 77.03 1.05 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.257 -0.902 . . . . 0.0 110.148 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -173.09 -163.61 27.1 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -123.32 135.49 54.22 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.218 -1.166 . . . . 0.0 110.209 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.506 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t -79.9 144.94 32.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -0.887 . . . . 0.0 110.11 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.751 HD12 ' CD1' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -158.18 -179.86 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.22 -0.925 . . . . 0.0 109.565 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.511 ' O ' HG13 ' A' ' 3' ' ' ILE . 17.9 t80 -144.22 128.58 17.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.886 -1.134 . . . . 0.0 110.449 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.598 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.7 mm? -85.14 130.63 34.57 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.15 -0.969 . . . . 0.0 110.789 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.602 HG11 ' CB ' ' A' ' 2' ' ' SER . 6.0 p -90.86 -25.74 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.345 -0.847 . . . . 0.0 110.564 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -78.08 -3.62 43.21 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.008 -1.057 . . . . 0.0 108.925 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.522 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -159.81 68.41 0.4 Allowed 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 179.18 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.509 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.58 91.76 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.981 0.896 . . . . 0.0 111.2 -178.409 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -160.18 147.95 16.53 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.517 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 23.1 t30 -63.21 128.71 37.09 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.373 -0.83 . . . . 0.0 110.235 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.751 ' CD1' HD12 ' A' ' 20' ' ' ILE . 6.5 t80 -122.16 116.58 24.43 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.357 -0.839 . . . . 0.0 110.108 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.721 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 1.8 m -122.57 112.69 18.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.223 -0.923 . . . . 0.0 110.142 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -80.13 102.06 9.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.173 -0.954 . . . . 0.0 109.842 179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 74.4 m -79.54 170.42 16.59 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.875 . . . . 0.0 110.041 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 32.2 tt0 -79.45 125.45 29.57 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.221 -0.924 . . . . 0.0 109.807 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.422 ' H ' HG23 ' A' ' 34' ' ' VAL . 10.5 t -66.43 -20.72 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.398 -0.814 . . . . 0.0 110.182 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.418 ' O ' HD12 ' A' ' 46' ' ' LEU . . . -66.93 -10.6 56.35 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.57 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.79 176.52 9.65 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -1.185 . . . . 0.0 109.912 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.956 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -108.64 27.48 9.37 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.907 -1.121 . . . . 0.0 110.343 179.573 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.754 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -159.29 155.59 26.68 Favored Glycine 0 N--CA 1.488 2.137 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.541 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.5 p -84.63 43.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.289 -1.124 . . . . 0.0 109.815 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -157.02 20.11 0.31 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.32 -0.862 . . . . 0.0 110.051 -179.557 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 8.9 p 29.22 91.42 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.495 0.664 . . . . 0.0 111.614 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.3 tt0 -155.56 -36.96 0.09 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.339 -0.851 . . . . 0.0 110.158 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.956 ' CD2' HG23 ' A' ' 37' ' ' THR . 30.1 p-80 -121.13 121.07 37.05 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.143 -0.973 . . . . 0.0 110.462 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.597 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 33.8 t80 -83.88 121.94 28.03 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.378 0.609 . . . . 0.0 109.839 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.566 ' HB2' HG21 ' A' ' 37' ' ' THR . 0.2 OUTLIER -92.22 -19.83 21.8 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.28 -0.888 . . . . 0.0 110.069 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.597 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.0 mt . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.327 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 121.216 0.531 . . . . 0.0 110.469 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.683 ' CG1' HG22 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -79.93 153.97 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.242 -0.911 . . . . 0.0 109.913 179.675 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.507 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.4 m -136.05 162.19 33.59 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.281 -0.887 . . . . 0.0 110.252 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -93.6 -178.8 4.82 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.433 -0.792 . . . . 0.0 110.099 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.546 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 15.5 m -110.97 -163.42 0.85 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.219 -0.926 . . . . 0.0 110.274 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.55 -158.84 0.9 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.271 -0.893 . . . . 0.0 110.159 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.0 p -81.77 168.65 17.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.234 -0.917 . . . . 0.0 110.121 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 46.5 23.68 0.25 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.141 -0.974 . . . . 0.0 110.345 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -120.75 -0.77 10.1 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 110.163 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -120.56 101.41 7.74 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.237 -0.914 . . . . 0.0 110.257 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -138.65 16.44 3.32 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -114.74 -53.4 2.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.313 -1.11 . . . . 0.0 110.284 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -93.62 123.11 36.72 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.295 -0.878 . . . . 0.0 110.632 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.5 mt -90.31 -42.85 10.73 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.267 -0.896 . . . . 0.0 110.315 179.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.569 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.9 m80 -109.8 88.27 2.71 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.302 -0.874 . . . . 0.0 110.165 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.13 -167.61 40.6 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -123.23 159.43 28.73 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.227 -1.16 . . . . 0.0 110.357 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.546 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.3 OUTLIER -99.94 149.21 23.66 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.231 -0.918 . . . . 0.0 110.504 -179.807 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.763 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.4 mt -155.0 -171.64 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.364 -0.835 . . . . 0.0 109.531 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.507 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 18.7 t80 -145.55 133.56 21.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.042 -1.036 . . . . 0.0 109.644 179.369 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.63 HD23 ' HB2' ' A' ' 29' ' ' TYR . 2.1 mm? -99.4 137.96 37.16 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.129 -0.982 . . . . 0.0 111.076 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.408 ' H ' HG12 ' A' ' 23' ' ' VAL . 7.2 p -90.38 -26.01 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.38 -0.825 . . . . 0.0 110.52 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 25' ' ' MET . 49.0 p30 -77.9 -4.73 48.24 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.119 -0.988 . . . . 0.0 109.095 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.556 ' O ' ' N ' ' A' ' 27' ' ' GLN . 8.8 mtm -157.95 65.57 0.46 Allowed 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 179.069 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.474 ' C ' ' O ' ' A' ' 25' ' ' MET . 68.4 p -29.28 86.93 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 CA-C-O 121.614 0.721 . . . . 0.0 111.831 -178.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.556 ' N ' ' O ' ' A' ' 25' ' ' MET . 2.9 pt20 -160.9 174.91 13.13 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.707 -0.621 . . . . 0.0 109.405 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -79.28 146.85 32.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.345 -0.847 . . . . 0.0 110.549 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.763 ' CD1' HD12 ' A' ' 20' ' ' ILE . 8.1 t80 -129.88 108.54 10.21 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.53 -0.732 . . . . 0.0 109.592 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 5.8 m -111.72 107.77 16.97 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.104 -0.998 . . . . 0.0 110.74 -179.419 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.49 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -79.57 121.63 25.48 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.182 -0.948 . . . . 0.0 109.218 179.182 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.65 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 89.9 m -79.38 173.67 12.34 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.221 -0.925 . . . . 0.0 110.137 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -78.94 115.1 18.4 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.229 -0.919 . . . . 0.0 109.8 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.415 ' H ' HG23 ' A' ' 34' ' ' VAL . 22.0 t -51.93 100.89 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.498 -0.751 . . . . 0.0 109.883 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 151.69 -13.64 0.78 Allowed Glycine 0 N--CA 1.493 2.449 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.433 ' CZ ' ' HD1' ' A' ' 44' ' ' PHE . 1.2 m-85 -79.13 170.54 16.5 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.012 -1.287 . . . . 0.0 110.049 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.839 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -112.38 35.72 3.69 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.937 -1.102 . . . . 0.0 110.544 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.817 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.29 154.9 25.97 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.549 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.0 p -85.18 45.43 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.21 -1.171 . . . . 0.0 109.47 179.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.575 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -158.76 20.01 0.21 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.518 -0.739 . . . . 0.0 109.979 -179.179 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.65 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 2.8 p 27.12 93.56 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.577 -0.702 . . . . 0.0 111.541 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 4.4 tt0 -160.73 -35.65 0.05 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.549 -0.719 . . . . 0.0 110.323 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.839 ' CD2' HG23 ' A' ' 37' ' ' THR . 35.0 p-80 -124.15 112.55 17.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.111 -0.993 . . . . 0.0 110.652 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.433 ' HD1' ' CZ ' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -79.89 134.25 36.28 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.297 -0.877 . . . . 0.0 109.508 179.309 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.55 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -91.14 -24.05 20.08 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.362 -0.836 . . . . 0.0 110.212 -179.303 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.547 ' HG ' ' CD2' ' A' ' 45' ' ' PHE . 1.9 mt . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.277 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.845 ' HB2' HG11 ' A' ' 23' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.189 0.518 . . . . 0.0 110.255 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 1.089 HD11 HD12 ' A' ' 20' ' ' ILE . 6.4 tt -79.93 157.29 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.529 HG23 ' N ' ' A' ' 5' ' ' LYS . 6.4 t -142.58 -153.85 0.49 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.296 -0.877 . . . . 0.0 110.006 179.817 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.529 ' N ' HG23 ' A' ' 4' ' ' THR . 11.7 mtpt -102.73 178.61 4.52 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.394 -0.816 . . . . 0.0 110.258 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 59.6 m -105.69 -150.87 0.44 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.175 -0.953 . . . . 0.0 110.247 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.5 m -111.2 -170.03 1.57 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.209 -0.932 . . . . 0.0 110.203 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.68 13.34 8.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -0.888 . . . . 0.0 110.185 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.63 21.78 5.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.293 -0.88 . . . . 0.0 110.214 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -127.04 3.53 6.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.255 -0.903 . . . . 0.0 110.136 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.53 ' O ' ' ND2' ' A' ' 11' ' ' ASN . 0.6 OUTLIER -86.07 48.65 1.64 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.287 -0.883 . . . . 0.0 110.103 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -126.06 3.55 7.88 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -101.22 -48.49 4.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.15 -1.206 . . . . 0.0 110.27 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 22.1 p -105.16 116.18 31.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.291 -0.881 . . . . 0.0 110.63 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.596 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.6 mt -90.43 -39.05 12.87 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.301 -0.875 . . . . 0.0 110.506 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.596 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 21.3 m80 -110.73 63.11 0.61 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.109 -0.995 . . . . 0.0 110.555 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.481 ' HA3' ' SG ' ' A' ' 32' ' ' CYS . . . -173.51 -160.32 21.69 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -122.66 136.25 54.82 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.292 -1.122 . . . . 0.0 110.177 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t -84.64 146.73 27.33 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.326 -0.859 . . . . 0.0 110.449 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.089 HD12 HD11 ' A' ' 3' ' ' ILE . 5.0 pt -157.78 -170.61 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.379 -0.826 . . . . 0.0 110.104 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.474 ' O ' HG13 ' A' ' 3' ' ' ILE . 4.6 t80 -140.9 133.7 28.94 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.112 -0.993 . . . . 0.0 110.097 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.733 HD12 ' OD2' ' A' ' 24' ' ' ASP . 1.2 mm? -86.7 133.74 33.65 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.122 -0.986 . . . . 0.0 111.113 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.845 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.2 p -90.83 -25.23 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.412 -0.805 . . . . 0.0 110.67 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.733 ' OD2' HD12 ' A' ' 22' ' ' LEU . 2.9 p30 -78.64 -15.52 58.41 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.047 -1.033 . . . . 0.0 108.9 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.6 mtt -147.43 67.0 1.13 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.1 p -29.11 88.76 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.693 0.758 . . . . 0.0 111.661 -178.421 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.3 OUTLIER -160.28 173.44 15.7 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.673 -0.642 . . . . 0.0 109.561 179.643 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -77.18 136.89 38.6 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.368 -0.832 . . . . 0.0 110.522 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.877 ' CD1' HD11 ' A' ' 20' ' ' ILE . 8.6 t80 -135.82 154.42 51.19 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.461 -0.774 . . . . 0.0 109.653 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.617 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 3.0 m -153.64 123.51 6.83 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.926 -1.109 . . . . 0.0 110.94 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.412 ' HA ' ' HD3' ' A' ' 31' ' ' ARG . 15.3 tpp85 -103.04 106.72 17.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.175 -0.953 . . . . 0.0 109.093 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 27.0 m -111.27 -164.82 0.94 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.293 -0.88 . . . . 0.0 110.592 -178.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.418 ' CG ' ' H ' ' A' ' 35' ' ' GLY . 21.2 tt0 -78.24 123.05 26.49 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.244 -0.91 . . . . 0.0 109.615 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.4 t -64.5 -10.59 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.447 -0.783 . . . . 0.0 109.707 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.418 ' H ' ' CG ' ' A' ' 33' ' ' GLU . . . -68.72 -7.09 53.86 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.595 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.6 m-85 -79.46 165.13 23.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.18 -1.188 . . . . 0.0 109.407 179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . 1.037 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.61 34.0 4.22 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.878 -1.139 . . . . 0.0 111.478 -178.823 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.68 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.7 159.5 31.02 Favored Glycine 0 N--CA 1.491 2.336 0 C-N-CA 119.351 -1.404 . . . . 0.0 110.075 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -84.33 13.04 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -1.119 . . . . 0.0 109.362 178.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 28.0 ttp180 -109.08 -17.62 13.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.569 -0.707 . . . . 0.0 110.116 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 21.9 m 61.11 58.65 2.18 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.315 -0.866 . . . . 0.0 110.607 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER -136.35 -19.53 1.44 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.482 -0.761 . . . . 0.0 111.278 179.93 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 1.037 ' CD2' HG23 ' A' ' 37' ' ' THR . 17.3 p-80 -127.52 119.93 27.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.736 -1.227 . . . . 0.0 110.7 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.628 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 21.1 t80 -81.75 108.22 15.12 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.327 0.584 . . . . 0.0 109.964 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.564 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -64.61 -15.9 61.87 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.222 -0.924 . . . . 0.0 109.912 -179.773 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.628 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.0 mt . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.27 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' SER . . . . . 1.028 ' CB ' HG11 ' A' ' 23' ' ' VAL . 48.3 m . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.433 0.635 . . . . 0.0 110.147 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.826 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.8 OUTLIER -139.18 153.0 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.297 -0.877 . . . . 0.0 110.043 -179.954 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -132.83 162.23 32.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.261 -0.899 . . . . 0.0 110.425 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -101.93 168.16 9.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.335 -0.853 . . . . 0.0 110.129 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.723 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 58.4 m -108.83 -145.66 0.4 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.227 -0.92 . . . . 0.0 110.253 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.495 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.3 OUTLIER -153.79 -158.27 0.85 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.311 -0.868 . . . . 0.0 110.062 179.877 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.495 ' N ' ' OG ' ' A' ' 7' ' ' SER . 3.0 t -80.5 168.62 18.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.154 -0.966 . . . . 0.0 110.231 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.6 t0 47.88 22.86 0.4 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.097 -1.002 . . . . 0.0 110.286 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.19 8.17 8.53 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.326 -0.859 . . . . 0.0 110.176 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.428 ' ND2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -114.75 -142.72 0.38 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.285 -0.885 . . . . 0.0 110.04 -179.98 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 116.94 -0.17 19.62 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.426 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 65.2 t80 -110.48 -51.35 2.88 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.222 -1.163 . . . . 0.0 110.132 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.532 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.2 p -96.67 120.74 37.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.307 -0.871 . . . . 0.0 110.163 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.596 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 10.8 mt -88.17 -40.96 13.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.201 -0.937 . . . . 0.0 110.377 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.596 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.1 m80 -114.2 80.3 1.37 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.216 -0.928 . . . . 0.0 110.037 -179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.507 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -179.74 -168.25 38.25 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -115.04 167.55 10.71 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.298 -1.119 . . . . 0.0 110.283 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.723 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 1.3 t -103.68 126.36 50.77 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.394 -0.816 . . . . 0.0 110.378 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.885 HD13 ' HD2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -130.25 -172.9 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.322 -0.861 . . . . 0.0 109.555 -179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.507 ' O ' HD12 ' A' ' 3' ' ' ILE . 14.5 t80 -145.82 142.85 29.23 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.894 -1.129 . . . . 0.0 110.19 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.622 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.2 mm? -104.14 136.64 43.38 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.108 -0.995 . . . . 0.0 111.37 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 1.028 HG11 ' CB ' ' A' ' 2' ' ' SER . 14.7 p -90.78 -27.69 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.352 -0.842 . . . . 0.0 110.556 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -78.77 -19.04 53.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.035 -1.041 . . . . 0.0 108.839 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -138.84 63.6 1.51 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.735 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.486 ' C ' ' O ' ' A' ' 25' ' ' MET . 11.5 p -28.75 89.03 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.679 0.752 . . . . 0.0 111.543 -178.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 5.5 pt20 -159.73 176.74 11.61 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.609 -0.682 . . . . 0.0 109.73 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -88.09 115.94 25.92 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.495 -0.753 . . . . 0.0 110.352 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.885 ' HD2' HD13 ' A' ' 20' ' ' ILE . 28.7 t80 -91.08 157.03 17.47 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.493 -0.755 . . . . 0.0 109.73 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.532 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -141.15 112.85 7.64 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.067 -1.02 . . . . 0.0 110.403 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.772 ' H ' HD11 ' A' ' 20' ' ' ILE . 11.1 tpp180 -88.66 115.77 26.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.262 -0.898 . . . . 0.0 109.479 179.485 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.504 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 91.4 m -79.05 170.12 17.15 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.281 -0.887 . . . . 0.0 110.391 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -79.44 113.97 18.0 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.316 -0.865 . . . . 0.0 110.143 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.411 HG23 ' H ' ' A' ' 34' ' ' VAL . 47.4 t -48.12 104.62 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.362 -0.836 . . . . 0.0 109.786 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.92 -9.18 2.27 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.525 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.41 175.58 10.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.13 -1.217 . . . . 0.0 109.832 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -116.95 13.14 14.85 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.025 -1.047 . . . . 0.0 110.818 -179.583 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -128.74 161.73 22.36 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.641 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.3 p -87.67 31.55 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.298 -1.119 . . . . 0.0 109.743 179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.37 29.62 0.16 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.332 -0.855 . . . . 0.0 109.962 -179.655 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.504 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 8.1 p 31.76 90.8 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.616 -0.677 . . . . 0.0 111.13 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 4.0 tm-20 -154.02 -39.88 0.09 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.295 -0.878 . . . . 0.0 110.098 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.2 p-80 -117.21 128.49 55.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.093 -1.004 . . . . 0.0 110.202 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.588 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 34.9 t80 -88.62 130.49 35.27 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.436 0.636 . . . . 0.0 110.528 -178.549 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -93.48 -36.8 12.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.409 -0.807 . . . . 0.0 110.001 -179.741 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.588 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.379 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.687 ' HB3' HG11 ' A' ' 23' ' ' VAL . 3.7 t . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.335 0.588 . . . . 0.0 110.376 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.884 HG12 HG22 ' A' ' 20' ' ' ILE . 5.5 tt -80.03 -178.25 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.209 -0.932 . . . . 0.0 110.003 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -155.19 160.74 41.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.238 -0.914 . . . . 0.0 110.246 -179.896 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.5 mtmm -110.36 161.93 15.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.297 -0.877 . . . . 0.0 110.218 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.1 m -103.73 -144.64 0.37 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.269 -0.895 . . . . 0.0 110.101 179.991 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB3' ' HB2' ' A' ' 10' ' ' MET . 0.5 OUTLIER -127.61 -154.43 0.63 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.183 -0.948 . . . . 0.0 110.214 179.943 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.3 m -82.35 -61.1 1.99 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.245 -0.909 . . . . 0.0 110.18 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -91.51 27.65 1.93 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.227 -0.92 . . . . 0.0 110.182 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.42 ' HB2' ' HB3' ' A' ' 7' ' ' SER . 0.0 OUTLIER -108.97 -11.83 14.93 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.274 -0.891 . . . . 0.0 110.217 -180.0 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 11' ' ' ASN . 7.7 p-10 -132.77 96.85 3.9 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.307 -0.87 . . . . 0.0 110.202 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.17 52.73 0.67 Allowed Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -121.79 -59.36 1.68 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -1.151 . . . . 0.0 110.184 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -87.75 118.75 27.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 110.296 -179.877 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.744 ' HB2' ' CD2' ' A' ' 16' ' ' HIS . 11.2 mt -78.72 -43.01 26.81 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.303 -0.873 . . . . 0.0 110.288 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.744 ' CD2' ' HB2' ' A' ' 15' ' ' LEU . 14.7 m-70 -116.99 77.54 1.13 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.329 -0.857 . . . . 0.0 110.496 -178.919 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.441 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -175.85 167.71 39.64 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.832 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -89.96 145.55 25.03 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -1.209 . . . . 0.0 110.27 179.956 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 15.9 t -88.9 142.6 27.51 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.331 -0.856 . . . . 0.0 110.349 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.884 HG22 HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -158.74 -175.44 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.314 -0.866 . . . . 0.0 109.697 179.979 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.51 ' O ' HG13 ' A' ' 3' ' ' ILE . 9.4 t80 -152.68 123.27 7.29 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.037 -1.039 . . . . 0.0 109.963 -179.852 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.667 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.9 mm? -82.16 130.98 35.23 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.214 -0.929 . . . . 0.0 111.048 -179.366 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.687 HG11 ' HB3' ' A' ' 2' ' ' SER . 7.7 p -90.39 -23.81 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.298 -0.876 . . . . 0.0 110.42 179.518 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.39 -10.23 59.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.067 -1.021 . . . . 0.0 108.771 178.9 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.547 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.5 mpp? -150.86 69.0 0.96 Allowed 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.466 ' C ' ' O ' ' A' ' 25' ' ' MET . 6.9 p -29.49 87.64 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 121.575 0.702 . . . . 0.0 111.91 -178.183 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 tt0 -158.67 154.1 25.86 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.703 -0.623 . . . . 0.0 109.85 179.595 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.97 127.35 32.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.468 -0.77 . . . . 0.0 110.232 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.799 ' CD1' HD12 ' A' ' 20' ' ' ILE . 15.5 t80 -116.57 123.6 47.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.313 -0.867 . . . . 0.0 109.965 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 5.8 m -125.67 118.58 25.93 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.154 -0.966 . . . . 0.0 110.38 -179.78 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.464 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 5.1 tpp85 -79.43 124.85 28.84 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.218 -0.926 . . . . 0.0 109.421 179.551 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.8 m -79.4 160.4 26.68 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.214 -0.929 . . . . 0.0 109.528 -179.782 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' GLY . 16.2 tt0 -78.79 110.34 13.87 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.072 -1.017 . . . . 0.0 109.411 179.764 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.433 ' C ' ' O ' ' A' ' 33' ' ' GLU . 40.3 t -41.61 94.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.541 -0.724 . . . . 0.0 110.244 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.825 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 152.9 -17.67 0.73 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.868 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.493 ' HH ' ' CG ' ' A' ' 16' ' ' HIS . 2.1 m-85 -79.92 165.97 22.11 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.192 -1.181 . . . . 0.0 110.216 -179.937 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.914 HG23 ' NE2' ' A' ' 43' ' ' HIS . 6.1 t -120.28 35.21 4.94 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 119.103 -1.039 . . . . 0.0 110.902 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.563 ' HA3' ' CE1' ' A' ' 43' ' ' HIS . . . -140.6 153.87 23.87 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 179.721 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.692 HG12 ' O ' ' A' ' 39' ' ' VAL . 43.1 t -85.2 14.05 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.356 -1.085 . . . . 0.0 109.782 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.576 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 2.1 tmm_? -127.9 -15.14 4.91 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.455 -0.778 . . . . 0.0 110.399 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.1 m 71.75 85.59 0.12 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.389 -0.819 . . . . 0.0 109.719 -179.679 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.576 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -152.42 -31.33 0.14 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.638 -0.664 . . . . 0.0 110.715 -179.805 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.914 ' NE2' HG23 ' A' ' 37' ' ' THR . 21.6 p-80 -123.64 118.79 28.09 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.891 -1.131 . . . . 0.0 110.729 179.522 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.612 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 24.6 t80 -80.62 104.06 10.89 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.307 0.575 . . . . 0.0 109.9 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.562 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -64.85 -22.21 66.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.206 -0.934 . . . . 0.0 109.95 -179.774 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.825 HD12 ' O ' ' A' ' 35' ' ' GLY . 4.4 mt . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.139 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.571 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.343 0.592 . . . . 0.0 110.116 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.793 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -143.97 153.62 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.325 -0.86 . . . . 0.0 110.342 -179.769 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.485 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -131.15 173.97 10.5 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.238 -0.914 . . . . 0.0 110.251 179.906 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -106.75 165.14 11.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.234 -0.916 . . . . 0.0 110.149 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.629 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 60.7 m -102.11 -141.17 0.35 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.254 -0.904 . . . . 0.0 110.216 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.5 t -141.25 -160.91 1.13 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.28 -0.888 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.2 28.5 1.41 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.26 -0.9 . . . . 0.0 110.241 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.34 30.85 1.54 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.228 -0.92 . . . . 0.0 110.177 179.962 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -145.44 14.56 1.43 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.97 . . . . 0.0 110.245 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -109.83 75.28 0.93 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.177 -0.952 . . . . 0.0 110.234 -179.967 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.32 -7.47 6.38 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -95.57 -60.28 1.69 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.281 -1.129 . . . . 0.0 110.076 -179.996 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.555 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.1 p -83.89 126.66 33.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.334 -0.854 . . . . 0.0 110.136 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.56 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.5 mt -90.58 -45.72 8.74 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.138 -0.976 . . . . 0.0 110.333 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.56 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.1 m80 -109.33 77.49 1.07 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.257 -0.902 . . . . 0.0 110.233 -179.573 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.484 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -174.5 -163.49 27.86 Favored Glycine 0 N--CA 1.488 2.16 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -128.73 153.15 47.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.328 -1.101 . . . . 0.0 110.285 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.629 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -83.07 152.45 25.35 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.305 -0.872 . . . . 0.0 110.124 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.845 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -153.62 -173.99 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.144 -0.973 . . . . 0.0 109.603 -179.894 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.485 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 23.0 t80 -147.41 133.0 18.76 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.038 -1.039 . . . . 0.0 110.162 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.626 HD22 HD12 ' A' ' 3' ' ' ILE . 1.4 mm? -94.7 134.64 37.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.254 -0.904 . . . . 0.0 110.468 -179.882 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.571 HG11 ' CB ' ' A' ' 2' ' ' SER . 8.1 p -90.38 -27.16 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.344 -0.848 . . . . 0.0 110.599 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' A' ' 25' ' ' MET . 11.2 p30 -78.16 -15.13 59.12 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.106 -0.996 . . . . 0.0 108.757 179.362 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.3 ttm -144.74 65.56 1.27 Allowed 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.852 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 19.8 p -29.05 88.7 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 121.629 0.728 . . . . 0.0 111.751 -178.321 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 7.1 pt20 -160.38 176.15 12.0 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.627 -0.671 . . . . 0.0 109.601 179.488 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -81.68 138.82 35.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.452 -179.836 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.845 ' CD1' HD12 ' A' ' 20' ' ' ILE . 17.7 t80 -128.15 117.32 21.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.372 -0.83 . . . . 0.0 109.838 179.861 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.555 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -114.06 117.39 31.14 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.08 -1.013 . . . . 0.0 110.621 -179.671 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.484 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.0 ttm180 -91.78 129.8 37.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.945 . . . . 0.0 109.749 179.433 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.502 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 71.9 m -79.4 175.12 10.89 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.279 -0.888 . . . . 0.0 110.241 -179.869 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -79.81 112.85 17.49 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -0.891 . . . . 0.0 109.854 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.423 HG23 ' H ' ' A' ' 34' ' ' VAL . 43.4 t -47.27 105.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.361 -0.837 . . . . 0.0 109.887 -179.94 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.47 -8.89 2.37 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.743 -1.343 . . . . 0.0 109.743 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.477 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.33 176.07 10.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.116 -1.226 . . . . 0.0 110.056 179.963 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.608 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -115.12 31.31 6.78 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.119 -0.988 . . . . 0.0 110.378 -179.49 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.06 155.31 26.43 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.519 ' O ' HG22 ' A' ' 39' ' ' VAL . 12.5 p -84.76 43.07 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.275 -1.133 . . . . 0.0 109.789 179.61 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.568 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.27 22.21 0.16 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.412 -0.805 . . . . 0.0 109.918 -179.537 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.502 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 6.6 p 28.95 92.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.697 -0.627 . . . . 0.0 111.472 179.767 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.4 OUTLIER -154.2 -42.85 0.09 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.378 -0.826 . . . . 0.0 110.139 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.608 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.4 p-80 -118.24 127.75 54.03 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.09 -1.006 . . . . 0.0 110.364 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.604 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 37.6 t80 -86.86 128.07 35.04 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.387 0.613 . . . . 0.0 110.508 -178.65 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -92.59 -35.2 13.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.385 -0.822 . . . . 0.0 109.964 -179.758 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.604 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.22 -179.713 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.534 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.38 0.61 . . . . 0.0 110.173 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.705 HD11 ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -147.8 156.73 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.28 -0.887 . . . . 0.0 110.161 -179.948 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.496 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.8 m -133.43 164.32 27.4 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.294 -0.879 . . . . 0.0 110.158 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 19' ' ' CYS . 10.6 tttt -126.41 155.05 42.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.205 -0.935 . . . . 0.0 110.181 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.2 m -99.91 -146.14 0.34 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.255 -0.903 . . . . 0.0 110.227 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.5 t -122.23 -164.42 1.16 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.294 -0.879 . . . . 0.0 110.221 179.912 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -87.13 11.52 13.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.227 -0.92 . . . . 0.0 110.321 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -121.98 26.35 8.63 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.24 -0.913 . . . . 0.0 110.188 179.938 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.4 14.16 4.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.297 -0.877 . . . . 0.0 110.138 179.935 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -102.47 66.5 0.98 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.931 . . . . 0.0 110.269 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.26 26.26 10.62 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -145.86 -55.8 0.29 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -1.133 . . . . 0.0 110.249 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.553 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.4 p -90.51 127.34 36.21 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.26 -0.9 . . . . 0.0 110.354 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.67 ' N ' HD23 ' A' ' 15' ' ' LEU . 3.5 mt -90.52 -44.88 9.29 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.231 -0.918 . . . . 0.0 110.344 179.885 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 18.0 m80 -110.51 89.38 3.01 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.318 -0.864 . . . . 0.0 110.487 -179.168 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.474 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.23 -161.46 31.55 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 179.931 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -134.14 149.3 51.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.292 -1.122 . . . . 0.0 110.229 179.881 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.3 t -79.9 120.29 23.93 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.216 -0.928 . . . . 0.0 110.027 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.705 ' CG2' HD11 ' A' ' 3' ' ' ILE . 21.2 mm -122.32 168.64 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 110.224 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.496 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 18.3 t80 -139.47 129.94 25.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 109.994 -179.988 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.608 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 3.6 mm? -90.06 134.42 34.26 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.214 -0.929 . . . . 0.0 110.638 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.534 HG11 ' HB3' ' A' ' 2' ' ' SER . 11.3 p -90.48 -25.58 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.269 -0.894 . . . . 0.0 110.541 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -78.34 -14.45 59.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.086 -1.009 . . . . 0.0 108.82 179.323 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.3 ttm -147.47 66.66 1.13 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.992 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 58.8 p -29.21 88.57 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.675 0.75 . . . . 0.0 111.467 -178.437 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.39 146.38 15.26 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.493 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -55.81 161.55 2.15 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.132 -0.98 . . . . 0.0 110.388 -179.711 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.608 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 5.9 t80 -154.59 86.31 1.14 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.402 -0.811 . . . . 0.0 109.906 -179.908 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.553 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.2 m -82.8 104.71 13.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.188 -0.945 . . . . 0.0 110.53 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.494 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 11.5 tpp85 -81.7 123.17 28.5 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.212 -0.93 . . . . 0.0 110.118 179.698 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.494 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 97.7 m -79.79 172.78 13.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.328 -0.858 . . . . 0.0 110.145 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -79.81 128.81 33.88 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.891 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.3 t -58.54 105.84 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.249 -0.907 . . . . 0.0 110.084 -179.937 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 1.019 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 145.17 -14.16 1.88 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.716 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.589 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.2 m-85 -79.75 154.24 28.67 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.344 -1.092 . . . . 0.0 109.903 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.952 HG23 ' NE2' ' A' ' 43' ' ' HIS . 5.1 t -109.42 46.58 0.99 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.954 -1.092 . . . . 0.0 110.782 -179.762 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.2 156.18 27.4 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.693 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.651 ' O ' HG22 ' A' ' 39' ' ' VAL . 10.6 p -87.11 37.2 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.261 -1.141 . . . . 0.0 109.753 179.609 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.593 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.09 22.36 0.16 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.418 -0.801 . . . . 0.0 109.839 -179.483 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.486 ' C ' ' O ' ' A' ' 40' ' ' ARG . 4.2 p 29.74 91.5 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.609 -0.682 . . . . 0.0 111.645 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.593 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 0.7 OUTLIER -144.92 -36.91 0.3 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.552 -0.717 . . . . 0.0 109.906 179.382 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.952 ' NE2' HG23 ' A' ' 37' ' ' THR . 19.5 p-80 -124.21 117.78 25.35 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.164 -0.96 . . . . 0.0 109.9 178.798 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.615 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 46.2 t80 -79.58 103.09 9.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.73 -0.606 . . . . 0.0 110.218 -179.365 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.584 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -65.85 -28.47 69.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.43 -0.794 . . . . 0.0 110.15 -179.763 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 1.019 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.6 mt . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.342 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.191 0.519 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.548 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.7 tt -122.95 155.52 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.34 -0.85 . . . . 0.0 110.167 -179.997 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.537 ' CB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -119.77 -167.8 1.49 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.128 -0.983 . . . . 0.0 110.32 -179.959 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.4 mttp -126.36 -179.89 4.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.214 -0.929 . . . . 0.0 110.468 -179.825 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.71 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 1.9 m -114.95 -161.25 0.77 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.288 -0.882 . . . . 0.0 110.18 179.972 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.7 t -132.29 -144.84 0.25 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.121 -0.987 . . . . 0.0 110.442 -179.826 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 79.4 p -79.61 2.74 21.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.308 -0.87 . . . . 0.0 110.392 -179.821 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -96.93 28.41 3.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 109.868 179.849 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.494 ' HG3' ' HB2' ' A' ' 19' ' ' CYS . 8.9 tmm? -116.75 5.4 13.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.395 -0.816 . . . . 0.0 110.323 -179.676 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -90.02 60.74 4.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.207 -0.933 . . . . 0.0 109.923 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -157.17 -36.06 0.02 OUTLIER Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.576 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 43.4 t80 -93.86 -54.99 3.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.149 -1.206 . . . . 0.0 110.698 -179.692 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.577 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 19.2 p -117.83 117.07 28.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.081 -1.012 . . . . 0.0 110.607 -179.641 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.591 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 17.5 mt -91.33 -50.28 5.9 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.391 -0.818 . . . . 0.0 110.449 179.725 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 6.8 m80 -98.45 79.03 2.46 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.498 -0.751 . . . . 0.0 110.342 -178.813 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.46 163.85 26.98 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -94.33 143.87 26.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.282 -1.128 . . . . 0.0 109.916 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.772 ' C ' HD13 ' A' ' 20' ' ' ILE . 8.1 t -98.68 153.01 19.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.2 -0.938 . . . . 0.0 110.571 -179.747 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.805 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -159.88 -174.51 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.491 -0.755 . . . . 0.0 109.9 -179.932 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.537 ' HB3' ' CB ' ' A' ' 4' ' ' THR . 15.1 t80 -133.21 129.46 37.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.198 -0.938 . . . . 0.0 110.1 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.662 HD23 ' CB ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -87.52 131.38 34.39 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.153 -0.967 . . . . 0.0 110.782 -179.714 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.9 p -90.7 -26.74 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.24 -0.913 . . . . 0.0 110.602 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -78.12 -14.52 59.45 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.111 -0.993 . . . . 0.0 108.927 179.264 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.537 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.3 mtt -148.19 67.32 1.09 Allowed 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.862 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.456 ' C ' ' O ' ' A' ' 25' ' ' MET . 64.1 p -29.87 87.83 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.59 0.71 . . . . 0.0 111.968 -178.446 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -158.18 165.43 34.93 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.583 -0.698 . . . . 0.0 109.843 179.497 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.43 113.48 14.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.485 -0.76 . . . . 0.0 110.441 -179.738 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.662 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.0 t80 -101.53 117.34 34.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.397 -0.815 . . . . 0.0 109.53 179.642 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.577 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.1 m -117.47 112.76 21.08 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.122 -0.986 . . . . 0.0 110.852 -179.181 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.494 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.4 tpp85 -86.97 110.17 19.86 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.309 -0.87 . . . . 0.0 109.629 179.267 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 84.9 m -79.53 -179.84 7.07 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.171 -0.956 . . . . 0.0 110.382 -179.602 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -82.72 115.85 21.83 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.28 -0.888 . . . . 0.0 110.291 -179.809 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.7 t -52.21 105.9 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.299 -0.876 . . . . 0.0 109.611 179.701 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 139.42 -4.7 2.84 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.782 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.605 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.27 163.92 24.54 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.019 -1.283 . . . . 0.0 109.567 179.756 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 37' ' ' THR . . . . . 1.066 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -97.71 27.22 4.51 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.832 -1.167 . . . . 0.0 110.077 -179.834 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.532 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.09 152.94 23.85 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 179.545 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.592 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.9 p -84.15 44.0 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.198 -1.178 . . . . 0.0 109.952 -179.969 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.587 ' NH1' ' CG ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -160.14 20.29 0.16 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.307 -0.871 . . . . 0.0 110.531 -179.537 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.8 p 33.54 93.66 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.576 -0.702 . . . . 0.0 111.792 179.926 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.587 ' CG ' ' NH1' ' A' ' 40' ' ' ARG . 1.7 tm-20 -151.13 -40.32 0.12 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.531 -0.73 . . . . 0.0 109.655 179.127 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 1.066 ' CD2' HG23 ' A' ' 37' ' ' THR . 14.9 p-80 -122.82 112.43 17.88 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.911 0.862 . . . . 0.0 108.714 178.622 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 20.4 t80 -78.54 108.7 12.11 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.674 0.75 . . . . 0.0 110.126 -178.441 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.556 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -66.15 -9.75 34.52 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.431 0.634 . . . . 0.0 109.982 -179.492 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.618 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.9 mt . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.203 -179.718 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.447 ' HB3' ' CG1' ' A' ' 23' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.3 0.572 . . . . 0.0 110.172 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.558 HD11 ' HB ' ' A' ' 20' ' ' ILE . 1.1 tt -138.8 154.69 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.277 -0.89 . . . . 0.0 110.146 -179.95 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.2 m -127.73 161.52 28.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 -179.991 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.03 178.79 7.71 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.272 -0.892 . . . . 0.0 110.31 -179.903 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.846 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 68.7 m -109.66 -147.53 0.42 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.253 -0.905 . . . . 0.0 110.075 179.936 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 t -133.99 -167.64 1.99 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.255 -0.903 . . . . 0.0 110.119 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.6 t -83.96 12.69 5.84 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.267 -0.896 . . . . 0.0 110.274 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -132.25 23.98 4.49 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.299 -0.876 . . . . 0.0 110.253 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -121.82 -5.27 9.11 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.246 -0.909 . . . . 0.0 110.213 -179.976 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.484 ' O ' ' ND2' ' A' ' 11' ' ' ASN . 0.6 OUTLIER -90.88 54.16 2.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.277 -0.89 . . . . 0.0 110.272 -179.998 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -119.43 0.44 14.16 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -106.92 -64.92 1.13 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.197 -1.178 . . . . 0.0 110.26 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.2 p -84.53 124.54 31.51 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.209 -0.932 . . . . 0.0 110.351 -179.926 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.598 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.5 mt -90.07 -44.36 9.87 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.269 -0.895 . . . . 0.0 110.273 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.598 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 3.6 m80 -114.62 92.04 3.82 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.29 -0.881 . . . . 0.0 110.159 -179.719 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.467 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.53 -169.43 42.4 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.997 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -110.49 143.91 40.11 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.28 -1.129 . . . . 0.0 110.165 179.853 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.846 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 1.0 OUTLIER -95.92 128.69 43.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.316 -0.865 . . . . 0.0 110.419 -179.903 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.8 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -146.46 -171.82 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.305 -0.872 . . . . 0.0 110.008 179.878 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.439 ' O ' HG13 ' A' ' 3' ' ' ILE . 17.5 t80 -142.83 135.13 27.46 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.334 -0.854 . . . . 0.0 109.811 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.629 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.4 mm? -87.62 129.61 35.06 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.046 -1.034 . . . . 0.0 110.839 -179.589 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.447 ' CG1' ' HB3' ' A' ' 2' ' ' SER . 8.9 p -90.71 -24.98 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.247 -0.908 . . . . 0.0 110.454 179.746 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -78.31 -12.13 59.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.994 -1.066 . . . . 0.0 108.802 179.206 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.0 OUTLIER -151.78 68.83 0.9 Allowed 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 178.915 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 56.0 p -29.19 89.78 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.791 0.805 . . . . 0.0 111.412 -178.545 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.531 ' HG3' ' N ' ' A' ' 28' ' ' ASN . 1.5 tt0 -159.88 148.13 17.16 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.621 -0.674 . . . . 0.0 109.562 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.531 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 15.9 p30 -61.46 126.46 27.43 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.253 -0.904 . . . . 0.0 110.42 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.629 ' CB ' HD23 ' A' ' 22' ' ' LEU . 9.8 t80 -118.85 133.82 55.58 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.35 -0.844 . . . . 0.0 109.705 179.696 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -135.95 113.92 11.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.096 -1.002 . . . . 0.0 110.594 -179.561 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.467 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.2 tpp180 -81.78 106.07 13.42 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.215 -0.928 . . . . 0.0 109.587 179.373 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 94.1 m -79.49 171.34 15.29 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.255 -0.903 . . . . 0.0 110.186 -179.763 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.423 ' CG ' ' H ' ' A' ' 35' ' ' GLY . 15.4 tt0 -78.91 129.45 34.53 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.222 -0.924 . . . . 0.0 109.662 179.873 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.407 HG23 ' H ' ' A' ' 34' ' ' VAL . 11.8 t -66.12 -14.72 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.332 -0.855 . . . . 0.0 110.287 -179.542 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.423 ' H ' ' CG ' ' A' ' 33' ' ' GLU . . . -69.17 -17.42 72.01 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.836 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.491 ' CE1' ' N ' ' A' ' 43' ' ' HIS . 1.5 m-85 -79.92 166.39 21.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.326 -1.102 . . . . 0.0 110.065 179.828 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.759 HG23 ' NE2' ' A' ' 43' ' ' HIS . 14.2 t -102.39 29.22 5.33 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.979 -1.076 . . . . 0.0 110.516 -179.788 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.467 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.42 160.28 31.63 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 179.778 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.545 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.8 p -84.7 43.73 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.121 -1.223 . . . . 0.0 109.897 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.567 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -148.99 12.18 0.85 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.381 -0.825 . . . . 0.0 110.279 -179.384 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 6.9 p 32.05 87.85 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.608 -0.683 . . . . 0.0 110.493 -179.67 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.567 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 2.1 tt0 -160.32 -33.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.214 -0.929 . . . . 0.0 111.023 -179.515 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.759 ' NE2' HG23 ' A' ' 37' ' ' THR . 23.8 p-80 -126.72 119.25 26.49 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.708 -1.245 . . . . 0.0 111.937 -179.677 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.546 ' CE2' ' C ' ' A' ' 46' ' ' LEU . 44.4 t80 -87.24 92.15 8.96 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.091 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.869 ' CE2' HD11 ' A' ' 46' ' ' LEU . 0.4 OUTLIER -66.85 -5.39 12.17 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.443 -0.786 . . . . 0.0 110.72 -179.012 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.869 HD11 ' CE2' ' A' ' 45' ' ' PHE . 2.2 mm? . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.072 -1.018 . . . . 0.0 110.192 -179.865 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.53 ' HA ' ' CB ' ' A' ' 23' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.192 0.52 . . . . 0.0 110.145 . . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.475 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 2.2 tt -79.56 148.6 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.266 -0.896 . . . . 0.0 110.341 179.975 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -160.98 -178.32 6.72 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.297 -0.877 . . . . 0.0 110.636 179.68 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -97.8 -178.71 4.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.465 -0.772 . . . . 0.0 110.27 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 49.0 m -98.13 -93.98 0.23 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.274 -0.891 . . . . 0.0 110.287 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.45 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 172.45 -167.2 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.097 -1.002 . . . . 0.0 110.122 -179.927 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.426 ' O ' ' N ' ' A' ' 10' ' ' MET . 6.6 t -80.1 169.63 17.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -0.904 . . . . 0.0 110.096 179.927 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 8' ' ' SER . 25.7 t70 43.13 26.25 0.08 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.146 -0.971 . . . . 0.0 110.214 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.426 ' N ' ' O ' ' A' ' 8' ' ' SER . 1.3 ttt -123.6 3.03 8.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.247 -0.908 . . . . 0.0 110.226 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.588 ' ND2' ' SG ' ' A' ' 14' ' ' CYS . 2.7 m120 -101.97 70.42 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.896 . . . . 0.0 110.035 179.883 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.61 -24.29 14.08 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.871 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -86.7 -64.32 1.17 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.171 -1.194 . . . . 0.0 110.112 -179.989 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -81.34 119.45 23.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.287 -0.883 . . . . 0.0 110.382 -179.677 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.578 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 5.5 mt -90.62 -46.15 8.46 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.196 -0.94 . . . . 0.0 110.676 -179.882 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.598 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 12.3 m80 -111.72 78.63 1.14 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.168 -0.957 . . . . 0.0 110.353 -178.932 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.428 ' HA3' ' HA ' ' A' ' 32' ' ' CYS . . . 178.72 -160.9 26.99 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.963 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -127.56 138.7 52.96 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.401 -1.058 . . . . 0.0 110.221 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.864 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -81.5 134.88 35.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.246 -0.909 . . . . 0.0 110.199 179.969 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.864 HD13 ' O ' ' A' ' 19' ' ' CYS . 24.3 mm -142.59 172.81 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.262 -0.899 . . . . 0.0 110.262 -179.908 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.477 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 8.8 t80 -137.03 138.25 40.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.242 -0.911 . . . . 0.0 109.58 179.866 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.594 HD23 ' HB2' ' A' ' 29' ' ' TYR . 3.3 mm? -100.51 136.42 40.42 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.973 -1.079 . . . . 0.0 111.28 -179.26 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.53 ' CB ' ' HA ' ' A' ' 2' ' ' SER . 10.7 p -90.72 -27.18 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.509 -0.744 . . . . 0.0 110.497 179.847 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.24 -17.21 56.99 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.122 -0.986 . . . . 0.0 108.886 179.426 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.532 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.9 mtm -143.38 64.86 1.33 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.726 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.465 ' C ' ' O ' ' A' ' 25' ' ' MET . 66.1 p -29.12 88.4 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.699 0.761 . . . . 0.0 111.733 -178.32 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.532 ' N ' ' O ' ' A' ' 25' ' ' MET . 4.4 pt20 -160.39 177.79 10.24 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.659 -0.651 . . . . 0.0 109.444 179.557 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -81.1 156.08 25.96 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.233 -0.917 . . . . 0.0 110.235 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.594 ' HB2' HD23 ' A' ' 22' ' ' LEU . 2.8 t80 -150.22 95.34 2.26 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.307 -0.871 . . . . 0.0 110.132 -179.959 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 4.0 m -102.36 106.9 17.75 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.195 -0.941 . . . . 0.0 110.105 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.3 tpp85 -79.52 97.93 6.64 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.177 -0.952 . . . . 0.0 109.504 179.602 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 77.9 m -79.73 175.91 10.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.445 -0.785 . . . . 0.0 110.525 -179.39 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 35' ' ' GLY . 10.6 tt0 -79.85 124.76 28.93 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.395 -0.815 . . . . 0.0 109.618 179.864 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.413 ' H ' HG23 ' A' ' 34' ' ' VAL . 14.1 t -65.16 -9.0 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.388 -0.82 . . . . 0.0 110.335 -179.423 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.719 ' O ' HD12 ' A' ' 46' ' ' LEU . . . -78.48 -3.22 86.13 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 179.863 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.598 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.9 OUTLIER -79.9 168.22 19.53 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.036 -1.273 . . . . 0.0 109.684 179.75 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 37' ' ' THR . . . . . 1.098 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -108.22 32.09 5.06 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.929 -1.107 . . . . 0.0 110.784 -179.595 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.514 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -147.93 171.38 28.45 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.269 -1.532 . . . . 0.0 109.269 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.407 ' O ' HG22 ' A' ' 39' ' ' VAL . 9.0 p -86.18 21.13 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.17 -1.194 . . . . 0.0 109.946 179.828 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.544 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 41.0 ttp180 -137.48 -95.62 0.21 Allowed 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.285 -0.885 . . . . 0.0 110.03 -179.674 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.9 p 163.62 73.04 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.78 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.544 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 2.0 tt0 -133.71 -28.93 1.37 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.418 -0.801 . . . . 0.0 110.673 -179.48 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 1.098 ' CD2' HG23 ' A' ' 37' ' ' THR . 15.1 p-80 -128.34 113.46 15.64 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.907 -1.121 . . . . 0.0 109.922 179.236 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.62 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 37.2 t80 -79.41 106.43 11.44 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.463 0.649 . . . . 0.0 110.041 -179.253 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.86 -29.46 70.41 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.286 -0.884 . . . . 0.0 109.936 -179.679 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.719 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.4 mt . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.244 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.404 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.298 0.57 . . . . 0.0 110.114 . . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.571 HD11 ' HB ' ' A' ' 20' ' ' ILE . 2.8 tt -144.74 156.1 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.211 -0.931 . . . . 0.0 110.308 -179.816 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.26 157.16 25.36 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.902 . . . . 0.0 110.244 179.919 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -96.19 165.46 12.21 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.231 -0.918 . . . . 0.0 110.219 -179.987 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.512 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 84.3 m -109.26 -152.86 0.5 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 110.342 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.94 -170.45 2.24 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.268 -0.895 . . . . 0.0 110.294 -179.916 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 m -85.24 11.55 9.8 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.904 . . . . 0.0 110.097 179.864 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.36 16.23 11.37 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.9 . . . . 0.0 110.114 -179.903 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.67 20.86 9.36 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.254 -0.904 . . . . 0.0 110.286 -179.87 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -104.09 72.47 1.09 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.171 -0.956 . . . . 0.0 110.236 -179.988 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -120.51 2.04 12.45 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.466 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 24.7 t80 -119.65 -57.4 1.98 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.184 -1.186 . . . . 0.0 110.246 179.964 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.4 p -90.33 121.65 32.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.237 -0.914 . . . . 0.0 110.366 -179.951 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.621 ' N ' HD23 ' A' ' 15' ' ' LEU . 3.9 mt -90.72 -56.98 2.98 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.152 -0.968 . . . . 0.0 110.714 -179.853 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.593 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 13.2 m80 -100.21 83.74 2.72 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.259 -0.901 . . . . 0.0 110.395 -178.885 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.516 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 176.53 -160.4 27.9 Favored Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.846 -1.301 . . . . 0.0 109.846 -179.8 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.404 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 2.2 mm100 -124.7 147.43 48.6 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.356 -1.085 . . . . 0.0 110.192 -179.968 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.512 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.7 t -93.73 130.12 39.81 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.382 -0.824 . . . . 0.0 110.318 -179.961 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.824 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -142.66 -176.95 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.42 -0.8 . . . . 0.0 109.978 179.867 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.471 ' O ' HG13 ' A' ' 3' ' ' ILE . 9.7 t80 -143.47 124.81 14.66 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.152 -0.968 . . . . 0.0 109.957 -179.92 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.529 HD22 ' HD2' ' A' ' 29' ' ' TYR . 1.9 mp -79.49 128.36 33.26 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.003 -1.061 . . . . 0.0 111.317 -179.269 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.404 HG11 ' HB3' ' A' ' 2' ' ' SER . 5.5 p -90.38 -26.16 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.688 -0.633 . . . . 0.0 110.417 179.788 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -78.17 -11.89 59.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.099 -1.001 . . . . 0.0 108.659 178.951 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 10.0 ttm -150.55 68.24 0.96 Allowed 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.929 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 13.7 p -29.19 89.86 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 121.745 0.783 . . . . 0.0 111.344 -178.471 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.1 147.65 18.14 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.738 -0.602 . . . . 0.0 109.725 -179.965 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.528 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.0 m-20 -64.87 124.49 22.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.442 -0.786 . . . . 0.0 110.133 -179.953 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.529 ' HD2' HD22 ' A' ' 22' ' ' LEU . 4.8 t80 -116.54 132.43 56.68 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.413 -0.805 . . . . 0.0 109.931 -179.866 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -129.64 112.63 13.87 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.092 -1.005 . . . . 0.0 110.374 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.516 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.7 OUTLIER -86.0 115.04 23.36 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.255 -0.903 . . . . 0.0 109.451 179.389 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.639 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 91.9 m -78.89 179.41 7.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.15 -0.969 . . . . 0.0 110.61 -179.408 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.463 ' OE2' ' CE1' ' A' ' 44' ' ' PHE . 22.3 tt0 -83.89 116.51 22.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.392 -0.818 . . . . 0.0 110.404 -179.543 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.1 t -52.43 101.67 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.192 -0.943 . . . . 0.0 109.555 179.523 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.905 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 147.9 -10.61 1.22 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.61 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.593 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.4 m-85 -78.78 160.21 27.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.897 -1.354 . . . . 0.0 109.465 179.769 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 37' ' ' THR . . . . . 1.109 HG23 ' CE1' ' A' ' 43' ' ' HIS . 1.0 OUTLIER -105.72 -4.62 20.74 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.841 -1.162 . . . . 0.0 111.125 -179.084 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.527 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -98.34 140.89 15.28 Favored Glycine 0 N--CA 1.488 2.11 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.778 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.425 ' C ' ' O ' ' A' ' 38' ' ' GLY . 8.5 p -44.85 -25.73 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.133 -1.216 . . . . 0.0 108.807 179.072 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.546 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 7.4 ttp180 -102.15 -130.67 0.25 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.218 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.639 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -151.72 75.64 1.16 Allowed 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 179.011 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.546 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 0.9 OUTLIER -123.82 -29.9 3.62 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.394 -0.816 . . . . 0.0 110.336 -179.264 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 1.109 ' CE1' HG23 ' A' ' 37' ' ' THR . 3.0 p80 -130.45 117.09 19.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.961 -1.087 . . . . 0.0 110.05 179.443 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 44.6 t80 -79.28 104.38 9.86 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 121.494 0.664 . . . . 0.0 110.002 -179.351 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.585 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.67 -32.87 74.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.466 -0.771 . . . . 0.0 110.172 -179.515 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.905 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.9 mt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.248 179.963 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.47 ' N ' HG11 ' A' ' 23' ' ' VAL . 16.5 t . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 121.32 0.581 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.797 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.81 149.58 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.328 -0.858 . . . . 0.0 110.124 179.964 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -119.0 161.3 20.45 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 110.241 -179.949 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -110.38 165.9 11.41 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.333 -0.854 . . . . 0.0 110.206 179.957 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 72.5 m -112.96 -155.59 0.57 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.229 -0.919 . . . . 0.0 110.206 -179.991 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 m -135.61 -164.13 1.49 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.256 -0.903 . . . . 0.0 110.318 179.961 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.53 10.3 13.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 0.0 110.216 -179.983 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -123.13 19.23 9.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 0.0 110.181 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.79 23.06 2.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.893 . . . . 0.0 110.175 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -106.25 68.3 0.76 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.221 -0.924 . . . . 0.0 110.206 -179.978 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -109.22 43.65 1.67 Allowed Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 179.948 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -156.93 -58.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.297 -1.119 . . . . 0.0 110.204 -179.914 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.6 p -91.15 118.87 30.79 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.265 -0.897 . . . . 0.0 110.295 -179.912 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.59 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.8 mt -90.43 -43.13 10.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.117 -0.99 . . . . 0.0 110.325 179.8 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.9 m80 -111.65 78.02 1.09 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.251 -0.905 . . . . 0.0 110.163 -179.486 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 176.07 -171.02 44.06 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -114.44 146.41 40.67 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.2 -1.176 . . . . 0.0 110.326 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.4 t -84.47 147.47 27.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.322 -0.861 . . . . 0.0 110.037 179.805 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.809 HD12 ' CD1' ' A' ' 29' ' ' TYR . 0.7 OUTLIER -155.35 -177.59 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.147 -0.971 . . . . 0.0 110.107 -179.805 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.502 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 14.8 t80 -142.36 132.66 24.88 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.282 -0.886 . . . . 0.0 109.98 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.633 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.5 mm? -94.47 134.5 36.94 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.126 -0.984 . . . . 0.0 111.016 -179.339 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.47 HG11 ' N ' ' A' ' 2' ' ' SER . 10.7 p -90.92 -24.94 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.297 -0.877 . . . . 0.0 110.524 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.547 ' OD2' HD12 ' A' ' 22' ' ' LEU . 3.3 p30 -78.56 -15.68 58.29 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.044 -1.035 . . . . 0.0 108.956 179.314 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.544 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.5 ttp -146.01 66.48 1.2 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 178.899 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.91 88.56 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 122.001 0.905 . . . . 0.0 111.877 -178.223 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 tt0 -160.86 173.79 14.82 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 121.318 0.58 . . . . 0.0 109.935 179.401 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -77.19 140.99 40.3 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.462 -0.774 . . . . 0.0 110.23 -179.962 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.809 ' CD1' HD12 ' A' ' 20' ' ' ILE . 9.8 t80 -135.64 113.94 11.51 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.356 -0.84 . . . . 0.0 110.031 179.894 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 15.4 m -117.85 116.97 28.03 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.045 -1.034 . . . . 0.0 110.41 -179.809 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.432 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.2 tpp85 -79.49 118.34 21.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.155 -0.966 . . . . 0.0 109.447 179.431 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.513 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 95.7 m -79.52 170.76 16.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.392 -0.818 . . . . 0.0 110.573 -179.329 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -79.48 117.14 20.16 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.358 -0.839 . . . . 0.0 109.968 179.974 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.415 HG23 ' H ' ' A' ' 34' ' ' VAL . 36.4 t -50.13 103.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.296 -0.877 . . . . 0.0 109.686 179.966 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.74 -12.75 1.32 Allowed Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.67 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.32 172.14 14.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.203 -1.175 . . . . 0.0 109.648 179.85 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.935 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.72 29.78 6.91 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.906 -1.121 . . . . 0.0 110.524 179.974 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.55 160.08 31.5 Favored Glycine 0 N--CA 1.489 2.186 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.547 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.617 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.7 p -88.88 27.09 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.177 -1.19 . . . . 0.0 109.536 179.321 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.559 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -132.95 14.31 4.29 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.48 -0.762 . . . . 0.0 109.738 -179.667 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.513 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 4.9 p 32.62 87.63 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 121.467 0.651 . . . . 0.0 110.601 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.559 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 1.1 tp10 -156.09 -34.81 0.09 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.405 -0.809 . . . . 0.0 110.644 -179.61 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.935 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.4 p80 -120.46 119.21 32.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.882 -1.136 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.632 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 17.3 t80 -84.21 111.74 19.64 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-O 121.247 0.546 . . . . 0.0 109.859 -179.728 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.574 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -68.43 -23.71 64.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.285 -0.884 . . . . 0.0 109.655 -179.78 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.632 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.8 mt . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.269 -179.819 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.759 ' HB2' HG11 ' A' ' 23' ' ' VAL . 2.6 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.353 0.597 . . . . 0.0 110.403 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 1.084 HD11 HD12 ' A' ' 20' ' ' ILE . 1.7 tt -129.51 157.37 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.294 -0.879 . . . . 0.0 109.991 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -121.57 168.06 12.17 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.212 -0.93 . . . . 0.0 110.262 -179.913 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.29 159.51 14.9 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.206 -0.934 . . . . 0.0 110.234 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 65.1 m -104.59 -147.99 0.4 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.242 -0.911 . . . . 0.0 110.147 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -127.48 -171.4 2.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.247 -0.908 . . . . 0.0 110.212 -179.934 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.8 t -79.81 -55.42 5.0 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.253 -0.904 . . . . 0.0 110.167 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -63.07 -11.3 18.67 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.242 -0.911 . . . . 0.0 110.149 179.906 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.7 ttm -88.14 27.37 1.22 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.253 -0.905 . . . . 0.0 110.225 -179.986 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -121.85 69.89 0.94 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.219 -0.926 . . . . 0.0 110.232 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -119.7 3.29 13.44 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -108.77 -50.53 3.0 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.159 -1.201 . . . . 0.0 110.182 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 22.3 p -104.07 120.09 40.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.216 -0.928 . . . . 0.0 110.271 179.932 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.589 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 10.1 mt -90.17 -43.22 10.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.298 -0.876 . . . . 0.0 110.519 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.6 m80 -110.53 86.88 2.4 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.134 -0.979 . . . . 0.0 110.258 -179.503 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.464 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.68 -131.39 2.11 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.968 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 7.3 pt20 -160.35 149.71 17.47 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.233 -1.157 . . . . 0.0 110.236 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.607 ' O ' HG23 ' A' ' 20' ' ' ILE . 1.2 t -94.54 147.54 23.17 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.195 -0.941 . . . . 0.0 110.194 179.948 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.102 HD11 ' CD1' ' A' ' 29' ' ' TYR . 19.0 pt -157.7 167.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.302 -0.874 . . . . 0.0 110.063 179.96 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.508 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 12.4 t80 -120.36 118.84 31.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.205 -0.934 . . . . 0.0 110.065 -179.983 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.786 HD11 ' CD2' ' A' ' 29' ' ' TYR . 11.3 mt -83.45 135.89 34.51 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.242 -0.912 . . . . 0.0 110.766 -179.751 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.759 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.2 p -88.32 -29.0 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.398 -0.814 . . . . 0.0 110.078 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -78.41 -22.8 47.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.208 -0.933 . . . . 0.0 108.716 179.191 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.1 mmt -134.23 61.14 1.68 Allowed 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 178.526 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.466 ' C ' ' O ' ' A' ' 25' ' ' MET . 3.2 p -28.74 86.2 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 121.576 0.703 . . . . 0.0 111.883 -178.46 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 pt20 -161.21 167.56 25.83 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.576 -0.702 . . . . 0.0 109.556 179.526 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.604 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 2.2 p-10 -82.51 90.58 6.77 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.327 -0.858 . . . . 0.0 109.787 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 1.102 ' CD1' HD11 ' A' ' 20' ' ' ILE . 5.4 t80 -79.7 131.92 36.07 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.405 -0.809 . . . . 0.0 110.283 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -120.58 113.21 19.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.169 -0.957 . . . . 0.0 110.368 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.536 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . 3.0 tpm_? -81.73 116.95 21.67 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.193 -0.942 . . . . 0.0 109.461 179.452 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.506 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 66.9 m -79.06 173.63 12.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.279 -0.888 . . . . 0.0 110.136 -179.793 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -79.42 111.65 15.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.284 -0.885 . . . . 0.0 109.909 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.3 t -49.15 103.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.446 -0.784 . . . . 0.0 109.727 -179.959 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 141.71 -7.28 2.46 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -179.741 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.558 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.25 179.97 7.09 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.175 -1.191 . . . . 0.0 109.796 179.853 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -116.5 23.91 11.71 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.915 -1.116 . . . . 0.0 110.731 -179.629 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -149.65 157.78 27.38 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.545 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.528 ' O ' HG13 ' A' ' 39' ' ' VAL . 8.6 p -85.78 40.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.248 -1.149 . . . . 0.0 109.797 179.557 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.56 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.03 21.07 0.16 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.452 -0.78 . . . . 0.0 109.973 -179.522 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.506 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 8.8 p 32.32 84.85 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.665 -0.647 . . . . 0.0 110.745 -179.702 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.56 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 23.8 tt0 -146.01 -41.53 0.21 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.405 -0.809 . . . . 0.0 109.967 -179.878 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.8 p-80 -119.43 128.69 54.26 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.11 -0.994 . . . . 0.0 110.372 179.598 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.617 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 34.4 t80 -86.68 130.32 34.53 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 121.383 0.611 . . . . 0.0 110.434 -178.504 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.557 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -91.64 -37.29 13.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 109.849 -179.878 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.617 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.3 mt . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.201 -179.663 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.415 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.273 0.559 . . . . 0.0 110.336 . . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.68 HD11 ' HB ' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -128.19 150.25 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.259 -0.901 . . . . 0.0 110.086 179.841 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -118.77 -163.61 0.97 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.206 -0.934 . . . . 0.0 110.173 179.93 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -130.74 154.4 48.0 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.13 -0.981 . . . . 0.0 110.352 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.566 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 94.6 m -83.81 -165.35 1.1 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.408 -0.807 . . . . 0.0 110.239 179.926 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.48 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.4 OUTLIER -125.69 -158.41 0.84 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.301 -0.874 . . . . 0.0 110.114 179.812 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.48 ' N ' ' OG ' ' A' ' 7' ' ' SER . 2.8 m -79.93 168.97 18.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.154 -0.967 . . . . 0.0 110.126 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 50.48 20.94 0.76 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.206 -0.934 . . . . 0.0 110.235 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tpp -122.85 -15.52 7.38 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.201 -0.937 . . . . 0.0 110.181 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -89.16 52.48 2.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.315 -0.866 . . . . 0.0 110.354 -179.941 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -109.63 1.94 30.63 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.447 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 45.9 t80 -93.4 -57.3 2.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.203 -1.175 . . . . 0.0 110.128 179.999 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.3 p -97.54 119.74 36.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.271 -0.893 . . . . 0.0 110.111 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.3 mt -90.24 -45.18 9.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.221 -0.924 . . . . 0.0 110.303 -179.999 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.569 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.5 m80 -108.59 85.71 2.16 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.297 -0.877 . . . . 0.0 110.224 -179.591 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.489 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 169.82 -174.75 44.05 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.03 145.76 30.97 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.268 -1.136 . . . . 0.0 110.311 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.566 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 5.6 t -96.08 130.07 43.19 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.365 -0.834 . . . . 0.0 110.385 -179.932 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.804 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.7 177.53 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.372 -0.83 . . . . 0.0 110.102 179.994 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.501 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 13.8 t80 -128.0 135.14 49.49 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.289 -0.882 . . . . 0.0 109.703 179.707 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.675 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.2 mm? -92.86 132.86 36.64 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.979 -1.076 . . . . 0.0 111.149 -179.309 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.415 HG11 ' CB ' ' A' ' 2' ' ' SER . 9.1 p -90.87 -31.7 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.461 -0.775 . . . . 0.0 110.586 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -78.06 -19.67 53.82 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.124 -0.985 . . . . 0.0 108.78 179.403 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 27' ' ' GLN . 35.8 mtt -137.19 61.56 1.62 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.608 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 89.5 p -29.21 87.79 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 121.614 0.721 . . . . 0.0 111.584 -178.499 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.557 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.4 pt20 -160.73 171.46 18.81 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.66 -0.65 . . . . 0.0 109.648 179.689 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -79.72 115.86 19.56 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.447 -0.783 . . . . 0.0 110.292 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.675 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.7 t80 -105.67 141.47 37.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.349 -0.844 . . . . 0.0 109.717 179.804 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 14.3 m -141.58 112.05 7.02 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.017 -1.052 . . . . 0.0 110.694 -179.562 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.489 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.5 OUTLIER -81.04 112.84 18.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.207 -0.933 . . . . 0.0 109.427 179.291 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.529 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 95.8 m -79.36 172.4 13.85 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.307 -0.871 . . . . 0.0 110.519 -179.507 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -79.39 114.03 18.0 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.441 -0.787 . . . . 0.0 109.965 -179.849 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.422 HG23 ' H ' ' A' ' 34' ' ' VAL . 41.1 t -46.08 102.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.27 -0.894 . . . . 0.0 109.709 179.961 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.36 -13.1 1.4 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -179.666 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.568 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -79.28 176.03 10.05 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.162 -1.199 . . . . 0.0 109.852 179.892 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.604 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -117.29 26.33 9.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.906 -1.121 . . . . 0.0 110.784 -179.78 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -147.66 160.5 28.32 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.819 -1.313 . . . . 0.0 109.819 179.607 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.717 HG12 ' O ' ' A' ' 39' ' ' VAL . 69.9 t -86.8 19.14 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.325 -1.103 . . . . 0.0 109.818 179.59 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.549 ' NH2' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -140.23 21.72 2.41 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.522 -0.736 . . . . 0.0 109.672 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.529 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 5.9 p 32.31 93.04 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 CA-C-O 121.493 0.663 . . . . 0.0 111.118 179.711 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.549 ' HB3' ' NH2' ' A' ' 40' ' ' ARG . 30.1 tt0 -156.61 -38.04 0.08 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.358 -0.839 . . . . 0.0 110.232 179.714 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.604 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.2 p-80 -117.36 129.59 55.96 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.029 -1.044 . . . . 0.0 110.611 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.624 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.5 t80 -88.13 130.28 35.08 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.433 0.635 . . . . 0.0 110.376 -178.737 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -94.39 -33.45 13.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.454 -0.779 . . . . 0.0 110.277 -179.65 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.624 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.2 mt . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.291 -179.745 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.286 0.565 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.698 HG12 HG22 ' A' ' 20' ' ' ILE . 9.5 tt -83.37 166.48 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.315 -0.866 . . . . 0.0 110.185 -179.987 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 4.2 m -137.98 165.47 26.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.197 -0.939 . . . . 0.0 110.547 -179.631 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -91.83 154.39 18.93 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.241 -0.912 . . . . 0.0 110.223 179.892 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.72 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 60.7 m -91.71 -141.15 0.18 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.32 -0.863 . . . . 0.0 110.259 -179.984 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.519 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.5 OUTLIER -159.47 -155.2 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.286 -0.884 . . . . 0.0 109.962 -179.931 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.519 ' N ' ' OG ' ' A' ' 7' ' ' SER . 0.1 OUTLIER -79.67 166.47 21.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.063 -1.023 . . . . 0.0 109.871 179.936 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 50.84 20.86 0.83 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.083 -1.01 . . . . 0.0 110.19 -179.822 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.99 14.23 5.76 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.175 -0.953 . . . . 0.0 110.202 -179.866 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.4 ' OD1' ' N ' ' A' ' 11' ' ' ASN . 10.3 m-20 -118.35 -141.11 0.36 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.236 -0.915 . . . . 0.0 110.389 -179.878 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.14 49.57 3.03 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.286 -1.526 . . . . 0.0 109.286 -179.817 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.682 ' OH ' HG23 ' A' ' 39' ' ' VAL . 8.6 t80 -155.0 -70.27 0.12 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.314 -1.109 . . . . 0.0 109.938 -179.819 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.486 ' C ' HD23 ' A' ' 15' ' ' LEU . 25.3 p -87.87 125.99 34.78 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.072 -1.017 . . . . 0.0 110.33 179.74 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.62 ' N ' HD23 ' A' ' 15' ' ' LEU . 3.9 mt -90.19 -49.04 6.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.19 -0.943 . . . . 0.0 110.142 179.765 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.54 ' ND1' ' HB2' ' A' ' 15' ' ' LEU . 10.4 m80 -104.83 77.21 1.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.219 -0.926 . . . . 0.0 110.112 -179.838 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.504 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -176.98 -178.97 47.14 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.868 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -108.53 140.46 41.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.255 -1.144 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.72 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 8.4 t -79.76 147.66 31.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.197 -0.939 . . . . 0.0 109.828 179.854 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.698 HG22 HG12 ' A' ' 3' ' ' ILE . 0.3 OUTLIER -154.22 -170.0 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.152 -0.968 . . . . 0.0 110.001 -179.693 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.5 ' O ' HG13 ' A' ' 3' ' ' ILE . 8.6 t80 -147.88 128.39 14.07 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.077 -1.014 . . . . 0.0 109.857 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.651 HD23 ' CD2' ' A' ' 29' ' ' TYR . 0.8 OUTLIER -84.19 131.78 34.73 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.196 -0.94 . . . . 0.0 111.103 -179.31 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.6 p -90.54 -28.31 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.343 -0.848 . . . . 0.0 110.587 179.732 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.52 ' OD2' ' CD1' ' A' ' 22' ' ' LEU . 1.9 p30 -78.43 -15.25 58.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.019 -1.05 . . . . 0.0 108.789 179.229 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -144.45 65.55 1.28 Allowed 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 178.733 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.487 ' C ' ' O ' ' A' ' 25' ' ' MET . 40.3 p -29.15 89.38 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.702 0.763 . . . . 0.0 111.542 -178.355 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 pt20 -157.81 168.89 25.9 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.737 -0.602 . . . . 0.0 109.419 179.51 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -77.22 124.96 28.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.283 -0.886 . . . . 0.0 110.594 -179.615 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.651 ' CD2' HD23 ' A' ' 22' ' ' LEU . 35.5 t80 -110.83 158.39 18.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.402 -0.811 . . . . 0.0 109.77 179.73 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.407 ' SG ' ' O ' ' A' ' 29' ' ' TYR . 1.9 m -158.1 108.38 2.13 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.058 -1.026 . . . . 0.0 110.503 -179.95 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.504 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.8 tpp180 -81.29 115.04 20.48 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.88 . . . . 0.0 109.666 179.681 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 97.5 m -79.4 175.06 10.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.167 -0.958 . . . . 0.0 110.521 -179.56 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -79.46 117.94 20.88 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.367 -0.833 . . . . 0.0 110.383 -179.792 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -49.94 99.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.283 -0.886 . . . . 0.0 109.914 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 152.35 -16.84 0.77 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.847 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.472 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.0 OUTLIER -79.55 172.92 13.14 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.147 -1.207 . . . . 0.0 110.023 179.947 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.598 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -113.29 31.47 6.44 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.017 -1.052 . . . . 0.0 110.518 -179.636 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.32 162.9 33.62 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.448 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.682 HG23 ' OH ' ' A' ' 13' ' ' TYR . 2.4 m -84.34 14.73 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.345 -1.091 . . . . 0.0 109.733 179.546 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.584 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -128.26 18.18 6.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.386 -0.821 . . . . 0.0 109.852 -179.444 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.6 p 27.33 91.06 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 CA-C-O 121.402 0.62 . . . . 0.0 111.369 179.493 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.584 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 10.8 tm-20 -156.6 -37.79 0.08 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.398 -0.814 . . . . 0.0 110.284 179.752 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.598 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 3.1 p-80 -114.86 128.44 56.29 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.008 -1.058 . . . . 0.0 110.523 179.887 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.654 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 15.7 t80 -86.63 126.33 34.44 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.459 0.647 . . . . 0.0 109.842 -179.009 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.584 ' O ' ' CG ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -85.27 12.47 8.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.447 -0.783 . . . . 0.0 109.955 -179.329 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.654 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.5 mt . . . . . 0 C--N 1.302 -1.479 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.395 -179.748 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 2' ' ' SER . . . . . 1.032 ' HB2' HG11 ' A' ' 23' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.301 0.572 . . . . 0.0 109.959 . . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.588 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -153.68 164.94 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.238 -0.914 . . . . 0.0 110.267 -179.802 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 3.7 m -148.52 167.16 26.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 0.0 110.219 179.984 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.457 ' HD2' HD13 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -110.41 168.99 9.04 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 110.027 179.908 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 57.0 m -86.49 -166.3 1.51 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.177 -0.952 . . . . 0.0 110.169 -179.937 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.84 -64.85 0.69 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.313 -0.867 . . . . 0.0 110.314 -179.963 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.44 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 0.5 OUTLIER -153.69 -71.17 0.14 Allowed 'General case' 0 C--N 1.291 -1.946 0 O-C-N 121.78 -0.575 . . . . 0.0 110.377 -179.961 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -62.72 -11.18 15.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.205 -0.934 . . . . 0.0 110.218 -179.972 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.438 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -104.27 39.5 1.64 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.258 -0.901 . . . . 0.0 110.159 179.898 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.44 ' OD1' ' O ' ' A' ' 8' ' ' SER . 41.4 p-10 -137.74 21.44 2.88 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.284 -0.885 . . . . 0.0 110.337 -179.885 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -100.18 75.14 0.44 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.971 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -160.28 -58.43 0.06 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.264 -1.139 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -97.25 118.2 33.15 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.342 -0.849 . . . . 0.0 110.605 -179.718 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.756 ' HB2' ' CD2' ' A' ' 16' ' ' HIS . 15.7 mt -75.77 -40.69 54.84 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 109.887 179.706 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.756 ' CD2' ' HB2' ' A' ' 15' ' ' LEU . 10.2 m-70 -119.85 89.36 3.11 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.414 -0.804 . . . . 0.0 110.584 -179.096 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.469 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 171.08 -177.81 43.83 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 179.791 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -108.06 153.46 23.09 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.294 -1.121 . . . . 0.0 110.306 179.86 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.909 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -92.05 133.66 35.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.377 -0.827 . . . . 0.0 110.539 -179.809 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.909 HD13 ' O ' ' A' ' 19' ' ' CYS . 9.4 mm -142.71 178.67 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.35 -0.844 . . . . 0.0 109.883 179.968 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.556 ' H ' HG22 ' A' ' 20' ' ' ILE . 20.6 t80 -147.68 129.45 15.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.986 -1.071 . . . . 0.0 110.252 179.952 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.613 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 2.9 mm? -88.65 131.78 34.84 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.267 -0.896 . . . . 0.0 110.749 -179.662 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 1.032 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.4 p -90.57 -23.19 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.341 -0.849 . . . . 0.0 110.612 179.88 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -78.59 -12.43 60.02 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.003 -1.061 . . . . 0.0 108.806 179.28 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -151.01 68.9 0.95 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.957 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.489 ' C ' ' O ' ' A' ' 25' ' ' MET . 40.1 p -29.02 89.52 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.791 0.805 . . . . 0.0 111.308 -178.419 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.55 148.09 17.69 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.726 -0.609 . . . . 0.0 109.367 -179.883 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.53 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.2 m-80 -60.68 146.21 46.46 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.197 -0.94 . . . . 0.0 110.399 -179.635 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.613 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 3.5 t80 -142.73 102.85 4.12 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.441 -0.787 . . . . 0.0 109.991 179.984 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.9 m -108.62 119.03 38.33 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.108 -0.995 . . . . 0.0 110.278 -179.951 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.469 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -78.98 137.33 37.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.107 -0.996 . . . . 0.0 109.216 179.476 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.8 m -79.54 169.3 18.23 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.281 -0.887 . . . . 0.0 110.025 -179.528 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.529 ' O ' ' N ' ' A' ' 35' ' ' GLY . 9.6 tt0 -78.59 112.26 15.49 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.309 -0.869 . . . . 0.0 108.709 179.21 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.465 ' C ' ' O ' ' A' ' 33' ' ' GLU . 38.3 t -36.12 93.17 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 121.479 0.657 . . . . 0.0 110.475 -179.071 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.999 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 149.72 -15.77 1.07 Allowed Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.649 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.503 ' CE2' ' C ' ' A' ' 43' ' ' HIS . 2.4 m-85 -81.12 169.24 17.66 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.137 -1.213 . . . . 0.0 109.922 179.939 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.899 HG23 ' NE2' ' A' ' 43' ' ' HIS . 5.2 t -122.55 45.55 2.35 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.968 -1.082 . . . . 0.0 111.171 -179.77 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.53 156.08 27.32 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.963 -1.255 . . . . 0.0 109.963 179.568 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.7 HG12 ' O ' ' A' ' 39' ' ' VAL . 79.2 t -89.07 21.27 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.327 -1.102 . . . . 0.0 109.487 179.288 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.578 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 6.5 ttp180 -122.78 -19.23 6.28 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.568 -0.708 . . . . 0.0 109.978 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.7 m 69.51 70.26 0.25 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.172 -0.955 . . . . 0.0 110.234 179.281 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.578 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -141.03 -29.25 0.66 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.19 -0.944 . . . . 0.0 111.255 -179.838 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.899 ' NE2' HG23 ' A' ' 37' ' ' THR . 21.3 p-80 -125.63 120.46 30.84 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.623 -1.298 . . . . 0.0 111.214 179.963 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.612 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 51.6 t80 -82.57 103.14 11.88 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.295 0.569 . . . . 0.0 109.678 179.773 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.578 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.59 -30.34 71.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.239 -0.913 . . . . 0.0 110.237 -179.29 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.999 HD12 ' O ' ' A' ' 35' ' ' GLY . 3.2 mt . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.13 -0.981 . . . . 0.0 110.147 -179.986 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.533 ' HB3' HG11 ' A' ' 23' ' ' VAL . 6.3 t . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.328 0.585 . . . . 0.0 110.205 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.799 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -80.63 141.18 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.29 -0.881 . . . . 0.0 110.216 -179.933 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.424 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -101.33 158.53 15.98 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.306 -179.97 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -108.17 151.49 25.85 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.302 -0.874 . . . . 0.0 110.019 179.864 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.4 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 61.3 m -97.81 -159.86 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.269 -0.895 . . . . 0.0 110.365 -179.94 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.7 t -145.12 -146.47 0.19 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.204 -0.935 . . . . 0.0 110.198 179.996 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.435 ' O ' ' N ' ' A' ' 10' ' ' MET . 23.7 t -79.87 168.02 19.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.224 -0.922 . . . . 0.0 110.134 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' A' ' 8' ' ' SER . 20.0 t0 42.08 26.93 0.06 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.262 -0.899 . . . . 0.0 110.288 179.954 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.435 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -125.78 -0.86 7.33 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.261 -0.9 . . . . 0.0 110.321 -179.892 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.422 ' O ' ' CG ' ' A' ' 11' ' ' ASN . 24.4 p-10 -140.03 105.53 5.09 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.169 -0.957 . . . . 0.0 110.194 -179.976 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.45 20.79 6.9 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.902 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.455 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 71.0 t80 -110.62 -55.57 2.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.189 -1.183 . . . . 0.0 110.273 -179.899 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.2 p -93.52 123.27 36.72 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.274 -0.891 . . . . 0.0 110.268 -179.818 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.563 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -90.18 -43.65 10.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.111 -0.993 . . . . 0.0 110.416 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.563 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 9.2 m80 -107.87 85.89 2.2 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.265 -0.897 . . . . 0.0 110.233 -179.513 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.93 -165.1 36.1 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.983 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -121.28 134.79 55.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.38 -1.07 . . . . 0.0 110.31 -179.955 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.576 ' O ' HG23 ' A' ' 20' ' ' ILE . 10.7 t -84.47 141.76 30.55 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 110.125 179.903 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.887 HD11 ' CD1' ' A' ' 29' ' ' TYR . 9.5 pt -157.7 -167.38 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.183 -0.948 . . . . 0.0 110.059 -179.778 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.499 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 12.1 t80 -144.18 133.54 23.23 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.269 -0.895 . . . . 0.0 110.086 179.984 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.68 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.6 mm? -87.66 132.62 34.03 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.138 -0.976 . . . . 0.0 110.671 -179.642 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.533 HG11 ' HB3' ' A' ' 2' ' ' SER . 4.8 p -90.71 -22.31 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.256 -0.903 . . . . 0.0 110.674 179.797 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.555 ' OD2' HD12 ' A' ' 22' ' ' LEU . 12.5 p30 -78.46 -9.63 59.38 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.014 -1.054 . . . . 0.0 108.913 179.26 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -157.35 70.85 0.62 Allowed 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.146 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.499 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 12.5 p -29.32 89.43 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 121.768 0.794 . . . . 0.0 111.307 -178.587 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.18 149.61 17.7 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.704 -0.623 . . . . 0.0 109.478 -179.7 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.519 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 3.3 t-20 -61.09 135.13 57.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.215 -0.928 . . . . 0.0 110.227 -179.857 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.887 ' CD1' HD11 ' A' ' 20' ' ' ILE . 7.2 t80 -129.07 126.24 38.99 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.445 -0.785 . . . . 0.0 109.74 -179.936 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 8.2 m -123.47 112.78 17.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.98 . . . . 0.0 110.718 -179.554 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.481 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 8.9 tpp85 -79.51 111.35 15.7 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.272 -0.893 . . . . 0.0 109.686 179.568 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.467 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 68.5 m -79.32 167.74 20.49 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.222 -0.924 . . . . 0.0 110.027 -179.871 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -79.82 106.36 11.78 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.295 -0.878 . . . . 0.0 110.225 -179.727 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.435 ' H ' HG22 ' A' ' 34' ' ' VAL . 5.6 m -47.25 107.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 O-C-N 121.399 -0.813 . . . . 0.0 109.674 179.583 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.13 -10.77 2.04 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.305 -1.518 . . . . 0.0 109.305 -179.369 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.562 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -78.66 178.97 7.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.197 -1.178 . . . . 0.0 109.692 179.862 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.845 HG21 ' CE1' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -106.7 -43.92 4.58 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 118.538 -1.265 . . . . 0.0 110.584 -179.989 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.73 158.03 42.5 Favored Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.635 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.638 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.8 p -84.99 44.88 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.12 -1.224 . . . . 0.0 109.696 179.756 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.26 27.21 0.17 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.407 -0.808 . . . . 0.0 109.746 -179.438 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.49 ' C ' ' O ' ' A' ' 40' ' ' ARG . 15.2 p 31.33 93.47 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.63 -0.669 . . . . 0.0 111.026 179.778 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 9.9 tm-20 -159.24 -41.77 0.06 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.481 -0.762 . . . . 0.0 110.035 179.938 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.845 ' CE1' HG21 ' A' ' 37' ' ' THR . 0.1 OUTLIER -120.14 129.47 54.17 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.06 -1.025 . . . . 0.0 110.669 179.83 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.591 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 35.6 t80 -88.76 125.15 34.75 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.404 -178.758 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.56 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.2 OUTLIER -98.05 -11.83 22.53 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.362 -0.836 . . . . 0.0 110.45 -179.534 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.591 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 6.3 mt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.052 -1.03 . . . . 0.0 110.241 -179.711 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.52 ' HA ' ' HB ' ' A' ' 23' ' ' VAL . 3.1 m . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.238 0.542 . . . . 0.0 109.898 . . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.479 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 2.7 tt -79.6 148.67 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.233 -0.917 . . . . 0.0 109.803 179.595 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.672 HG23 ' N ' ' A' ' 5' ' ' LYS . 4.9 t -160.25 -150.12 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.144 -0.972 . . . . 0.0 110.759 -179.928 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.672 ' N ' HG23 ' A' ' 4' ' ' THR . 35.6 mtpt -117.28 174.96 5.83 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.417 -0.802 . . . . 0.0 110.28 -179.806 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.558 ' O ' ' CB ' ' A' ' 7' ' ' SER . 14.3 m -113.37 -11.16 13.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.276 -0.89 . . . . 0.0 110.257 -179.802 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.558 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 1.1 m 79.69 -175.26 0.07 Allowed 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.662 -0.649 . . . . 0.0 110.654 179.99 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.472 ' O ' ' ND2' ' A' ' 11' ' ' ASN . 0.2 OUTLIER -78.97 -39.2 34.99 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.299 -0.876 . . . . 0.0 111.363 -179.108 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -84.36 46.13 1.19 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.941 -1.099 . . . . 0.0 109.68 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.53 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -155.17 24.2 0.42 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.429 -0.794 . . . . 0.0 109.815 -179.226 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.472 ' ND2' ' O ' ' A' ' 8' ' ' SER . 15.5 p30 -118.78 -158.24 0.72 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.108 -0.995 . . . . 0.0 109.922 -179.905 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.38 44.6 0.43 Allowed Glycine 0 N--CA 1.488 2.155 0 N-CA-C 109.267 -1.533 . . . . 0.0 109.267 -179.903 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.417 ' HD2' ' HG ' ' A' ' 14' ' ' CYS . 25.5 t80 -159.7 -44.38 0.05 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.392 -1.064 . . . . 0.0 110.002 -179.676 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -106.37 131.45 53.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.569 -0.707 . . . . 0.0 109.934 -179.588 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.666 HD11 ' OE2' ' A' ' 42' ' ' GLU . 13.1 mt -90.78 -42.58 10.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.346 -0.846 . . . . 0.0 110.438 179.667 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.608 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.8 m80 -113.52 79.24 1.22 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.2 -0.938 . . . . 0.0 110.235 -179.567 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 178.53 -166.83 36.94 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.951 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -131.33 149.18 52.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.282 -1.129 . . . . 0.0 110.239 -179.995 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.563 ' C ' HG23 ' A' ' 20' ' ' ILE . 4.7 t -95.87 146.08 24.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.23 -0.919 . . . . 0.0 110.073 179.993 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.097 HD11 ' CD1' ' A' ' 29' ' ' TYR . 15.1 pt -156.11 -173.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.253 -0.904 . . . . 0.0 110.234 -179.795 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.479 ' HB3' HG22 ' A' ' 4' ' ' THR . 12.7 t80 -131.67 145.79 51.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.306 -0.871 . . . . 0.0 109.859 179.782 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.744 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.4 mm? -103.64 137.75 41.26 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.054 -1.029 . . . . 0.0 111.366 -179.33 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.52 ' HB ' ' HA ' ' A' ' 2' ' ' SER . 9.3 p -91.16 -27.66 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 110.855 179.865 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.429 ' O ' ' HG3' ' A' ' 25' ' ' MET . 10.7 m-20 -77.79 -17.68 57.23 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.071 -1.018 . . . . 0.0 108.831 179.666 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 27' ' ' GLN . 7.0 mtt -144.48 64.38 1.3 Allowed 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 178.698 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 25' ' ' MET . 58.9 p -29.31 86.24 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.711 0.767 . . . . 0.0 111.814 -178.461 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.6 pt20 -161.29 -175.8 5.04 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.605 -0.684 . . . . 0.0 109.467 179.677 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -81.86 145.35 30.42 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.263 -0.898 . . . . 0.0 109.97 179.645 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 1.097 ' CD1' HD11 ' A' ' 20' ' ' ILE . 12.3 t80 -141.02 108.67 5.62 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.357 -0.839 . . . . 0.0 109.82 -179.682 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 25.4 m -103.33 112.88 25.96 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.254 -0.904 . . . . 0.0 110.797 -179.499 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -90.33 95.46 10.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.157 -0.964 . . . . 0.0 109.736 179.492 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.507 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 92.8 m -79.71 178.91 7.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.224 -0.922 . . . . 0.0 110.057 -179.91 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.51 131.32 36.01 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.237 -0.914 . . . . 0.0 109.803 179.864 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.4 t -66.64 -18.33 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.333 -0.854 . . . . 0.0 110.353 -179.494 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.13 -7.13 49.76 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 179.93 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -90.43 168.32 11.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.219 -1.165 . . . . 0.0 110.233 -179.913 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.924 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -110.86 34.03 4.24 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.119 -0.988 . . . . 0.0 110.497 179.797 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.43 156.93 28.29 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.643 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.775 HG12 ' O ' ' A' ' 39' ' ' VAL . 77.0 t -85.07 44.96 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.288 -1.125 . . . . 0.0 109.568 179.54 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.58 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.83 20.92 0.17 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.347 -0.845 . . . . 0.0 109.97 -179.375 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.521 ' C ' ' O ' ' A' ' 40' ' ' ARG . 3.3 p 26.71 90.94 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 121.485 0.66 . . . . 0.0 111.574 179.631 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.666 ' OE2' HD11 ' A' ' 15' ' ' LEU . 1.6 tt0 -155.57 -34.62 0.09 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.835 . . . . 0.0 110.597 179.749 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.924 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.3 p80 -121.89 119.9 32.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.977 -1.077 . . . . 0.0 110.683 179.725 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.577 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 35.4 t80 -83.02 119.34 24.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.718 -0.614 . . . . 0.0 109.743 179.938 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.737 ' HB2' HG21 ' A' ' 37' ' ' THR . 0.4 OUTLIER -89.14 -21.19 23.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.393 -0.817 . . . . 0.0 110.343 -179.435 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.577 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.4 mt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.349 -179.636 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.546 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.352 0.596 . . . . 0.0 110.102 . . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.882 HD12 HD22 ' A' ' 22' ' ' LEU . 5.0 tt -81.69 156.41 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.304 -0.873 . . . . 0.0 110.344 179.939 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.623 HG23 ' N ' ' A' ' 5' ' ' LYS . 5.6 t -136.94 -150.67 0.37 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.311 -0.868 . . . . 0.0 110.063 179.87 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.623 ' N ' HG23 ' A' ' 4' ' ' THR . 11.1 ttpt -107.67 -178.64 3.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.476 -0.765 . . . . 0.0 110.266 179.986 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.727 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 79.5 m -111.95 -154.32 0.54 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.3 -0.875 . . . . 0.0 110.171 -179.947 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.506 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.4 OUTLIER -137.49 -156.57 0.7 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.243 -0.911 . . . . 0.0 110.095 -179.91 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.506 ' N ' ' OG ' ' A' ' 7' ' ' SER . 21.9 t -79.81 167.66 20.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.181 -0.949 . . . . 0.0 110.04 179.93 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 53.11 19.18 1.35 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.176 -0.953 . . . . 0.0 110.173 -179.86 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -119.67 4.51 11.07 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.345 -0.847 . . . . 0.0 110.199 -179.986 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.522 ' ND2' ' O ' ' A' ' 11' ' ' ASN . 1.0 OUTLIER -111.3 90.53 3.36 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.241 -0.912 . . . . 0.0 110.236 -179.959 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -144.76 40.56 1.14 Allowed Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.983 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.418 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 57.5 t80 -148.13 -57.43 0.23 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.201 -1.176 . . . . 0.0 110.271 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.569 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 28.4 p -97.13 118.86 34.51 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.174 -0.954 . . . . 0.0 110.128 -179.958 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.613 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 12.1 mt -89.27 -40.3 12.92 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.246 -0.909 . . . . 0.0 110.307 -179.974 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.613 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -114.35 81.98 1.64 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.046 -1.034 . . . . 0.0 110.193 -179.651 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.404 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -178.28 -173.77 43.97 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.968 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -101.43 144.41 30.26 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.286 -1.126 . . . . 0.0 110.413 -179.985 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.727 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 14.8 t -98.35 125.53 43.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.287 -0.883 . . . . 0.0 110.262 -179.959 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.805 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.0 -175.74 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.453 -0.779 . . . . 0.0 110.139 -179.954 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.472 ' O ' HG13 ' A' ' 3' ' ' ILE . 11.8 t80 -138.27 125.96 22.25 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.165 -0.959 . . . . 0.0 110.107 179.975 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.882 HD22 HD12 ' A' ' 3' ' ' ILE . 1.0 OUTLIER -80.3 129.8 34.75 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.174 -0.954 . . . . 0.0 110.838 -179.584 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.546 HG11 ' CB ' ' A' ' 2' ' ' SER . 5.0 p -90.59 -28.07 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.391 -0.818 . . . . 0.0 110.438 179.731 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -78.27 -13.52 59.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.069 -1.019 . . . . 0.0 108.719 179.097 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.531 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -147.45 66.31 1.13 Allowed 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.902 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.492 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.9 p -29.29 89.8 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.757 0.789 . . . . 0.0 111.436 -178.604 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -159.08 147.63 18.17 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.693 -0.629 . . . . 0.0 109.481 -179.998 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.519 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.3 m-20 -63.77 109.9 1.88 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.304 -0.872 . . . . 0.0 110.084 -179.987 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.616 ' CB ' HD23 ' A' ' 22' ' ' LEU . 6.2 t80 -98.01 141.25 31.2 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.238 -0.914 . . . . 0.0 109.684 179.871 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.569 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 19.5 m -141.95 113.25 7.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.089 -1.007 . . . . 0.0 110.586 -179.497 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.404 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 12.2 tpp180 -81.5 104.46 11.95 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.197 -0.94 . . . . 0.0 109.625 179.511 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.634 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 94.8 m -79.5 168.29 19.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.331 -0.856 . . . . 0.0 110.186 -179.65 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.41 ' CG ' ' H ' ' A' ' 35' ' ' GLY . 7.9 tt0 -78.8 127.44 32.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.188 -0.945 . . . . 0.0 109.504 179.783 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.4 t -66.93 -10.3 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.346 -0.846 . . . . 0.0 110.613 -179.19 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.41 ' H ' ' CG ' ' A' ' 33' ' ' GLU . . . -79.44 -5.94 89.09 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 179.835 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.58 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -83.14 178.65 8.01 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.195 -1.18 . . . . 0.0 110.194 -179.95 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.629 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -111.85 28.5 8.69 Favored 'General case' 0 N--CA 1.498 1.974 0 C-N-CA 119.046 -1.062 . . . . 0.0 110.16 179.663 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.22 157.75 29.1 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 179.527 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.564 ' O ' HG13 ' A' ' 39' ' ' VAL . 8.8 p -84.68 43.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -1.162 . . . . 0.0 109.723 179.522 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.571 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -157.03 18.71 0.3 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.463 -0.773 . . . . 0.0 110.135 -179.405 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.634 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 13.7 p 29.76 91.4 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.432 -0.793 . . . . 0.0 111.566 179.393 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.571 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.7 tt0 -158.62 -37.74 0.06 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -0.925 . . . . 0.0 110.42 179.507 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.629 ' CE1' HG23 ' A' ' 37' ' ' THR . 0.6 OUTLIER -119.0 125.13 48.67 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.049 -1.032 . . . . 0.0 110.523 179.83 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.603 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.6 t80 -88.2 126.56 35.21 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.467 0.651 . . . . 0.0 109.865 -179.173 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.578 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.2 OUTLIER -92.71 -28.39 16.67 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.471 -0.768 . . . . 0.0 110.164 -179.394 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.603 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.4 mt . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.45 -179.689 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.511 ' HB2' HG11 ' A' ' 23' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.248 0.546 . . . . 0.0 110.148 . . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.537 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 2.4 tt -107.95 177.69 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.302 -0.874 . . . . 0.0 110.234 -179.941 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -153.46 169.65 22.64 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.243 -0.911 . . . . 0.0 110.139 -179.936 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.71 167.51 9.85 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 110.196 -179.988 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.567 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 39.9 m -102.14 -149.45 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 110.217 179.994 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -139.8 -169.65 2.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.227 -0.921 . . . . 0.0 110.064 -179.979 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 78.4 p -82.46 9.82 8.43 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.938 . . . . 0.0 110.221 179.999 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -123.34 20.29 9.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.19 -0.944 . . . . 0.0 110.209 -179.953 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 9.8 ttt -146.05 22.31 1.39 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.227 -0.92 . . . . 0.0 110.301 -179.971 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -118.19 94.97 4.69 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.305 -0.872 . . . . 0.0 110.203 179.942 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -155.12 28.64 0.64 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.933 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -122.98 -61.74 1.41 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.21 -1.17 . . . . 0.0 110.261 179.94 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.515 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.6 p -90.8 119.26 30.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.204 -0.935 . . . . 0.0 110.351 -179.816 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.608 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.4 mt -80.89 -42.9 20.7 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.326 -0.859 . . . . 0.0 109.999 179.794 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.608 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.2 m80 -118.36 80.98 1.61 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.355 -0.841 . . . . 0.0 110.36 -179.421 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.402 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -170.31 165.94 39.19 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.943 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.476 ' HB2' ' HB3' ' A' ' 31' ' ' ARG . 3.3 mt-30 -80.89 148.92 29.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.212 -1.17 . . . . 0.0 110.149 179.946 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.567 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 15.3 t -103.38 119.64 39.27 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.34 -0.85 . . . . 0.0 110.255 179.911 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.804 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -142.35 -175.69 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.205 -0.934 . . . . 0.0 110.372 179.959 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.475 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 6.3 t80 -143.51 126.68 16.54 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.241 -0.912 . . . . 0.0 109.696 179.89 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.537 HD13 ' CB ' ' A' ' 29' ' ' TYR . 1.6 mp -79.46 132.11 36.26 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.191 -0.943 . . . . 0.0 111.011 -179.529 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.511 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.6 p -90.31 -29.37 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.487 -0.758 . . . . 0.0 110.241 179.942 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -78.31 -15.69 58.48 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.129 -0.982 . . . . 0.0 108.735 179.042 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.524 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -142.57 64.43 1.37 Allowed 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.037 -1.098 . . . . 0.0 108.037 178.642 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.475 ' C ' ' O ' ' A' ' 25' ' ' MET . 44.8 p -29.14 89.64 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.725 0.774 . . . . 0.0 111.476 -178.52 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.524 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.03 146.7 16.03 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.713 -0.617 . . . . 0.0 109.484 179.93 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.607 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 1.0 OUTLIER -63.6 110.1 1.89 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 110.189 -179.953 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.537 ' CB ' HD13 ' A' ' 22' ' ' LEU . 5.4 t80 -99.39 134.6 42.03 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.367 -0.833 . . . . 0.0 109.729 179.889 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.2 m -130.22 114.48 15.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.082 -1.011 . . . . 0.0 110.566 -179.682 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.476 ' HB3' ' HB2' ' A' ' 18' ' ' GLN . 3.6 tpp180 -79.81 130.98 35.78 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.162 -0.961 . . . . 0.0 109.531 179.525 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 12.2 m -79.78 159.53 26.52 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.222 -0.924 . . . . 0.0 110.121 -179.689 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 35' ' ' GLY . 9.9 tt0 -79.17 107.28 11.82 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.24 -0.912 . . . . 0.0 109.481 179.694 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.442 HG23 ' H ' ' A' ' 34' ' ' VAL . 37.3 t -42.87 97.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.638 -0.664 . . . . 0.0 110.02 -179.558 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 152.78 -16.07 0.72 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.958 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.572 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.5 m-85 -79.67 169.23 18.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.077 -1.249 . . . . 0.0 110.11 179.964 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 37' ' ' THR . . . . . 1.057 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -113.44 31.86 6.19 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.997 -1.064 . . . . 0.0 110.711 -179.764 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.665 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -152.46 157.22 27.15 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.671 -1.371 . . . . 0.0 109.671 179.676 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.445 ' O ' HG22 ' A' ' 39' ' ' VAL . 9.4 p -87.86 20.63 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.271 -1.135 . . . . 0.0 109.965 179.814 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.589 ' CZ ' ' CB ' ' A' ' 42' ' ' GLU . 4.3 tmm_? -124.05 -20.36 5.36 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.191 179.851 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.2 m 72.79 82.53 0.13 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.326 -0.859 . . . . 0.0 109.945 179.75 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.589 ' CB ' ' CZ ' ' A' ' 40' ' ' ARG . 0.9 OUTLIER -155.54 -30.7 0.1 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.453 -0.78 . . . . 0.0 111.047 -179.871 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 1.057 ' CD2' HG23 ' A' ' 37' ' ' THR . 22.4 p-80 -122.15 121.51 37.06 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.69 -1.256 . . . . 0.0 110.881 179.783 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.607 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.6 t80 -83.66 108.65 16.88 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.243 0.544 . . . . 0.0 109.891 -179.884 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.573 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -69.74 -16.84 63.39 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.318 -0.864 . . . . 0.0 109.958 -179.707 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.607 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.307 -179.835 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.572 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.233 0.539 . . . . 0.0 110.216 . . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.563 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -124.93 160.72 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.254 -0.904 . . . . 0.0 110.169 179.823 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.477 ' O ' HG22 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -135.97 -178.39 5.12 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.264 -0.897 . . . . 0.0 110.079 -179.559 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.415 ' H ' HG22 ' A' ' 4' ' ' THR . 22.3 mttt -84.5 -177.72 6.7 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.237 -0.914 . . . . 0.0 110.028 179.9 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.424 ' O ' ' CB ' ' A' ' 7' ' ' SER . 63.1 m -108.85 -104.14 0.36 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.182 -0.949 . . . . 0.0 110.396 -179.923 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.482 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.1 OUTLIER 174.07 -164.35 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.954 -1.091 . . . . 0.0 110.195 -179.886 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.482 ' N ' ' OG ' ' A' ' 7' ' ' SER . 0.7 OUTLIER -82.75 169.68 15.9 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.178 -0.951 . . . . 0.0 110.121 179.895 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.404 ' C ' ' O ' ' A' ' 8' ' ' SER . 12.1 m-20 43.17 26.41 0.09 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.247 -0.908 . . . . 0.0 110.2 -179.917 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.415 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.8 OUTLIER -124.68 4.33 8.2 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.24 -0.913 . . . . 0.0 110.334 -179.88 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -106.69 82.58 1.73 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.215 -0.928 . . . . 0.0 110.218 179.943 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -137.34 25.55 3.0 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.973 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -125.17 -52.74 1.63 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.227 -1.16 . . . . 0.0 110.241 -179.967 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.52 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 20.1 p -106.82 120.47 42.11 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.337 -0.852 . . . . 0.0 110.43 -179.974 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.592 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.7 mt -89.83 -43.39 10.67 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.256 -0.902 . . . . 0.0 110.432 -179.973 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.592 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.0 m80 -110.26 88.5 2.78 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.278 -0.889 . . . . 0.0 110.077 -179.482 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.429 ' C ' ' OE1' ' A' ' 18' ' ' GLN . . . 174.91 -126.61 1.2 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 -179.873 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.579 ' NE2' ' CG ' ' A' ' 31' ' ' ARG . 14.6 pm0 -160.5 134.72 7.26 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.433 -1.04 . . . . 0.0 110.248 179.642 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.486 ' C ' ' CG1' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -81.45 148.9 29.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.262 -0.899 . . . . 0.0 110.374 -179.692 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.002 HD12 ' CD1' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -159.57 -172.22 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.235 -0.915 . . . . 0.0 109.643 179.913 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.45 ' O ' HG13 ' A' ' 3' ' ' ILE . 4.5 t80 -151.81 128.92 11.12 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.076 -1.015 . . . . 0.0 110.271 -179.636 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.57 HD11 ' HD2' ' A' ' 29' ' ' TYR . 36.4 mt -79.34 130.39 35.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.146 -0.971 . . . . 0.0 110.866 -179.696 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.572 HG12 ' O ' ' A' ' 2' ' ' SER . 4.6 p -90.3 -34.05 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.157 -0.964 . . . . 0.0 109.968 179.361 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 25' ' ' MET . 3.0 p30 -78.23 -20.88 50.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.152 -0.967 . . . . 0.0 108.586 179.101 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.506 ' O ' ' C ' ' A' ' 26' ' ' SER . 3.9 ttm -136.78 61.5 1.63 Allowed 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.559 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.506 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -29.52 92.66 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 122.106 0.955 . . . . 0.0 111.206 -178.608 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -158.73 141.25 14.24 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.933 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -55.81 113.88 1.67 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.104 -0.997 . . . . 0.0 110.504 -179.511 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 1.002 ' CD1' HD12 ' A' ' 20' ' ' ILE . 4.4 t80 -105.93 120.98 43.13 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.349 -0.844 . . . . 0.0 109.789 179.73 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.52 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -127.17 111.41 13.95 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.113 -0.992 . . . . 0.0 110.18 179.804 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.579 ' CG ' ' NE2' ' A' ' 18' ' ' GLN . 13.2 tpp180 -84.64 103.88 14.14 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.129 -0.982 . . . . 0.0 110.036 179.777 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.545 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 73.6 m -80.57 173.98 12.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.323 -0.861 . . . . 0.0 110.28 -179.842 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -79.89 133.46 36.23 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.277 -0.889 . . . . 0.0 109.896 179.892 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.8 t -71.35 -26.38 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.282 -0.887 . . . . 0.0 110.469 -179.531 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.45 -12.12 31.19 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.805 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.573 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.0 OUTLIER -79.57 178.4 8.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.182 -1.187 . . . . 0.0 110.279 -179.974 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 37' ' ' THR . . . . . 1.022 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -110.39 25.28 11.95 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.128 -0.982 . . . . 0.0 110.267 179.61 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.768 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -158.28 157.52 28.39 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.652 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.785 HG12 ' O ' ' A' ' 39' ' ' VAL . 70.7 t -84.67 44.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.219 -1.165 . . . . 0.0 109.823 179.715 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.591 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.4 OUTLIER -157.32 20.04 0.29 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.441 -0.787 . . . . 0.0 109.972 -179.523 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.545 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.1 p 28.24 89.75 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.429 0.633 . . . . 0.0 111.399 179.724 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.591 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.8 tm-20 -153.63 -37.03 0.1 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.432 -0.793 . . . . 0.0 110.143 179.865 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 1.022 ' CD2' HG23 ' A' ' 37' ' ' THR . 29.0 p-80 -119.59 121.52 39.51 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.0 110.221 179.209 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.606 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 24.7 t80 -84.95 120.16 26.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.696 -0.627 . . . . 0.0 110.064 -179.505 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.542 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -87.14 -12.16 47.86 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.479 -0.763 . . . . 0.0 109.916 -179.572 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.606 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.8 mt . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 117.926 -1.035 . . . . 0.0 110.274 -179.882 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.514 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.27 0.557 . . . . 0.0 110.105 . . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.836 HD11 ' HB ' ' A' ' 20' ' ' ILE . 3.0 tt -142.74 161.71 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.313 -0.867 . . . . 0.0 110.179 179.96 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.483 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.3 m -143.57 162.25 36.37 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.223 -0.923 . . . . 0.0 110.221 179.755 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 mtmp? -86.56 167.73 14.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.222 -0.924 . . . . 0.0 110.178 -179.882 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 75.5 m -90.59 -178.39 5.29 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.305 -0.872 . . . . 0.0 110.233 179.983 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.7 t -108.25 -153.17 0.5 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.923 . . . . 0.0 110.265 -179.895 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.5 172.04 11.29 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.341 -0.849 . . . . 0.0 110.304 -179.991 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t0 45.26 25.3 0.19 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.222 -0.924 . . . . 0.0 110.157 -179.953 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.16 2.86 8.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.178 -0.951 . . . . 0.0 110.291 179.992 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -101.55 47.63 0.9 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.273 -0.892 . . . . 0.0 110.261 -179.985 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -120.44 16.0 9.84 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.997 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.0 t80 -105.45 -53.23 2.69 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -1.161 . . . . 0.0 110.276 179.972 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.466 ' HB2' ' SG ' ' A' ' 41' ' ' CYS . 23.4 p -109.89 118.05 35.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.264 -0.897 . . . . 0.0 110.31 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.581 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -90.35 -43.11 10.54 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.233 -0.917 . . . . 0.0 110.338 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.581 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.3 m80 -107.85 83.94 1.88 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.31 -0.869 . . . . 0.0 110.015 -179.538 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.492 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 175.73 -161.22 29.89 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.813 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -121.78 133.98 54.92 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.251 -1.147 . . . . 0.0 110.119 179.827 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.587 ' C ' HG23 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -85.61 140.34 30.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.226 -0.921 . . . . 0.0 110.318 -179.831 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.068 HD11 ' CD1' ' A' ' 29' ' ' TYR . 32.8 pt -157.65 -167.95 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 110.075 -179.949 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.529 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 11.2 t80 -147.08 139.69 24.88 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.907 . . . . 0.0 110.04 -179.919 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.663 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.5 mm? -92.2 134.52 34.8 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.105 -0.997 . . . . 0.0 110.743 -179.725 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.514 HG11 ' CB ' ' A' ' 2' ' ' SER . 7.5 p -90.66 -28.32 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.239 -0.913 . . . . 0.0 110.658 179.997 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.541 ' OD1' HD12 ' A' ' 22' ' ' LEU . 58.0 p30 -78.17 -12.98 60.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.922 -1.111 . . . . 0.0 108.892 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -146.41 65.78 1.19 Allowed 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.777 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.529 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 20.5 p -30.03 87.93 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.64 0.733 . . . . 0.0 111.928 -178.466 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.7 tt0 -158.59 168.05 27.93 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.581 -0.7 . . . . 0.0 109.763 179.531 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -76.52 127.47 32.89 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.398 -0.814 . . . . 0.0 110.373 -179.86 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 1.068 ' CD1' HD11 ' A' ' 20' ' ' ILE . 6.3 t80 -122.31 119.83 32.29 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.422 -0.798 . . . . 0.0 109.816 179.906 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 22.2 m -123.79 115.15 20.89 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.128 -0.983 . . . . 0.0 110.51 -179.561 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.492 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 8.1 tpp85 -80.97 115.71 20.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.263 -0.898 . . . . 0.0 109.675 179.528 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 87.4 m -79.68 168.84 18.82 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.237 -0.914 . . . . 0.0 110.512 -179.667 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -79.84 115.44 19.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.415 -0.803 . . . . 0.0 110.216 -179.866 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.439 ' H ' HG23 ' A' ' 34' ' ' VAL . 37.2 t -54.83 110.06 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.347 -0.846 . . . . 0.0 109.778 179.748 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 138.9 -8.23 3.3 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.701 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.22 177.09 9.09 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.158 -1.201 . . . . 0.0 109.908 179.943 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.606 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.62 29.88 7.33 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.92 -1.112 . . . . 0.0 110.115 -179.913 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.01 155.77 26.92 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.384 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.57 ' O ' HG22 ' A' ' 39' ' ' VAL . 14.8 p -85.12 44.27 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.24 -1.153 . . . . 0.0 109.628 179.547 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.22 22.26 0.16 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.491 -0.755 . . . . 0.0 109.909 -179.374 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 11.8 p 29.63 90.28 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.612 -0.68 . . . . 0.0 111.351 179.625 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.6 tm-20 -151.85 -45.04 0.11 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.162 -0.961 . . . . 0.0 110.415 179.943 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.606 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 3.0 p-80 -117.85 129.62 55.76 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.074 -1.017 . . . . 0.0 110.817 179.883 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.664 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 14.8 t80 -87.03 126.44 34.75 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.399 0.619 . . . . 0.0 109.978 -178.794 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.576 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -84.92 2.48 42.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.473 -0.767 . . . . 0.0 109.954 -179.598 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.664 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.4 mt . . . . . 0 C--N 1.302 -1.496 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.31 -179.518 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.466 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 40.8 t . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.186 0.517 . . . . 0.0 110.2 . . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.811 HD11 ' CG2' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -100.02 156.66 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.326 -0.859 . . . . 0.0 110.349 179.974 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.513 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 3.2 m -137.25 166.72 23.09 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.141 179.955 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.9 mttt -106.61 156.08 18.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.214 -0.929 . . . . 0.0 110.35 -179.945 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.637 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 90.7 m -81.8 -160.82 0.38 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.276 -0.89 . . . . 0.0 110.149 -179.948 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.0 t -131.81 -159.62 0.98 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.252 -0.905 . . . . 0.0 110.221 179.967 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.0 m -80.33 171.23 15.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.263 -0.898 . . . . 0.0 110.214 179.967 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 46.5 24.02 0.27 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.279 -0.888 . . . . 0.0 110.238 -179.951 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.11 7.73 7.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.218 -0.926 . . . . 0.0 110.28 -179.981 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -115.22 96.79 5.85 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.223 -0.923 . . . . 0.0 110.229 -179.93 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.56 39.19 1.31 Allowed Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.995 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.445 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 82.6 t80 -142.42 -53.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -1.143 . . . . 0.0 110.262 -179.932 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.3 p -100.86 118.34 36.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.458 -179.833 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.568 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.8 mt -90.49 -43.05 10.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.248 -0.907 . . . . 0.0 110.328 179.838 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.568 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.3 m80 -108.24 83.13 1.73 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.269 -0.894 . . . . 0.0 110.289 -179.403 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 179.33 -134.26 2.25 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.999 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.5 pt20 -160.28 142.6 13.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -1.136 . . . . 0.0 110.387 179.981 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.837 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -83.37 135.51 34.68 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.192 -0.943 . . . . 0.0 110.036 179.739 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.837 HD13 ' O ' ' A' ' 19' ' ' CYS . 37.9 mm -143.13 169.74 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.155 -0.966 . . . . 0.0 110.257 -179.643 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.513 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 23.6 t80 -131.45 140.2 49.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.021 -1.049 . . . . 0.0 110.052 179.813 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.576 HD23 ' HB2' ' A' ' 29' ' ' TYR . 3.2 mm? -102.63 138.61 39.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.125 -0.985 . . . . 0.0 110.927 -179.57 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.466 ' HB ' ' O ' ' A' ' 2' ' ' SER . 7.5 p -90.4 -28.29 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.279 -0.888 . . . . 0.0 110.479 179.936 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -78.23 -17.81 56.23 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.087 -1.008 . . . . 0.0 108.769 179.351 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.576 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -139.57 62.78 1.51 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.685 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.6 p -29.21 85.54 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 121.565 0.698 . . . . 0.0 112.003 -178.284 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.576 ' N ' ' O ' ' A' ' 25' ' ' MET . 9.9 pt20 -161.39 -177.29 5.89 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.577 -0.702 . . . . 0.0 109.385 179.354 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -82.14 163.94 21.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.27 -0.894 . . . . 0.0 110.254 179.937 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.576 ' HB2' HD23 ' A' ' 22' ' ' LEU . 8.6 t80 -150.91 90.45 1.62 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.282 -0.886 . . . . 0.0 109.97 179.875 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.7 m -91.84 101.67 14.26 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.292 -0.88 . . . . 0.0 110.388 -179.735 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.455 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.9 OUTLIER -79.28 118.39 21.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.194 -0.941 . . . . 0.0 109.654 179.589 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 82.1 m -79.73 170.45 16.5 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.373 -0.83 . . . . 0.0 110.36 -179.738 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -79.78 116.22 19.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.356 -0.84 . . . . 0.0 110.118 -179.931 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 t -53.65 105.48 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.266 -0.896 . . . . 0.0 109.678 179.897 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.94 -10.7 1.85 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.663 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.547 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.15 178.6 7.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.12 -1.223 . . . . 0.0 109.673 179.876 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.601 HG23 ' O ' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -109.65 25.77 11.42 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 118.793 -1.163 . . . . 0.0 110.57 -179.799 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.42 160.28 31.62 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 179.29 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.517 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.5 p -87.09 38.13 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.115 -1.226 . . . . 0.0 109.622 179.382 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.57 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -146.31 14.01 1.26 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.562 -0.711 . . . . 0.0 109.65 -179.684 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 8.0 p 31.07 93.29 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.515 -0.74 . . . . 0.0 111.242 179.757 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.57 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.1 tm-20 -159.5 -38.38 0.06 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.509 -0.745 . . . . 0.0 110.022 179.612 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.601 ' O ' HG23 ' A' ' 37' ' ' THR . 2.1 p-80 -120.28 125.6 48.5 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 122.166 0.984 . . . . 0.0 110.538 179.78 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.616 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.2 t80 -85.59 127.48 34.47 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.338 0.589 . . . . 0.0 109.88 -179.026 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.55 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -86.89 -35.48 18.95 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.359 -0.838 . . . . 0.0 110.023 -179.5 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.616 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.7 mt . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.295 -179.775 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.331 0.586 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.971 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -143.9 154.74 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.281 -0.887 . . . . 0.0 110.186 -179.938 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.02 164.07 18.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.264 -0.898 . . . . 0.0 110.311 179.98 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.4 168.06 9.56 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.295 -0.878 . . . . 0.0 110.204 179.993 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.615 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 71.8 m -107.84 -170.93 1.77 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.213 -0.929 . . . . 0.0 110.223 179.99 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -116.85 -155.17 0.58 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.339 -0.851 . . . . 0.0 110.184 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.81 170.26 16.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.206 -0.933 . . . . 0.0 110.184 179.986 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.3 15.1 3.2 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.226 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.94 15.06 9.99 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.0 110.305 -179.977 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -128.71 114.17 16.28 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.225 -0.922 . . . . 0.0 110.088 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.15 27.71 0.19 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 -179.944 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -131.02 -47.59 1.01 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.246 -1.149 . . . . 0.0 110.204 179.914 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.547 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 17.1 p -102.78 123.38 46.34 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.296 -0.877 . . . . 0.0 110.134 179.901 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.6 ' N ' HD23 ' A' ' 15' ' ' LEU . 4.2 mt -90.5 -52.33 4.96 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.276 -0.89 . . . . 0.0 110.406 -179.823 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.502 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 10.5 m80 -99.04 82.81 2.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.37 -0.831 . . . . 0.0 110.358 -179.267 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 178.69 -135.31 2.57 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.93 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.464 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 5.0 pt20 -160.34 145.82 14.99 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -1.102 . . . . 0.0 110.23 179.863 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.615 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 41.9 t -89.43 131.13 35.64 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -0.876 . . . . 0.0 110.051 179.963 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.038 HD11 ' CD1' ' A' ' 29' ' ' TYR . 20.5 pt -143.46 -172.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.374 -0.829 . . . . 0.0 110.085 -179.865 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.53 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 14.9 t80 -142.66 132.53 24.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.242 -0.911 . . . . 0.0 109.868 179.861 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.625 HD23 ' CB ' ' A' ' 29' ' ' TYR . 2.5 mm? -86.49 131.57 34.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.14 -0.975 . . . . 0.0 110.612 -179.726 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.9 p -90.32 -25.04 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.257 -0.902 . . . . 0.0 110.504 179.919 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -78.38 -4.74 49.7 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.024 -1.048 . . . . 0.0 108.858 179.015 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.2 ttt -159.12 68.5 0.44 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 179.183 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 17.9 p -29.51 88.79 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.708 0.766 . . . . 0.0 111.471 -178.484 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.0 OUTLIER -160.49 148.44 16.3 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.629 -0.669 . . . . 0.0 109.462 -179.963 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.6 t-20 -59.08 148.93 29.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.283 -0.886 . . . . 0.0 109.853 179.921 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 1.038 ' CD1' HD11 ' A' ' 20' ' ' ILE . 5.4 t80 -145.82 114.43 6.8 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.161 -0.962 . . . . 0.0 110.328 -179.517 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.547 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.7 m -108.3 111.46 23.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.056 -1.028 . . . . 0.0 110.241 -179.964 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.49 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 1.6 tpp180 -85.61 114.48 22.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.253 -0.904 . . . . 0.0 110.017 179.717 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 96.6 m -79.82 175.99 10.13 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.315 -0.865 . . . . 0.0 110.509 -179.921 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -81.16 115.82 20.76 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.273 -0.892 . . . . 0.0 110.249 -179.944 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 59.7 t -52.16 105.84 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.194 -0.942 . . . . 0.0 109.909 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.547 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 146.62 -13.57 1.56 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 -179.872 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.502 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.54 174.34 11.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.35 -1.088 . . . . 0.0 109.951 179.886 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 37' ' ' THR . . . . . 1.025 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.4 OUTLIER -106.01 -32.45 8.29 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 118.86 -1.136 . . . . 0.0 111.117 -179.674 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.515 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -92.13 159.51 25.42 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.928 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.601 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.9 p -84.85 44.41 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.247 -1.149 . . . . 0.0 109.531 179.455 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.6 27.11 0.19 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.544 -0.722 . . . . 0.0 109.789 -179.339 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 3.2 p 28.5 91.94 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.606 -0.684 . . . . 0.0 111.472 179.577 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 15.4 tm-20 -157.47 -37.96 0.07 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.36 -0.838 . . . . 0.0 110.199 179.599 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 1.025 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.0 p80 -125.29 128.47 48.29 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.048 -1.032 . . . . 0.0 111.159 179.678 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.59 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 89.4 t80 -93.93 112.81 24.71 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.724 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.592 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -94.94 -10.54 30.76 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.266 -0.896 . . . . 0.0 110.197 -179.102 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.59 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 7.5 mt . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.213 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.775 HG13 ' O ' ' A' ' 1' ' ' VAL . 14.5 p . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 121.303 0.573 . . . . 0.0 110.219 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.57 ' HB2' HG11 ' A' ' 23' ' ' VAL . 94.0 p -139.55 90.06 2.38 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.208 -0.932 . . . . 0.0 110.084 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.821 HG12 HG22 ' A' ' 20' ' ' ILE . 9.4 tt -141.23 169.58 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.349 -0.844 . . . . 0.0 110.066 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.518 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 4.0 m -141.35 167.27 22.56 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.303 -0.873 . . . . 0.0 110.423 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -80.98 -170.43 2.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.2 -0.937 . . . . 0.0 110.151 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 99.5 m -116.08 172.67 7.02 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.206 -0.934 . . . . 0.0 110.255 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 t -110.91 -151.28 0.48 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.339 -0.851 . . . . 0.0 110.32 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.8 m -84.62 172.76 11.32 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.336 -0.853 . . . . 0.0 110.318 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 45.29 24.84 0.17 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.36 -0.838 . . . . 0.0 110.296 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.5 2.17 10.16 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.187 -0.945 . . . . 0.0 110.211 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -103.67 76.47 1.4 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 110.126 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -135.02 27.83 3.12 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -135.64 -60.49 0.74 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.236 -1.155 . . . . 0.0 110.199 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -91.47 120.28 32.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.323 -0.861 . . . . 0.0 110.145 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.8 mt -90.08 -41.88 11.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.19 -0.944 . . . . 0.0 110.493 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.597 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.8 m80 -114.4 85.09 2.17 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.258 -0.901 . . . . 0.0 110.098 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.505 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.03 178.18 42.11 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -99.75 140.61 33.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.311 -1.111 . . . . 0.0 110.143 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 1.004 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -85.43 134.32 34.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.311 -0.868 . . . . 0.0 110.278 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.004 HD13 ' O ' ' A' ' 19' ' ' CYS . 0.4 OUTLIER -139.4 -174.34 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.825 0 O-C-N 121.204 -0.935 . . . . 0.0 109.58 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.493 ' O ' HG13 ' A' ' 3' ' ' ILE . 11.3 t80 -149.31 123.46 9.5 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.919 -1.113 . . . . 0.0 110.504 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.734 HD12 ' NE2' ' A' ' 27' ' ' GLN . 21.0 mt -79.52 132.11 36.23 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.236 -0.915 . . . . 0.0 110.947 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.57 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.7 p -90.09 -33.36 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.244 -0.91 . . . . 0.0 109.864 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -78.29 -20.92 50.53 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.231 -0.918 . . . . 0.0 108.58 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.523 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.1 tpt -133.06 60.27 1.71 Allowed 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.479 ' C ' ' O ' ' A' ' 25' ' ' MET . 3.6 p -29.21 89.45 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.667 0.746 . . . . 0.0 111.611 -178.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.734 ' NE2' HD12 ' A' ' 22' ' ' LEU . 2.6 pt20 -159.85 170.44 21.43 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.712 -0.617 . . . . 0.0 109.431 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -81.15 116.23 20.96 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.261 -0.899 . . . . 0.0 110.508 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HD2' HD11 ' A' ' 22' ' ' LEU . 4.3 t80 -109.96 103.92 12.76 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.394 -0.816 . . . . 0.0 109.475 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 65.9 m -108.26 114.67 28.72 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.191 -0.943 . . . . 0.0 110.395 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.505 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.8 tpp85 -79.54 120.73 24.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.896 . . . . 0.0 109.401 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.561 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 95.5 m -78.98 171.84 14.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.138 -0.976 . . . . 0.0 110.471 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -79.38 121.24 24.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.391 -0.818 . . . . 0.0 110.037 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 32.6 t -52.51 104.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.222 -0.924 . . . . 0.0 109.73 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.612 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 144.56 -10.77 1.94 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.34 172.02 14.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.214 -1.168 . . . . 0.0 109.843 179.794 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.909 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -113.39 31.67 6.31 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.891 -1.13 . . . . 0.0 111.066 -179.253 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.43 155.44 26.59 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.56 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.5 p -85.69 43.5 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.308 -1.113 . . . . 0.0 109.475 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.574 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -156.64 20.14 0.33 Allowed 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.565 -0.709 . . . . 0.0 109.787 -179.353 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.561 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 5.2 p 27.57 90.73 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.685 -0.634 . . . . 0.0 111.614 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.574 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 10.4 tm-20 -154.89 -36.51 0.09 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.469 -0.769 . . . . 0.0 110.197 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.909 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.9 p80 -120.42 119.51 33.26 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.016 -1.053 . . . . 0.0 110.626 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.597 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 41.3 t80 -82.78 114.79 21.35 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.332 0.587 . . . . 0.0 110.045 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.532 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -77.98 -35.07 50.59 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.315 -0.866 . . . . 0.0 110.105 -179.69 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.612 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.6 mt . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.338 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 78.8 t . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.297 0.57 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.546 ' HB2' ' CG1' ' A' ' 23' ' ' VAL . 1.4 p -155.14 41.53 0.44 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.223 -0.923 . . . . 0.0 110.121 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.685 ' CG1' HG22 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -155.93 166.58 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.363 -0.836 . . . . 0.0 110.464 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.4 m -149.11 172.22 15.15 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.365 -0.835 . . . . 0.0 110.142 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.67 175.54 5.41 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.229 -0.92 . . . . 0.0 110.227 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 93.7 m -117.09 176.63 5.04 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.291 -0.881 . . . . 0.0 110.26 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -155.96 17.22 0.36 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 0.0 110.672 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.0 m -151.79 -70.39 0.16 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.187 -0.946 . . . . 0.0 110.246 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -80.25 12.9 2.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.161 -0.962 . . . . 0.0 110.552 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.544 ' HB3' ' CB ' ' A' ' 6' ' ' CYS . 22.2 ptm -78.89 -27.69 43.98 Favored 'General case' 0 C--N 1.308 -1.232 0 O-C-N 121.106 -0.996 . . . . 0.0 110.186 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.5 p30 -100.69 44.89 0.99 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.213 -0.929 . . . . 0.0 110.184 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -129.16 -39.11 0.31 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.8 t80 -94.08 -65.04 1.01 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.194 -1.18 . . . . 0.0 110.403 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.583 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 25.2 p -91.24 119.73 31.56 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.162 -0.961 . . . . 0.0 110.269 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.6 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.8 mt -87.59 -40.96 13.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.195 -0.94 . . . . 0.0 110.254 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.6 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.8 m80 -113.53 88.03 2.75 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.16 -0.963 . . . . 0.0 110.091 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.83 -168.43 41.27 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -117.24 134.62 54.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -1.117 . . . . 0.0 110.052 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 3.8 t -79.84 146.8 32.04 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.228 -0.92 . . . . 0.0 109.94 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.809 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.2 mt -152.35 -176.83 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.152 -0.967 . . . . 0.0 109.841 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.508 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 20.6 t80 -147.99 117.88 7.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.111 -0.993 . . . . 0.0 109.971 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.593 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.2 mm? -79.93 130.15 35.06 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.098 -1.001 . . . . 0.0 110.195 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.546 ' CG1' ' HB2' ' A' ' 2' ' ' SER . 7.2 p -89.34 -26.05 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.245 -0.909 . . . . 0.0 110.153 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -78.39 -13.77 59.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.163 -0.96 . . . . 0.0 108.683 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.534 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -148.1 66.91 1.09 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 178.922 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.489 ' C ' ' O ' ' A' ' 25' ' ' MET . 80.7 p -29.15 89.14 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 121.761 0.791 . . . . 0.0 111.743 -178.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.534 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -156.8 144.36 19.08 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.607 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.452 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 9.1 t30 -62.85 108.04 1.11 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.194 -0.941 . . . . 0.0 110.455 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.809 ' CD1' HD12 ' A' ' 20' ' ' ILE . 5.7 t80 -94.31 106.06 18.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.327 -0.858 . . . . 0.0 110.017 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.583 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 1.8 m -111.74 110.07 20.24 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 110.344 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.2 tpp180 -80.05 103.62 10.06 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.169 -0.957 . . . . 0.0 109.668 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 79.3 m -79.54 171.69 14.81 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.305 -0.872 . . . . 0.0 110.247 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -79.33 126.66 31.09 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.234 -0.916 . . . . 0.0 109.836 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 12.7 t -65.99 -15.15 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 110.114 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.27 -15.62 68.05 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.529 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.5 m-85 -79.75 169.86 17.34 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.219 -1.165 . . . . 0.0 109.955 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.67 HG23 ' NE2' ' A' ' 43' ' ' HIS . 15.2 t -101.43 26.48 7.19 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 118.874 -1.131 . . . . 0.0 110.655 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.08 160.64 31.81 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 39' ' ' VAL . 10.7 p -85.04 43.76 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.1 -1.235 . . . . 0.0 109.716 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.655 ' NH2' ' CE1' ' A' ' 43' ' ' HIS . 1.1 ttp180 -150.29 13.8 0.77 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.464 -0.772 . . . . 0.0 110.224 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.3 p 29.56 88.52 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.494 -0.754 . . . . 0.0 110.886 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.561 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 3.4 tt0 -154.85 -36.9 0.09 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.267 -0.895 . . . . 0.0 110.385 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.67 ' NE2' HG23 ' A' ' 37' ' ' THR . 26.5 p-80 -127.88 124.05 36.53 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.025 -1.047 . . . . 0.0 111.327 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.543 ' CE2' ' C ' ' A' ' 46' ' ' LEU . 87.3 t80 -90.63 89.78 7.68 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.598 ' HB3' ' CB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -64.51 -21.67 66.75 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.365 -0.834 . . . . 0.0 110.322 -179.094 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.543 ' C ' ' CE2' ' A' ' 44' ' ' PHE . 7.2 mt . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.211 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.608 HG13 ' O ' ' A' ' 1' ' ' VAL . 7.5 p . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.22 0.534 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.649 ' HB2' HG11 ' A' ' 23' ' ' VAL . 6.6 m -154.58 120.48 5.22 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.253 -0.905 . . . . 0.0 110.261 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.635 HD11 ' HB ' ' A' ' 20' ' ' ILE . 1.3 tt -112.21 150.79 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.487 ' HG1' ' HD1' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -116.23 161.53 18.85 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.272 -0.893 . . . . 0.0 110.204 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.0 tptt -85.09 158.62 20.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.172 -0.955 . . . . 0.0 110.186 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 75.6 m -90.13 -173.46 3.85 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.326 -0.859 . . . . 0.0 110.252 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.7 t -124.96 -152.2 0.51 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.869 . . . . 0.0 110.203 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.34 170.73 10.31 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.297 -0.877 . . . . 0.0 110.1 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.2 t70 52.68 19.57 1.29 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.244 -0.91 . . . . 0.0 110.232 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -118.15 5.33 11.98 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.333 -0.855 . . . . 0.0 110.276 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -105.84 76.21 1.17 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.203 -0.935 . . . . 0.0 110.215 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -125.87 -27.19 1.17 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.834 -1.307 . . . . 0.0 109.834 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.41 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 72.4 t80 -81.43 -52.77 6.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -1.179 . . . . 0.0 110.469 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 28.0 p -99.61 119.77 38.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.259 -0.901 . . . . 0.0 110.511 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.573 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.8 mt -90.49 -43.49 10.21 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.191 -0.943 . . . . 0.0 110.367 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 7.1 m80 -110.98 86.28 2.28 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.223 -0.923 . . . . 0.0 110.219 -179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.503 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 173.83 177.41 43.01 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -97.6 148.27 23.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.24 -1.153 . . . . 0.0 110.059 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -97.75 134.65 40.63 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.25 -0.906 . . . . 0.0 110.231 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.764 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -148.85 -172.36 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 110.048 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.487 ' HD1' ' HG1' ' A' ' 4' ' ' THR . 17.7 t80 -142.19 133.38 26.18 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.174 -0.954 . . . . 0.0 110.067 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.632 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.1 mm? -86.26 130.88 34.37 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.08 -1.012 . . . . 0.0 110.604 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.649 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.5 p -90.51 -25.7 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.265 -0.897 . . . . 0.0 110.47 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.602 ' OD1' HG13 ' A' ' 23' ' ' VAL . 22.1 m-20 -78.37 -11.69 59.96 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.106 -0.996 . . . . 0.0 108.792 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -151.18 67.9 0.92 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.017 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 25' ' ' MET . 67.2 p -29.3 90.1 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.673 0.749 . . . . 0.0 111.282 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -159.42 148.6 18.23 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.521 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 8.8 p30 -64.04 116.71 6.15 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.247 -0.908 . . . . 0.0 110.284 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.632 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.8 t80 -105.86 138.45 42.03 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.26 -0.9 . . . . 0.0 109.775 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 6.8 m -135.55 120.64 18.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.022 -1.049 . . . . 0.0 110.702 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.503 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -94.28 119.21 32.72 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.213 -0.929 . . . . 0.0 109.524 179.303 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.531 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 91.7 m -79.45 173.82 12.2 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.304 -0.873 . . . . 0.0 110.514 -179.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.54 117.57 20.6 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.354 -0.841 . . . . 0.0 109.927 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.1 t -49.09 102.07 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.242 -0.911 . . . . 0.0 109.761 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.539 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 147.16 -12.24 1.41 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.3 167.18 21.27 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.176 -1.191 . . . . 0.0 109.698 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . 1.04 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.95 35.0 3.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.959 -1.088 . . . . 0.0 110.91 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.503 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.25 158.99 30.39 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 39' ' ' VAL . 6.5 p -88.04 29.43 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.224 -1.162 . . . . 0.0 109.866 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -145.91 20.31 1.45 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.444 -0.785 . . . . 0.0 109.749 -179.607 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.531 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 6.4 p 30.55 94.56 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 CA-C-O 121.529 0.681 . . . . 0.0 111.308 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -155.07 -37.0 0.09 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.514 -0.741 . . . . 0.0 110.097 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 1.04 ' CD2' HG23 ' A' ' 37' ' ' THR . 22.6 p-80 -121.72 117.63 27.11 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.14 -0.975 . . . . 0.0 110.295 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 39.9 t80 -80.32 111.46 16.72 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.36 0.6 . . . . 0.0 109.991 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.532 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -74.05 -31.94 63.1 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.435 -0.791 . . . . 0.0 110.133 -179.659 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.247 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.204 0.526 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.755 ' HB3' HG11 ' A' ' 23' ' ' VAL . 29.2 t -156.32 60.39 0.56 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.283 -0.886 . . . . 0.0 110.219 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.675 HD11 ' HB ' ' A' ' 20' ' ' ILE . 5.7 tt -79.56 156.04 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.232 -0.917 . . . . 0.0 110.386 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.484 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.2 OUTLIER -124.29 -171.45 2.34 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.356 -0.84 . . . . 0.0 110.162 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 20' ' ' ILE . 14.1 mtpt -125.94 158.42 35.24 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.296 -0.877 . . . . 0.0 110.231 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.495 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 23.2 m -86.7 -150.62 0.16 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.878 . . . . 0.0 110.146 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -149.96 -155.35 0.62 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.218 -0.926 . . . . 0.0 110.125 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.9 m -90.32 27.92 1.56 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.245 -0.91 . . . . 0.0 110.124 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.444 ' O ' ' OD1' ' A' ' 9' ' ' ASP . 56.2 t0 -144.87 31.42 1.15 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.28 -0.888 . . . . 0.0 110.201 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.2 tpp -152.39 17.51 0.63 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.331 -0.856 . . . . 0.0 110.208 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -106.54 81.92 1.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -133.69 4.4 4.72 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -115.22 -56.63 2.34 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.254 -1.145 . . . . 0.0 110.113 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.581 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -96.55 116.48 29.16 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.167 -0.958 . . . . 0.0 110.516 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.621 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.3 mt -87.37 -40.36 14.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.389 -0.819 . . . . 0.0 110.129 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.9 m80 -118.0 87.22 2.67 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.317 -0.864 . . . . 0.0 110.325 -179.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.468 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -178.31 -169.28 38.92 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.445 ' O ' ' CD1' ' A' ' 20' ' ' ILE . 8.6 mm-40 -106.85 134.82 49.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.304 -1.115 . . . . 0.0 110.306 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.495 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -92.14 126.82 37.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.28 -0.887 . . . . 0.0 110.116 179.794 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.761 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -147.67 -169.64 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.233 -0.917 . . . . 0.0 110.511 -179.61 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.5 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 10.2 t80 -145.7 133.13 20.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.38 -0.825 . . . . 0.0 109.705 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.622 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.5 mm? -86.75 131.85 34.02 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.737 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.755 HG11 ' HB3' ' A' ' 2' ' ' SER . 4.5 p -90.7 -22.76 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.235 -0.915 . . . . 0.0 110.741 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -78.14 -9.51 59.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.069 -1.019 . . . . 0.0 108.893 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -157.11 71.02 0.64 Allowed 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.061 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.5 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 40.6 p -29.26 89.89 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.689 0.757 . . . . 0.0 111.227 -178.486 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -157.37 147.78 21.03 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.769 -0.582 . . . . 0.0 109.517 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.529 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.0 m120 -64.01 122.98 17.83 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.325 -0.86 . . . . 0.0 110.433 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.622 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.8 t80 -112.52 131.24 55.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.359 -0.838 . . . . 0.0 109.762 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.581 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.4 m -131.64 112.14 12.31 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.159 -0.963 . . . . 0.0 110.624 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.468 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 16.7 tpp85 -84.86 134.58 34.28 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.265 -0.897 . . . . 0.0 110.03 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.631 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 6.1 t -79.71 164.07 24.02 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.252 -0.905 . . . . 0.0 110.066 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 14.9 tt0 -79.58 110.69 15.14 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.285 -0.884 . . . . 0.0 109.495 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.427 ' C ' ' O ' ' A' ' 33' ' ' GLU . 37.6 t -43.36 96.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.503 -0.748 . . . . 0.0 109.719 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.842 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 151.52 -14.73 0.82 Allowed Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.581 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.4 m-85 -79.04 -178.33 6.06 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.109 -1.23 . . . . 0.0 109.826 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.672 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.3 OUTLIER -106.03 -57.37 2.05 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.036 -1.04 . . . . 0.0 110.662 -179.683 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.452 ' H ' ' CE1' ' A' ' 43' ' ' HIS . . . -85.41 152.86 26.99 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 39' ' ' VAL . 44.1 t -76.23 2.17 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.237 -1.155 . . . . 0.0 109.96 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.593 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 4.5 tmm_? -80.28 -10.0 59.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.336 -0.852 . . . . 0.0 109.878 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.631 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 11.2 m 59.95 66.9 0.92 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.392 -0.817 . . . . 0.0 110.476 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.593 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER -152.59 -28.25 0.16 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.067 -1.021 . . . . 0.0 111.965 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.672 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.1 p80 -122.78 121.21 35.74 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.56 -1.338 . . . . 0.0 111.659 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.638 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.8 t80 -80.14 110.46 15.57 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.869 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.564 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -74.93 -14.66 60.67 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.104 -0.998 . . . . 0.0 109.958 -179.72 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.842 HD12 ' O ' ' A' ' 35' ' ' GLY . 6.0 mt . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.275 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.439 HG12 ' OG ' ' A' ' 2' ' ' SER . 48.4 t . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.186 0.517 . . . . 0.0 110.106 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.716 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -140.46 103.77 4.62 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.343 -0.848 . . . . 0.0 110.076 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.548 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -160.19 167.88 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.291 -0.881 . . . . 0.0 110.403 -179.656 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.517 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.2 m -144.98 162.4 37.01 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.427 -0.796 . . . . 0.0 110.039 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -119.08 157.73 27.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.252 -0.905 . . . . 0.0 110.133 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 86.3 m -91.91 -124.55 0.08 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.294 -0.879 . . . . 0.0 109.976 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.2 t -146.77 -154.38 0.55 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.972 -1.08 . . . . 0.0 110.122 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -85.04 -59.04 2.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.233 -0.917 . . . . 0.0 110.338 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -83.44 11.89 6.31 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.269 -0.895 . . . . 0.0 110.356 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 8.5 tpt -100.0 -4.42 30.07 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.264 -0.898 . . . . 0.0 110.202 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.441 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 39.4 t-20 -120.89 67.87 0.87 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.232 -0.918 . . . . 0.0 110.144 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.67 24.72 16.03 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.469 ' O ' ' NH1' ' A' ' 40' ' ' ARG . 7.5 t80 -110.19 -50.04 3.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.239 -1.154 . . . . 0.0 110.231 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 1.9 m -89.04 138.16 31.66 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.428 -0.795 . . . . 0.0 110.392 -179.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.578 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.6 mt -91.44 -46.96 7.71 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.564 -0.71 . . . . 0.0 110.2 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.578 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.4 m80 -119.44 91.66 3.6 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.332 -0.855 . . . . 0.0 110.217 -179.02 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.13 -167.13 39.64 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -127.19 164.02 22.58 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.283 -1.127 . . . . 0.0 110.272 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.84 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.4 OUTLIER -96.23 135.2 38.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.282 -0.886 . . . . 0.0 110.315 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.84 HD13 ' O ' ' A' ' 19' ' ' CYS . 17.2 mm -134.58 173.35 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.351 -0.843 . . . . 0.0 109.825 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.517 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 19.7 t80 -144.51 127.84 16.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.923 -1.111 . . . . 0.0 110.399 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.582 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.5 mm? -89.78 133.76 34.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.258 -0.901 . . . . 0.0 110.485 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.716 HG11 ' CB ' ' A' ' 2' ' ' SER . 12.6 p -90.42 -30.55 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.171 -0.955 . . . . 0.0 110.462 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.426 ' OD1' HD12 ' A' ' 22' ' ' LEU . 3.4 p30 -78.3 -18.18 55.58 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.115 -0.991 . . . . 0.0 108.814 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.503 ' O ' ' N ' ' A' ' 27' ' ' GLN . 18.0 ttt -138.13 62.27 1.57 Allowed 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.493 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.56 92.0 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 122.119 0.961 . . . . 0.0 111.148 -178.532 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.512 ' HG3' ' N ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER -159.95 147.63 16.73 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.366 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 6.5 m120 -67.52 105.85 1.97 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.263 -0.898 . . . . 0.0 110.121 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.582 ' HB2' HD23 ' A' ' 22' ' ' LEU . 5.7 t80 -87.61 90.62 8.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.424 -0.797 . . . . 0.0 110.233 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 7.5 m -82.05 115.25 21.11 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 110.553 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -94.75 111.2 22.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.205 -0.934 . . . . 0.0 110.108 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.504 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 79.4 m -79.93 178.07 8.47 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.243 -0.911 . . . . 0.0 110.376 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -80.15 146.27 31.9 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.324 -0.86 . . . . 0.0 109.854 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.414 ' O ' HG12 ' A' ' 34' ' ' VAL . 5.1 t -76.28 29.59 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.143 -0.973 . . . . 0.0 111.818 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.689 ' O ' HD12 ' A' ' 46' ' ' LEU . . . -126.52 -5.06 6.12 Favored Glycine 0 N--CA 1.487 2.044 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.005 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.577 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 15.9 m-85 -95.4 157.51 15.86 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.354 -1.086 . . . . 0.0 109.57 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.65 HG23 ' NE2' ' A' ' 43' ' ' HIS . 10.2 t -108.85 43.47 1.25 Allowed 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 118.468 -1.293 . . . . 0.0 110.633 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.84 161.5 32.84 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.515 ' O ' HG13 ' A' ' 39' ' ' VAL . 8.8 p -87.55 35.64 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.081 -1.247 . . . . 0.0 109.568 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 0.5 OUTLIER -143.1 8.11 1.63 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.472 -0.767 . . . . 0.0 110.279 -179.428 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.504 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 2.5 p 34.02 78.8 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.379 -0.826 . . . . 0.0 111.012 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 33.5 tt0 -142.24 -33.65 0.47 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.406 -0.809 . . . . 0.0 110.159 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.65 ' NE2' HG23 ' A' ' 37' ' ' THR . 19.3 p-80 -118.76 114.61 22.95 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.995 -1.065 . . . . 0.0 109.485 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.593 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 27.0 t80 -78.68 98.07 6.08 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 121.776 0.798 . . . . 0.0 109.323 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.575 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.2 OUTLIER -64.57 -9.15 17.19 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 121.751 -0.593 . . . . 0.0 110.537 -179.015 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.689 HD12 ' O ' ' A' ' 35' ' ' GLY . 8.1 mt . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.465 HG22 ' N ' ' A' ' 2' ' ' SER . 10.0 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.203 0.525 . . . . 0.0 110.178 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.724 ' HB3' HG11 ' A' ' 23' ' ' VAL . 3.0 t -114.09 56.43 0.71 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.266 -0.896 . . . . 0.0 110.148 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.623 HD11 ' HB ' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.79 152.22 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.278 -0.889 . . . . 0.0 110.146 179.928 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.47 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -124.03 -165.14 1.31 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.245 -0.909 . . . . 0.0 110.187 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -106.58 -175.33 2.76 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.232 -0.917 . . . . 0.0 110.207 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 80.5 m -105.23 -155.83 0.55 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 110.356 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -147.42 -138.31 0.09 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.278 -0.889 . . . . 0.0 110.006 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.3 4.82 14.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.054 -1.028 . . . . 0.0 110.059 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -107.19 17.55 22.79 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.324 -0.86 . . . . 0.0 109.823 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.478 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 7.0 ptm -79.49 -26.61 41.58 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.359 -0.838 . . . . 0.0 110.639 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -96.16 58.19 1.81 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.144 -0.972 . . . . 0.0 110.307 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -146.89 13.17 1.49 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.559 ' CE1' ' HA ' ' A' ' 40' ' ' ARG . 8.4 t80 -157.28 -57.8 0.08 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.168 -1.196 . . . . 0.0 110.312 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.3 p -107.97 114.75 28.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.192 -0.943 . . . . 0.0 110.933 -179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.614 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.2 mt -90.13 -42.48 11.05 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.435 -0.791 . . . . 0.0 109.886 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.614 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -111.26 76.91 1.0 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.231 -0.918 . . . . 0.0 110.134 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -172.46 179.5 43.97 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.476 ' HB2' ' HB3' ' A' ' 31' ' ' ARG . 3.0 mt-30 -93.39 148.07 22.39 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.3 -1.118 . . . . 0.0 110.186 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -109.07 121.02 44.26 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.271 -0.893 . . . . 0.0 110.371 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.769 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -144.3 179.52 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.385 -0.822 . . . . 0.0 110.087 -179.819 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 20.9 t80 -127.48 133.68 49.87 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.146 -0.971 . . . . 0.0 110.124 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.719 HD23 ' CB ' ' A' ' 29' ' ' TYR . 0.6 OUTLIER -89.17 133.58 34.35 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.243 -0.911 . . . . 0.0 110.545 -179.967 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.724 HG11 ' HB3' ' A' ' 2' ' ' SER . 8.8 p -90.24 -26.34 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.238 -0.914 . . . . 0.0 110.44 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -78.56 -15.72 58.24 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.056 -1.028 . . . . 0.0 108.821 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -145.47 65.93 1.23 Allowed 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.829 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.494 ' C ' ' O ' ' A' ' 25' ' ' MET . 32.5 p -29.02 89.21 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 CA-C-O 121.648 0.737 . . . . 0.0 111.464 -178.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.3 OUTLIER -159.8 170.14 22.11 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.671 -0.643 . . . . 0.0 109.552 179.731 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.52 100.85 8.78 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.306 -0.871 . . . . 0.0 110.351 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.719 ' CB ' HD23 ' A' ' 22' ' ' LEU . 12.2 t80 -86.99 130.14 34.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.327 -0.858 . . . . 0.0 109.453 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 7.6 m -130.55 116.75 18.58 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.875 -1.14 . . . . 0.0 110.855 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.476 ' HB3' ' HB2' ' A' ' 18' ' ' GLN . 8.0 tpp85 -79.23 128.68 33.61 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.132 -0.98 . . . . 0.0 109.113 179.21 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.623 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 5.7 m -79.67 159.0 26.87 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.15 -0.969 . . . . 0.0 110.133 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 34' ' ' VAL . 31.3 tt0 -78.36 107.85 11.29 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.258 -0.901 . . . . 0.0 109.166 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.442 HG23 ' H ' ' A' ' 34' ' ' VAL . 39.6 t -40.99 101.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 121.697 -0.627 . . . . 0.0 110.436 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.84 ' O ' HD23 ' A' ' 46' ' ' LEU . . . 140.76 -8.42 2.79 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.565 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -84.79 173.01 11.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.029 -1.277 . . . . 0.0 110.486 -179.798 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.916 HG23 ' CE1' ' A' ' 43' ' ' HIS . 3.9 t -127.57 38.37 4.06 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 118.895 -1.122 . . . . 0.0 111.155 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.534 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -151.35 155.16 25.99 Favored Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.417 -1.373 . . . . 0.0 109.976 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.64 HG12 ' O ' ' A' ' 39' ' ' VAL . 79.6 t -83.55 12.68 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.379 -1.071 . . . . 0.0 109.844 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.574 ' HD3' ' N ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -123.26 -7.74 8.19 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.412 -0.805 . . . . 0.0 109.431 179.638 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.623 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 26.8 m 58.77 65.73 1.18 Allowed 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -178.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -135.32 -30.83 1.01 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.561 -0.712 . . . . 0.0 110.868 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.916 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.1 p80 -120.2 123.75 44.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.756 -1.215 . . . . 0.0 111.349 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.619 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 43.9 t80 -86.7 104.25 15.92 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.382 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.93 ' CE2' HD11 ' A' ' 46' ' ' LEU . 0.2 OUTLIER -71.82 -3.19 20.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.396 -0.815 . . . . 0.0 110.163 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.93 HD11 ' CE2' ' A' ' 45' ' ' PHE . 2.1 mm? . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.344 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.42 HG13 ' OG ' ' A' ' 2' ' ' SER . 9.8 p . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.174 0.511 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.469 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 3.2 m -148.52 43.27 1.01 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.171 -0.955 . . . . 0.0 110.356 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.821 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -141.56 122.66 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.138 -0.976 . . . . 0.0 110.659 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.533 ' HB ' ' CB ' ' A' ' 21' ' ' TYR . 4.2 m -90.96 167.28 12.52 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.387 -0.821 . . . . 0.0 109.765 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -122.34 169.29 11.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.274 -0.891 . . . . 0.0 110.13 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 62.8 m -110.61 -144.33 0.39 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.31 -0.869 . . . . 0.0 110.18 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 t -139.84 -166.27 2.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.229 -0.919 . . . . 0.0 110.111 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.18 7.48 13.53 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.208 -0.933 . . . . 0.0 110.283 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.12 25.81 10.07 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.213 -0.929 . . . . 0.0 110.224 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.436 ' SD ' ' SG ' ' A' ' 6' ' ' CYS . 31.8 ttm -144.67 28.11 1.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.225 -0.922 . . . . 0.0 110.196 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -110.42 27.6 9.47 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.243 -0.91 . . . . 0.0 110.167 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.15 -17.28 79.53 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -83.63 -50.08 8.55 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.251 -1.146 . . . . 0.0 110.327 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -105.79 120.9 42.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.254 -0.904 . . . . 0.0 110.408 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.59 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.6 mt -90.31 -42.29 11.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.336 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.1 m80 -111.17 86.45 2.32 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.173 -0.955 . . . . 0.0 110.1 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.456 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 168.93 -163.0 36.8 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -123.62 152.87 41.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.306 -1.114 . . . . 0.0 110.06 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 6.8 t -92.16 146.88 23.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.0 110.282 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.822 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -153.43 -174.08 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.278 -0.889 . . . . 0.0 109.803 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.533 ' CB ' ' HB ' ' A' ' 4' ' ' THR . 27.0 t80 -148.7 130.49 15.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.077 -1.015 . . . . 0.0 109.835 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.696 HD22 HD12 ' A' ' 3' ' ' ILE . 1.6 mm? -92.14 132.52 36.55 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.036 -1.04 . . . . 0.0 111.041 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.469 ' HB ' ' O ' ' A' ' 2' ' ' SER . 6.1 t -90.74 -27.22 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.33 -0.856 . . . . 0.0 110.382 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -77.52 -19.9 55.06 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.986 -1.072 . . . . 0.0 108.393 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.529 ' O ' ' N ' ' A' ' 27' ' ' GLN . 19.9 mtm -141.99 62.04 1.44 Allowed 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.487 ' C ' ' O ' ' A' ' 25' ' ' MET . 2.6 p -29.18 89.76 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.803 0.811 . . . . 0.0 111.494 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.529 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.32 147.85 17.91 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.734 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 5.9 m-80 -57.13 129.55 42.25 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.152 -0.967 . . . . 0.0 110.379 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.822 ' CD1' HD12 ' A' ' 20' ' ' ILE . 6.6 t80 -120.75 107.97 13.4 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.523 -0.736 . . . . 0.0 109.831 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 4.5 m -113.03 112.71 24.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.118 -0.988 . . . . 0.0 110.409 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.456 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 7.2 tpm_? -79.66 116.78 20.05 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.216 -0.928 . . . . 0.0 109.69 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.485 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 96.8 m -79.26 175.61 10.43 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.226 -0.921 . . . . 0.0 110.021 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -79.25 110.93 14.98 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.229 -0.919 . . . . 0.0 109.724 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.422 HG23 ' H ' ' A' ' 34' ' ' VAL . 39.1 t -44.77 101.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.396 -0.815 . . . . 0.0 109.672 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 146.2 -8.66 1.46 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.478 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.02 176.67 9.44 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.915 -1.344 . . . . 0.0 109.895 -179.967 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.606 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -113.99 28.69 8.56 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.897 -1.127 . . . . 0.0 110.472 -179.724 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -158.15 156.27 27.22 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.578 ' O ' HG13 ' A' ' 39' ' ' VAL . 10.0 p -84.63 42.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.326 -1.102 . . . . 0.0 109.839 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.581 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.27 22.93 0.16 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.341 -0.849 . . . . 0.0 109.849 -179.476 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.501 ' C ' ' O ' ' A' ' 40' ' ' ARG . 5.4 p 28.33 93.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.664 -0.647 . . . . 0.0 111.676 179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.581 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 13.4 tm-20 -154.81 -42.1 0.09 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.39 -0.819 . . . . 0.0 110.067 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.606 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.9 p-80 -118.53 128.35 54.49 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.099 -1.001 . . . . 0.0 110.419 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.611 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 36.8 t80 -87.78 128.08 35.32 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.422 0.63 . . . . 0.0 110.16 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.582 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -89.43 -37.33 14.89 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.387 -0.82 . . . . 0.0 110.087 -179.477 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.611 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.001 -0.999 . . . . 0.0 110.151 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 46.2 t . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.183 0.516 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.481 ' HB2' HG11 ' A' ' 23' ' ' VAL . 6.5 m -103.31 90.49 3.72 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.348 -0.845 . . . . 0.0 110.192 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 1.121 ' CD1' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -107.67 140.85 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 110.098 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.482 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -107.35 170.64 7.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 110.151 179.892 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -104.99 171.82 7.11 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.186 -0.947 . . . . 0.0 110.232 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.468 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 62.5 m -90.6 -143.62 0.17 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.287 -0.883 . . . . 0.0 110.106 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.5 p -158.17 -72.72 0.09 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.235 -0.916 . . . . 0.0 110.328 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.0 m -154.39 -75.14 0.11 Allowed 'General case' 0 C--N 1.292 -1.9 0 O-C-N 121.666 -0.646 . . . . 0.0 110.162 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -62.26 -12.1 18.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.881 . . . . 0.0 110.231 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.1 tpt -91.38 19.41 6.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.202 -0.936 . . . . 0.0 110.185 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.426 ' OD1' ' HB3' ' A' ' 6' ' ' CYS . 4.4 m-20 -126.39 81.09 1.97 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.285 -0.884 . . . . 0.0 110.221 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.09 59.92 0.43 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.535 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 63.8 t80 -160.11 -55.43 0.06 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.283 -1.128 . . . . 0.0 110.253 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.4 p -96.46 118.92 33.98 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.3 -0.875 . . . . 0.0 110.567 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.541 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.1 mt -90.66 -47.37 7.7 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.259 -0.901 . . . . 0.0 110.215 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 10.1 m80 -106.78 82.28 1.68 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.37 -0.831 . . . . 0.0 110.201 -179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.488 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 178.08 -171.02 43.44 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.4 mm-40 -109.36 133.48 53.01 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.198 -1.177 . . . . 0.0 110.168 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.587 ' C ' HG23 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -87.61 135.18 33.46 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.315 -0.865 . . . . 0.0 110.184 179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.121 HD12 ' CD1' ' A' ' 3' ' ' ILE . 26.9 pt -157.46 -168.07 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.214 -0.929 . . . . 0.0 110.235 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.56 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 8.4 t80 -141.3 139.44 33.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.209 -0.932 . . . . 0.0 110.004 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.747 HD23 ' CB ' ' A' ' 29' ' ' TYR . 0.7 OUTLIER -94.92 137.39 34.05 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.229 -0.919 . . . . 0.0 110.979 -179.525 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.481 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.3 p -90.14 -27.23 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.346 -0.846 . . . . 0.0 110.371 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.409 ' O ' ' SD ' ' A' ' 25' ' ' MET . 42.1 t0 -78.36 -15.42 58.72 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.165 -0.959 . . . . 0.0 108.814 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.2 OUTLIER -145.08 65.03 1.27 Allowed 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 179.01 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.56 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 49.7 p -29.41 87.72 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 121.623 0.725 . . . . 0.0 111.753 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 25' ' ' MET . 4.1 pt20 -160.89 175.79 12.14 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.584 -0.698 . . . . 0.0 109.544 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -82.18 111.24 18.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 110.339 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 1.094 ' CD1' HD11 ' A' ' 20' ' ' ILE . 10.0 t80 -100.11 118.75 37.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.343 -0.848 . . . . 0.0 109.706 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 20.7 m -119.66 111.51 18.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.06 -1.025 . . . . 0.0 110.641 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.488 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 13.5 tpp180 -81.03 117.88 22.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.195 -0.94 . . . . 0.0 109.485 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.48 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 98.0 m -79.37 170.47 16.55 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 110.349 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -79.61 114.0 18.2 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.322 -0.861 . . . . 0.0 110.183 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.401 HG23 ' H ' ' A' ' 34' ' ' VAL . 44.2 t -47.21 100.86 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.328 -0.858 . . . . 0.0 109.802 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 149.47 -13.37 1.05 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.711 -1.356 . . . . 0.0 109.711 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.2 m-85 -79.19 170.43 16.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.2 -1.177 . . . . 0.0 109.631 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 1.056 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -109.98 32.79 4.83 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.829 -1.169 . . . . 0.0 110.886 -179.67 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.554 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.65 159.9 31.37 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 39' ' ' VAL . 10.0 p -88.8 33.59 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.234 -1.156 . . . . 0.0 109.482 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.6 OUTLIER -142.91 17.89 1.96 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.461 -0.774 . . . . 0.0 109.595 -179.602 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.515 ' C ' ' O ' ' A' ' 40' ' ' ARG . 2.2 p 27.83 86.81 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.123 0 CA-C-O 121.442 0.639 . . . . 0.0 111.131 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 12.4 tm-20 -151.81 -34.79 0.13 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.451 -0.781 . . . . 0.0 110.4 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 1.056 ' CD2' HG23 ' A' ' 37' ' ' THR . 23.9 p-80 -120.91 117.64 27.85 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.034 -1.041 . . . . 0.0 110.364 179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.617 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 28.0 t80 -80.23 109.38 14.65 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.313 0.578 . . . . 0.0 109.991 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.567 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -70.45 -16.69 62.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.91 . . . . 0.0 109.682 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.617 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.7 mt . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.279 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.755 HG13 ' O ' ' A' ' 1' ' ' VAL . 9.5 p . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.212 0.529 . . . . 0.0 110.235 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.532 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER -139.01 177.69 7.71 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.335 -0.853 . . . . 0.0 109.91 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 1.097 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -155.78 165.13 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.347 -0.846 . . . . 0.0 110.209 -179.887 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.485 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 2.8 m -142.13 166.02 25.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.938 . . . . 0.0 110.027 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -85.72 163.21 18.37 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -0.875 . . . . 0.0 110.265 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.789 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 21.3 m -93.92 -145.17 0.24 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.231 -0.918 . . . . 0.0 110.209 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.0 t -151.94 -150.2 0.33 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 110.092 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.436 ' O ' ' N ' ' A' ' 10' ' ' MET . 0.3 OUTLIER -84.37 168.71 15.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.291 -0.88 . . . . 0.0 110.209 179.881 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 8' ' ' SER . 0.4 OUTLIER 42.12 27.15 0.07 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.267 -0.896 . . . . 0.0 110.231 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.452 ' SD ' ' HB3' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -122.68 -4.15 8.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.176 -0.953 . . . . 0.0 110.229 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -116.84 69.73 0.76 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.276 -0.89 . . . . 0.0 110.209 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -129.82 29.56 3.73 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.533 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 47.0 t80 -124.47 -57.25 1.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.333 -1.098 . . . . 0.0 110.295 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 26.7 p -91.45 122.75 34.32 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.283 -0.885 . . . . 0.0 110.34 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.553 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 5.6 mt -90.44 -45.46 8.97 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.259 -0.901 . . . . 0.0 110.238 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.553 ' ND1' ' HB2' ' A' ' 15' ' ' LEU . 7.1 m80 -109.07 87.44 2.49 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.309 -0.869 . . . . 0.0 110.159 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.488 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 177.98 -175.58 47.57 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -107.99 137.83 45.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.204 -1.174 . . . . 0.0 110.253 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.789 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 1.5 t -86.72 139.6 30.59 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.0 110.225 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.097 HD12 HD11 ' A' ' 3' ' ' ILE . 24.2 pt -157.33 -173.19 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.249 -0.907 . . . . 0.0 109.96 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.485 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 5.7 t80 -144.64 128.54 17.41 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.141 -0.975 . . . . 0.0 110.306 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.659 HD11 ' HD2' ' A' ' 29' ' ' TYR . 15.9 mt -79.54 133.55 36.47 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.339 -0.851 . . . . 0.0 110.779 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.532 HG11 ' HB3' ' A' ' 2' ' ' SER . 12.4 p -89.5 -30.91 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.889 . . . . 0.0 109.916 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -78.49 -20.07 51.65 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.136 -0.978 . . . . 0.0 108.684 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.558 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.0 mtm -136.78 61.72 1.62 Allowed 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 25' ' ' MET . 35.0 p -29.37 87.68 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 CA-C-O 121.7 0.762 . . . . 0.0 111.508 -178.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -160.64 148.17 15.89 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.48 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.7 t30 -62.62 114.97 3.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.196 -0.94 . . . . 0.0 110.304 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 1.07 ' CD1' HD11 ' A' ' 20' ' ' ILE . 4.1 t80 -106.54 121.78 44.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.408 -0.808 . . . . 0.0 109.687 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.609 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 19.9 m -117.52 112.12 20.17 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.078 -1.014 . . . . 0.0 110.478 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.488 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 1.9 tpp180 -81.89 117.52 22.21 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.207 -0.933 . . . . 0.0 109.635 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.463 ' HB3' ' HB3' ' A' ' 41' ' ' CYS . 65.8 m -79.36 170.85 15.99 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.229 -0.919 . . . . 0.0 110.488 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -79.46 113.16 17.38 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.335 -0.853 . . . . 0.0 110.194 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.5 t -48.67 106.71 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.44 -0.787 . . . . 0.0 109.955 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.26 -10.92 2.26 Favored Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -79.53 177.14 9.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.177 -1.19 . . . . 0.0 109.975 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.678 HG21 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -110.12 -43.26 3.99 Favored 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 118.732 -1.187 . . . . 0.0 111.21 -179.524 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.59 158.79 43.68 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.269 -1.532 . . . . 0.0 109.269 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.761 HG12 ' O ' ' A' ' 39' ' ' VAL . 80.9 t -84.7 44.45 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.247 -1.149 . . . . 0.0 109.513 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.575 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.28 26.65 0.17 Allowed 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.481 -0.762 . . . . 0.0 109.61 -179.372 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 10.9 p 30.78 93.12 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.512 -0.743 . . . . 0.0 111.335 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 6.6 tm-20 -160.17 -42.7 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 110.388 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.678 ' CE1' HG21 ' A' ' 37' ' ' THR . 0.0 OUTLIER -120.1 136.73 54.49 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 122.177 0.989 . . . . 0.0 110.8 -179.76 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 69.4 t80 -97.32 137.09 36.85 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.142 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.592 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -121.77 13.11 10.69 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 110.605 -179.431 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.6 mt . . . . . 0 N--CA 1.492 1.639 0 O-C-N 120.938 -1.101 . . . . 0.0 110.303 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 34.2 m . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 121.325 0.584 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.508 ' HB3' HG21 ' A' ' 23' ' ' VAL . 4.9 t -157.05 71.08 0.65 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.264 -0.897 . . . . 0.0 110.11 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.789 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.73 150.8 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.91 . . . . 0.0 110.34 -179.78 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.493 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.3 m -131.41 170.74 14.25 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.388 -0.82 . . . . 0.0 110.205 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -109.26 179.6 4.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.214 -0.929 . . . . 0.0 110.185 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.3 m -106.92 -154.58 0.52 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 110.355 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.0 t -136.23 -145.72 0.22 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.095 -1.003 . . . . 0.0 110.647 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 41.2 t -79.79 -70.67 0.5 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.31 -0.869 . . . . 0.0 110.421 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -76.33 2.96 11.96 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.264 -0.897 . . . . 0.0 110.366 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.18 14.95 25.88 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.13 -0.981 . . . . 0.0 110.191 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -140.95 120.08 12.87 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.31 -0.869 . . . . 0.0 110.245 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.48 62.57 0.19 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.593 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 52.1 t80 -151.45 -57.11 0.15 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.273 -1.134 . . . . 0.0 110.145 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.542 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 23.5 p -85.66 124.85 32.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.263 -0.898 . . . . 0.0 110.319 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.6 mt -89.99 -42.53 11.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.273 -0.892 . . . . 0.0 110.256 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.597 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.7 m80 -113.91 92.85 4.12 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.281 -0.887 . . . . 0.0 110.147 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.48 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 167.53 -132.6 2.64 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.439 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 0.8 OUTLIER -158.81 149.49 19.98 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -1.103 . . . . 0.0 110.285 -179.945 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -89.68 146.2 24.69 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.297 -0.877 . . . . 0.0 110.364 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.789 HG22 ' CG1' ' A' ' 3' ' ' ILE . 1.1 mt -153.03 -166.54 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.296 -0.877 . . . . 0.0 109.579 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.493 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 16.7 t80 -152.65 125.7 8.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.088 -1.007 . . . . 0.0 110.135 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.692 HD22 HD12 ' A' ' 3' ' ' ILE . 1.3 mm? -88.44 132.22 34.56 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.2 -0.937 . . . . 0.0 110.611 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.508 HG21 ' HB3' ' A' ' 2' ' ' SER . 9.4 p -90.38 -24.11 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.243 -0.911 . . . . 0.0 110.462 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.51 -13.69 59.71 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.107 -0.996 . . . . 0.0 108.703 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.537 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.0 tpp -150.0 67.88 0.99 Allowed 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 25' ' ' MET . 12.5 p -29.28 89.44 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.715 0.769 . . . . 0.0 111.536 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.11 147.85 16.58 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.725 -0.609 . . . . 0.0 109.377 179.9 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.515 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 10.8 m-20 -59.79 127.92 34.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.157 -0.964 . . . . 0.0 110.248 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.782 ' CD1' HD12 ' A' ' 20' ' ' ILE . 8.7 t80 -117.82 109.94 17.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.269 -0.894 . . . . 0.0 110.207 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.542 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -112.76 110.23 20.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.23 -0.919 . . . . 0.0 110.163 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.48 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -81.4 123.76 28.84 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.23 -0.919 . . . . 0.0 109.817 179.585 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.525 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 78.7 m -79.73 178.58 8.06 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.324 -0.86 . . . . 0.0 110.251 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -80.69 114.74 19.79 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.25 -0.906 . . . . 0.0 110.176 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.419 HG23 ' H ' ' A' ' 34' ' ' VAL . 42.4 t -47.33 103.0 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.334 -0.854 . . . . 0.0 109.796 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.752 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 145.4 -11.46 1.77 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.579 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.9 OUTLIER -79.54 167.38 20.84 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.127 -1.219 . . . . 0.0 109.923 179.994 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . 1.066 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -108.21 33.96 3.86 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.048 -1.032 . . . . 0.0 110.555 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.488 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.5 156.32 27.6 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.48 ' O ' HG22 ' A' ' 39' ' ' VAL . 7.6 p -87.51 33.27 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.2 -1.176 . . . . 0.0 109.834 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.593 ' HG3' ' CE1' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -148.68 20.02 1.03 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.349 -0.845 . . . . 0.0 109.677 -179.65 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.525 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 7.1 p 30.77 94.42 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.65 0.738 . . . . 0.0 111.603 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 6.2 tm-20 -153.8 -36.69 0.1 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.551 -0.718 . . . . 0.0 109.96 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 1.066 ' CD2' HG23 ' A' ' 37' ' ' THR . 18.6 p-80 -122.82 116.28 23.41 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.233 -0.917 . . . . 0.0 109.624 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.626 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 23.9 t80 -79.62 107.94 12.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.763 -0.586 . . . . 0.0 110.486 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.559 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -67.43 -30.55 70.32 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.397 -0.814 . . . . 0.0 109.428 179.663 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.752 HD12 ' O ' ' A' ' 35' ' ' GLY . 4.5 mt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.188 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.525 HG13 ' O ' ' A' ' 1' ' ' VAL . 2.6 p . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.229 0.537 . . . . 0.0 110.234 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.875 ' HB2' HG11 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -136.23 137.77 41.15 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.204 -0.935 . . . . 0.0 110.225 179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.794 ' CG1' HG22 ' A' ' 20' ' ' ILE . 1.1 tp -144.18 154.47 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.305 -0.872 . . . . 0.0 110.16 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.506 ' O ' ' N ' ' A' ' 21' ' ' TYR . 3.1 m -140.47 168.19 20.37 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.262 -0.898 . . . . 0.0 110.119 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.44 179.55 6.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.176 -0.953 . . . . 0.0 110.302 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 86.4 m -105.22 164.76 11.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.262 -0.898 . . . . 0.0 110.276 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.8 t -102.34 -152.38 0.44 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.326 -0.859 . . . . 0.0 110.141 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.414 ' O ' ' N ' ' A' ' 10' ' ' MET . 0.8 OUTLIER -83.81 171.55 13.02 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.34 -0.85 . . . . 0.0 110.076 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 8' ' ' SER . 3.0 t0 42.42 27.87 0.1 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.185 -0.947 . . . . 0.0 110.191 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.414 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -126.21 3.99 7.1 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.276 -0.89 . . . . 0.0 110.15 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -110.35 86.73 2.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.263 -0.898 . . . . 0.0 110.265 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.01 64.64 0.39 Allowed Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -154.19 -60.62 0.13 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.263 -1.139 . . . . 0.0 110.165 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 40' ' ' ARG . 25.4 p -96.28 117.18 30.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.278 -0.889 . . . . 0.0 110.43 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.589 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.3 mt -69.22 -42.66 75.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.49 -0.756 . . . . 0.0 109.784 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.3 m80 -117.25 80.63 1.52 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.439 -0.788 . . . . 0.0 110.388 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.416 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -177.33 152.76 12.39 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.211 -1.556 . . . . 0.0 109.211 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.545 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -80.85 169.81 17.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.125 -1.22 . . . . 0.0 110.563 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -107.22 130.12 54.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.241 -0.912 . . . . 0.0 110.798 -179.579 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.894 HD13 ' HD2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -132.79 -165.89 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.363 -0.836 . . . . 0.0 109.494 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.506 ' N ' ' O ' ' A' ' 4' ' ' THR . 12.5 t80 -149.57 135.16 18.49 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.054 -1.029 . . . . 0.0 109.871 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.59 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.2 mm? -95.77 134.05 39.16 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.15 -0.969 . . . . 0.0 111.234 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.875 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.0 p -90.73 -25.16 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.434 -0.791 . . . . 0.0 110.385 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.88 -14.53 59.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.096 -1.003 . . . . 0.0 108.82 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.548 ' O ' ' N ' ' A' ' 27' ' ' GLN . 5.5 ttm -147.31 67.38 1.14 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 25' ' ' MET . 17.2 p -29.81 87.68 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.599 0.714 . . . . 0.0 111.922 -178.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.0 OUTLIER -157.83 170.67 21.81 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.67 -0.644 . . . . 0.0 109.782 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -79.4 125.18 29.2 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.413 -0.804 . . . . 0.0 110.582 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.894 ' HD2' HD13 ' A' ' 20' ' ' ILE . 30.1 t80 -105.7 167.49 9.73 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.392 -0.817 . . . . 0.0 109.46 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.493 ' HA ' ' CD1' ' A' ' 20' ' ' ILE . 2.4 m -152.13 117.66 5.35 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.028 -1.045 . . . . 0.0 110.683 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.883 ' H ' HD11 ' A' ' 20' ' ' ILE . 4.8 tpp85 -84.89 125.79 32.93 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.104 -0.998 . . . . 0.0 108.896 179.06 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.3 m -79.69 163.62 24.39 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.129 -0.982 . . . . 0.0 110.334 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.508 ' O ' ' N ' ' A' ' 35' ' ' GLY . 10.2 tt0 -78.19 111.91 14.62 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.754 -0.779 . . . . 0.0 109.287 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.434 ' C ' ' O ' ' A' ' 33' ' ' GLU . 35.3 t -41.86 94.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.578 -0.701 . . . . 0.0 109.985 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.642 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 153.73 -17.2 0.65 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.565 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.6 m-85 -79.37 167.92 20.2 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.081 -1.247 . . . . 0.0 109.92 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . 1.035 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -113.86 37.01 3.41 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.139 -1.025 . . . . 0.0 110.924 -179.491 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.428 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.91 157.38 28.87 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.7 p -88.99 27.56 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.277 -1.131 . . . . 0.0 109.551 179.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.566 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 12.1 ttp180 -127.16 -18.87 4.46 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.539 -0.726 . . . . 0.0 110.276 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.7 m 68.45 78.83 0.22 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.156 -0.965 . . . . 0.0 109.829 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.566 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -152.18 -32.56 0.14 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.473 -0.767 . . . . 0.0 110.984 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 1.035 ' CD2' HG23 ' A' ' 37' ' ' THR . 20.4 p-80 -123.17 118.95 28.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.894 -1.129 . . . . 0.0 110.922 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 40.6 t80 -81.64 105.18 12.58 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.322 0.582 . . . . 0.0 109.798 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.522 ' CD1' ' C ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -64.78 -27.37 68.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.288 -0.883 . . . . 0.0 110.095 -179.567 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.642 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.7 mt . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.348 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.467 ' O ' HG12 ' A' ' 1' ' ' VAL . 59.2 t . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.195 0.521 . . . . 0.0 110.218 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.9 t -154.89 138.91 16.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.246 -0.909 . . . . 0.0 110.41 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.547 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.9 tt -121.19 152.79 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.315 -0.865 . . . . 0.0 110.063 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.482 ' CB ' ' HB3' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -110.01 169.69 8.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.902 . . . . 0.0 110.271 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -117.87 159.69 22.67 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.285 -0.884 . . . . 0.0 110.103 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.51 ' CB ' ' HG ' ' A' ' 19' ' ' CYS . 61.4 m -110.65 -151.26 0.47 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.113 -0.992 . . . . 0.0 110.34 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.7 t -152.99 -151.07 0.36 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.291 -0.88 . . . . 0.0 110.086 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.42 ' O ' ' C ' ' A' ' 9' ' ' ASP . 79.2 p -86.99 165.38 15.89 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.182 -0.949 . . . . 0.0 110.119 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.42 ' C ' ' O ' ' A' ' 8' ' ' SER . 2.2 m-20 41.48 31.01 0.16 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.214 -0.929 . . . . 0.0 110.301 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.78 -14.38 9.01 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.344 -0.847 . . . . 0.0 110.362 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -148.65 107.4 3.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.0 110.428 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -104.44 52.82 0.72 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.336 -1.506 . . . . 0.0 109.336 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -126.58 -55.37 1.42 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -1.106 . . . . 0.0 110.447 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.3 p -96.59 117.23 30.52 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.132 -0.98 . . . . 0.0 110.619 -179.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.621 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 14.4 mt -82.26 -39.52 22.89 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.365 -0.835 . . . . 0.0 109.839 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.6 m80 -121.41 84.35 2.23 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.443 -0.786 . . . . 0.0 110.243 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -177.02 175.8 47.82 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -93.22 141.49 28.37 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.269 -1.136 . . . . 0.0 110.276 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.518 ' C ' HD13 ' A' ' 20' ' ' ILE . 7.9 t -98.79 124.12 43.46 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.353 -0.842 . . . . 0.0 110.144 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.826 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.55 -173.7 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.389 -0.82 . . . . 0.0 110.141 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.482 ' HB3' ' CB ' ' A' ' 4' ' ' THR . 10.8 t80 -138.99 136.53 35.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.832 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.651 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.3 mm? -92.41 133.94 35.41 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.02 -1.05 . . . . 0.0 111.009 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.1 p -90.46 -27.7 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.356 -0.84 . . . . 0.0 110.563 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -78.36 -17.79 56.0 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.082 -1.011 . . . . 0.0 108.964 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.548 ' O ' ' N ' ' A' ' 27' ' ' GLN . 14.8 mtt -142.62 64.9 1.36 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.48 ' C ' ' O ' ' A' ' 25' ' ' MET . 11.8 p -29.18 88.69 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.716 0.769 . . . . 0.0 111.553 -178.368 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.7 pt20 -160.32 171.8 18.48 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.655 -0.653 . . . . 0.0 109.636 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -80.08 122.7 27.1 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.385 -0.822 . . . . 0.0 110.478 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.651 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.3 t80 -113.07 129.75 56.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.507 -0.746 . . . . 0.0 109.429 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.7 m -129.84 113.32 14.52 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.99 -1.069 . . . . 0.0 110.874 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -79.57 133.38 36.45 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.282 -0.886 . . . . 0.0 109.097 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 10.8 m -78.99 160.26 27.27 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.235 -0.916 . . . . 0.0 109.985 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.516 ' O ' ' N ' ' A' ' 35' ' ' GLY . 12.1 tt0 -78.54 112.99 16.17 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.294 -0.879 . . . . 0.0 109.023 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.436 ' C ' ' O ' ' A' ' 33' ' ' GLU . 24.0 t -40.76 94.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.586 -0.696 . . . . 0.0 110.3 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.901 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 153.41 -18.89 0.7 Allowed Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 3.6 m-85 -82.2 166.19 19.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -1.162 . . . . 0.0 109.902 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.772 HG23 ' NE2' ' A' ' 43' ' ' HIS . 9.1 t -121.38 47.81 1.78 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.973 -1.079 . . . . 0.0 111.158 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.63 157.62 29.07 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.7 p -88.59 23.83 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.345 -1.091 . . . . 0.0 109.421 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.588 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 11.2 ttp180 -126.51 -19.66 4.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.578 -0.701 . . . . 0.0 110.291 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.8 m 68.18 68.54 0.33 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.12 -0.987 . . . . 0.0 110.263 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.588 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 5.3 tm-20 -137.99 -27.87 0.89 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.367 -0.833 . . . . 0.0 110.992 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.772 ' NE2' HG23 ' A' ' 37' ' ' THR . 20.8 p-80 -126.95 121.82 32.81 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.762 -1.211 . . . . 0.0 111.111 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.627 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.3 t80 -83.16 101.18 11.03 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.54 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.1 OUTLIER -64.31 -14.33 55.4 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.208 -0.933 . . . . 0.0 110.149 -179.362 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.901 HD12 ' O ' ' A' ' 35' ' ' GLY . 6.9 mt . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.228 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.64 HG13 ' O ' ' A' ' 1' ' ' VAL . 11.3 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.258 0.551 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.851 ' N ' HG11 ' A' ' 23' ' ' VAL . 2.8 m -92.16 105.11 17.41 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.224 -0.923 . . . . 0.0 110.646 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.828 HD11 ' CG2' ' A' ' 20' ' ' ILE . 0.9 OUTLIER -80.11 164.6 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.245 -0.91 . . . . 0.0 109.873 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.544 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 2.3 m -148.7 166.34 28.67 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.11 -0.994 . . . . 0.0 110.259 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.65 162.02 13.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.234 -0.916 . . . . 0.0 110.163 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.8 m -93.19 -150.25 0.28 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.266 -0.896 . . . . 0.0 110.194 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 t -147.37 -155.42 0.62 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.264 -0.898 . . . . 0.0 110.22 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.34 172.11 14.19 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.29 -0.881 . . . . 0.0 110.205 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.5 t0 47.83 23.71 0.49 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.218 -0.926 . . . . 0.0 110.276 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.14 9.65 6.26 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.255 -0.903 . . . . 0.0 110.234 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.403 ' OD1' ' SG ' ' A' ' 14' ' ' CYS . 0.9 OUTLIER -119.52 76.84 1.16 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -0.912 . . . . 0.0 110.402 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -121.74 -8.95 7.21 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -91.67 -49.19 6.42 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.252 -1.146 . . . . 0.0 110.165 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.581 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.0 p -101.46 121.13 41.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.405 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.601 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.4 mt -90.03 -40.18 12.47 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -0.927 . . . . 0.0 110.402 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.601 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.6 m80 -114.19 89.93 3.22 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.204 -0.935 . . . . 0.0 110.12 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 171.1 -167.1 40.27 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -117.68 162.85 17.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.368 -1.078 . . . . 0.0 110.298 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.879 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -98.16 137.97 36.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.262 -0.899 . . . . 0.0 110.185 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.879 HD13 ' O ' ' A' ' 19' ' ' CYS . 15.9 mm -142.38 172.71 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.319 -0.863 . . . . 0.0 110.169 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.544 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 32.1 t80 -134.4 136.02 43.02 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.103 -0.998 . . . . 0.0 109.849 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.562 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 3.4 mm? -99.54 132.37 44.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.019 -1.051 . . . . 0.0 111.043 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.851 HG11 ' N ' ' A' ' 2' ' ' SER . 11.5 p -90.77 -24.58 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.6 -0.688 . . . . 0.0 110.722 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -78.05 -15.14 59.17 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.027 -1.046 . . . . 0.0 108.801 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.544 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -147.17 67.17 1.14 Allowed 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.641 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.492 ' C ' ' O ' ' A' ' 25' ' ' MET . 61.9 p -28.97 88.63 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.762 0.792 . . . . 0.0 111.403 -178.278 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.65 149.0 16.36 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.974 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.528 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.5 t30 -59.3 157.33 11.02 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.303 -0.873 . . . . 0.0 109.886 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.582 ' CD1' ' N ' ' A' ' 30' ' ' CYS . 12.9 t80 -138.87 159.77 41.34 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.312 -0.867 . . . . 0.0 109.699 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.582 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 28.6 m -153.47 107.61 3.06 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.07 -1.019 . . . . 0.0 110.595 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.483 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 1.3 tpp180 -82.43 121.35 26.62 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.252 -0.905 . . . . 0.0 109.468 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.519 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 75.8 m -79.46 170.75 16.12 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.219 -0.926 . . . . 0.0 110.549 -179.451 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -79.51 114.47 18.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.399 -0.813 . . . . 0.0 110.052 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 47.2 t -47.54 103.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.392 -0.818 . . . . 0.0 109.75 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 145.93 -10.66 1.62 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.477 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.39 176.16 9.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.112 -1.228 . . . . 0.0 109.84 179.905 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.669 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -115.03 31.56 6.61 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.98 -1.075 . . . . 0.0 110.878 -179.432 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.26 159.84 31.17 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.54 ' O ' HG22 ' A' ' 39' ' ' VAL . 12.7 p -86.98 37.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -1.122 . . . . 0.0 109.545 179.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.579 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -150.7 15.06 0.76 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.463 -0.773 . . . . 0.0 110.005 -179.441 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.519 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 9.4 p 32.67 87.19 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.67 -0.644 . . . . 0.0 110.6 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.579 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 1.5 tt0 -151.2 -38.76 0.12 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.403 -0.81 . . . . 0.0 110.286 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.669 ' CE1' HG23 ' A' ' 37' ' ' THR . 1.6 p-80 -120.53 128.5 53.16 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.04 -1.038 . . . . 0.0 110.703 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.608 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 25.0 t80 -86.76 128.3 35.02 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.424 0.63 . . . . 0.0 110.155 -178.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.593 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -95.38 6.26 49.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.429 -0.794 . . . . 0.0 110.118 -179.391 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 C--N 1.302 -1.48 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.443 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 121.278 0.561 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.558 ' HB3' HG11 ' A' ' 23' ' ' VAL . 1.3 t -82.47 96.79 8.12 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.238 -0.914 . . . . 0.0 110.287 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 1.001 ' CD1' HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -122.56 152.91 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.308 -0.87 . . . . 0.0 110.139 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.509 ' N ' HG13 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -125.97 172.78 9.65 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.229 -0.919 . . . . 0.0 110.267 -179.972 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.91 166.25 12.27 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.244 -0.91 . . . . 0.0 110.19 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 21.6 m -92.8 -143.76 0.22 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.211 -0.931 . . . . 0.0 110.186 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 t -137.12 -178.85 5.39 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 110.131 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.6 m -81.76 8.56 9.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.25 -0.906 . . . . 0.0 110.171 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -125.84 21.49 7.59 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.243 -0.911 . . . . 0.0 110.238 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.67 21.86 2.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.226 -0.922 . . . . 0.0 110.188 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -113.58 91.33 3.6 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.224 -0.922 . . . . 0.0 110.163 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -158.99 49.4 0.41 Allowed Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -144.98 -65.75 0.33 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -1.145 . . . . 0.0 110.191 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.632 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 24.6 p -83.64 125.68 32.08 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.224 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -89.48 -41.4 12.08 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.19 -0.944 . . . . 0.0 110.369 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.597 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.7 m80 -112.5 77.21 1.03 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.117 -0.989 . . . . 0.0 110.209 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -170.08 178.5 42.87 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -107.19 140.08 40.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.295 -1.121 . . . . 0.0 110.36 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -82.28 139.85 33.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.218 -0.927 . . . . 0.0 109.965 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.082 HD11 ' CD1' ' A' ' 29' ' ' TYR . 26.3 pt -156.21 -163.58 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.199 -0.938 . . . . 0.0 110.205 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.605 ' O ' HD12 ' A' ' 3' ' ' ILE . 5.3 t80 -153.48 141.61 20.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.156 -0.965 . . . . 0.0 109.882 -179.741 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.682 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.7 mm? -92.48 136.02 33.57 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.187 -0.946 . . . . 0.0 110.875 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.558 HG11 ' HB3' ' A' ' 2' ' ' SER . 7.7 p -90.94 -27.81 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.387 -0.821 . . . . 0.0 110.706 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' A' ' 25' ' ' MET . 58.3 p30 -78.46 -12.85 60.03 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.91 -1.118 . . . . 0.0 109.002 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 51.2 mtt -147.98 65.82 1.1 Allowed 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.575 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 69.0 p -29.68 89.25 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.703 0.763 . . . . 0.0 111.51 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.26 147.88 16.36 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.864 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.524 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 20.4 p30 -58.36 132.92 55.11 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.127 -0.983 . . . . 0.0 110.141 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 1.082 ' CD1' HD11 ' A' ' 20' ' ' ILE . 10.3 t80 -128.27 123.25 33.66 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.316 -0.865 . . . . 0.0 110.276 -179.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.632 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 1.7 m -113.74 115.2 27.44 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.09 -1.006 . . . . 0.0 110.172 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -86.18 100.6 12.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.13 -0.981 . . . . 0.0 109.569 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.583 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 86.6 m -79.52 172.68 13.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.319 -0.863 . . . . 0.0 110.239 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -79.53 127.64 32.38 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.324 -0.86 . . . . 0.0 109.859 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.9 t -71.49 -13.64 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.353 -0.842 . . . . 0.0 110.236 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -74.85 -7.45 80.86 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.535 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -79.78 177.5 8.85 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.183 -1.187 . . . . 0.0 110.091 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.613 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.59 27.57 9.52 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.922 -1.112 . . . . 0.0 110.13 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -159.07 157.76 28.81 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.321 -1.512 . . . . 0.0 109.321 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.808 HG12 ' O ' ' A' ' 39' ' ' VAL . 67.1 t -84.84 43.52 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.186 -1.185 . . . . 0.0 109.705 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.558 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -155.85 16.26 0.36 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.274 -0.891 . . . . 0.0 110.258 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.583 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 9.0 p 32.17 89.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.59 -0.694 . . . . 0.0 110.639 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.558 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 1.8 tt0 -155.95 -41.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.326 -0.859 . . . . 0.0 110.121 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.613 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.4 p-80 -118.37 126.36 51.94 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.066 -1.022 . . . . 0.0 110.512 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.608 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.4 t80 -87.5 129.02 35.22 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.553 -0.717 . . . . 0.0 109.986 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.557 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -92.64 -32.43 14.77 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.432 -0.793 . . . . 0.0 110.091 -179.412 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.8 mt . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.313 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 55.0 t . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.256 0.55 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.657 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -120.53 61.8 0.87 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.224 -0.922 . . . . 0.0 110.221 179.939 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.715 HD12 HD23 ' A' ' 22' ' ' LEU . 0.9 OUTLIER -109.86 149.94 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.254 -0.904 . . . . 0.0 110.247 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -115.53 179.46 3.96 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.256 -0.903 . . . . 0.0 110.215 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.62 170.81 8.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.242 -0.911 . . . . 0.0 110.199 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 97.8 m -108.48 -167.98 1.3 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.249 -0.907 . . . . 0.0 110.352 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.4 t -130.12 -138.97 0.22 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.058 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 33.0 t -79.71 5.61 12.95 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.09 -1.006 . . . . 0.0 110.133 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -97.33 8.7 44.06 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.283 -0.886 . . . . 0.0 110.018 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.464 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 22.3 ptt? -79.59 -14.06 59.08 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.323 -0.86 . . . . 0.0 110.455 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -107.96 90.15 3.21 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.21 -0.931 . . . . 0.0 110.087 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -171.4 -35.43 0.03 OUTLIER Glycine 0 N--CA 1.487 2.096 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -107.99 -62.82 1.39 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.219 -1.165 . . . . 0.0 110.418 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.526 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.1 p -87.31 117.93 26.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.196 -0.94 . . . . 0.0 110.483 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.763 ' HB2' ' CD2' ' A' ' 16' ' ' HIS . 15.3 mt -78.88 -42.8 26.4 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.293 -0.88 . . . . 0.0 109.985 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.763 ' CD2' ' HB2' ' A' ' 15' ' ' LEU . 7.3 m-70 -119.32 86.75 2.61 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.416 -0.803 . . . . 0.0 110.368 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -179.47 171.1 42.83 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -96.86 162.7 13.29 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.239 -1.153 . . . . 0.0 110.495 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -109.78 132.15 54.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.368 -0.833 . . . . 0.0 110.532 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.661 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -147.3 167.91 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.4 -0.812 . . . . 0.0 109.932 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.493 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 7.0 t80 -120.04 120.44 36.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.131 -0.981 . . . . 0.0 110.178 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.758 HD11 ' CD2' ' A' ' 29' ' ' TYR . 11.1 mt -83.7 136.1 34.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.154 -0.966 . . . . 0.0 110.862 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.657 HG11 ' HB3' ' A' ' 2' ' ' SER . 14.8 p -88.66 -29.5 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.466 -0.771 . . . . 0.0 110.1 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -78.63 -21.86 47.81 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.178 -0.951 . . . . 0.0 108.752 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.574 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -134.34 61.13 1.68 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 178.65 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.47 ' C ' ' O ' ' A' ' 25' ' ' MET . 7.3 p -28.89 85.53 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.523 0.678 . . . . 0.0 111.906 -178.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.574 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -161.35 164.74 29.84 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.613 -0.679 . . . . 0.0 109.633 179.522 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -79.51 91.95 5.22 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.407 -0.808 . . . . 0.0 109.701 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.758 ' CD2' HD11 ' A' ' 22' ' ' LEU . 5.9 t80 -79.8 135.6 36.52 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.414 -0.804 . . . . 0.0 109.826 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.526 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -122.23 117.11 25.38 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.092 -1.005 . . . . 0.0 110.591 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.479 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -80.41 136.74 36.41 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.177 -0.952 . . . . 0.0 109.413 179.16 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 6.3 m -80.38 166.25 21.46 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.178 -0.951 . . . . 0.0 109.764 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.521 ' O ' ' N ' ' A' ' 35' ' ' GLY . 17.9 tt0 -78.41 110.06 13.14 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.122 -0.986 . . . . 0.0 108.772 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' A' ' 33' ' ' GLU . 26.0 t -37.49 93.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 CA-C-O 121.422 0.63 . . . . 0.0 110.412 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.754 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 149.87 -15.17 1.04 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.505 ' CD2' ' O ' ' A' ' 43' ' ' HIS . 1.5 m-85 -80.51 173.95 12.09 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.177 -1.19 . . . . 0.0 110.198 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.796 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.6 OUTLIER -125.47 45.68 2.54 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.055 -1.028 . . . . 0.0 110.835 -179.745 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.444 ' HA3' ' CE1' ' A' ' 43' ' ' HIS . . . -160.03 153.42 24.39 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.3 p -88.23 20.03 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.269 -1.136 . . . . 0.0 109.761 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.594 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 3.1 tmm_? -125.25 -16.78 5.85 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.442 -0.787 . . . . 0.0 110.073 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.8 m 69.79 83.76 0.15 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.312 -0.868 . . . . 0.0 109.919 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.594 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -156.72 -31.11 0.09 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.388 -0.82 . . . . 0.0 111.247 -179.738 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.796 ' CD2' HG23 ' A' ' 37' ' ' THR . 15.8 p-80 -123.89 123.65 40.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.634 -1.291 . . . . 0.0 111.084 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.628 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 28.1 t80 -82.9 105.82 14.21 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.129 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -65.03 -16.16 63.14 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.187 -0.945 . . . . 0.0 109.778 -179.781 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.754 HD12 ' O ' ' A' ' 35' ' ' GLY . 5.7 mt . . . . . 0 N--CA 1.488 1.459 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.28 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 75.3 t . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 121.248 0.547 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.652 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -94.28 108.1 20.0 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 110.239 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 1.033 HD11 HD12 ' A' ' 20' ' ' ILE . 2.5 tt -133.44 161.16 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.296 -0.877 . . . . 0.0 110.194 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.468 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.2 OUTLIER -126.94 -177.99 4.24 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.209 -0.932 . . . . 0.0 110.326 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.77 171.24 7.61 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.226 -0.921 . . . . 0.0 110.275 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 64.4 m -107.25 -163.08 0.88 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.286 -0.884 . . . . 0.0 110.223 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.56 -167.08 1.67 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.322 -0.861 . . . . 0.0 110.207 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.6 t -83.61 9.27 11.89 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.164 -0.96 . . . . 0.0 110.31 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -134.36 26.09 3.8 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.226 -0.921 . . . . 0.0 110.334 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 ttm -143.94 16.03 1.74 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.262 -0.899 . . . . 0.0 110.217 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.1 p-10 -111.75 57.87 0.63 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -0.906 . . . . 0.0 110.279 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -110.81 62.12 0.29 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.435 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 64.2 t80 -160.18 -50.27 0.05 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.381 -1.07 . . . . 0.0 110.196 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -104.39 119.89 39.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.346 -0.846 . . . . 0.0 110.324 -179.785 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.533 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 5.6 mt -90.49 -48.29 7.19 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.228 -0.92 . . . . 0.0 110.127 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.577 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 11.2 m80 -103.73 69.39 0.97 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.368 -0.833 . . . . 0.0 110.25 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -174.14 -170.59 37.62 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -114.84 137.59 51.78 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.199 -1.177 . . . . 0.0 110.337 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.661 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -85.31 146.91 26.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.262 -0.899 . . . . 0.0 110.045 179.801 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.033 HD12 HD11 ' A' ' 3' ' ' ILE . 8.1 pt -159.46 -174.57 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.282 -0.886 . . . . 0.0 110.272 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 5.9 t80 -135.97 120.54 18.24 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.283 -0.885 . . . . 0.0 109.825 179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.785 HD11 ' CD2' ' A' ' 29' ' ' TYR . 13.2 mt -79.71 131.69 36.01 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.242 -0.911 . . . . 0.0 110.975 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.652 HG11 ' CB ' ' A' ' 2' ' ' SER . 7.7 p -87.49 -27.98 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 109.839 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -78.65 -20.63 49.84 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 108.739 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.562 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -140.18 63.69 1.47 Allowed 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.79 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.485 ' C ' ' O ' ' A' ' 25' ' ' MET . 20.1 p -29.12 87.55 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 121.682 0.753 . . . . 0.0 111.503 -178.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.562 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.97 148.85 15.71 Favored 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.652 -0.655 . . . . 0.0 109.371 179.937 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.518 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 7.7 p30 -64.44 105.05 0.86 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.316 -0.865 . . . . 0.0 109.762 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.944 ' CD1' HD11 ' A' ' 20' ' ' ILE . 4.9 t80 -99.75 144.66 28.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.343 -0.848 . . . . 0.0 110.018 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 42.9 m -137.44 115.33 11.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.011 -1.056 . . . . 0.0 110.581 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -80.87 114.94 20.09 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.221 -0.925 . . . . 0.0 109.683 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.471 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 91.2 m -79.6 172.99 13.03 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.21 -0.932 . . . . 0.0 110.44 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -79.44 118.41 21.3 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.371 -0.831 . . . . 0.0 109.964 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.2 t -50.87 106.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.301 -0.874 . . . . 0.0 109.763 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.665 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 143.97 -10.76 2.08 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.577 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.37 168.45 19.49 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.159 -1.2 . . . . 0.0 109.829 179.855 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.916 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.71 30.58 6.18 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.952 -1.093 . . . . 0.0 110.791 -179.742 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.12 154.61 25.66 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.496 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.6 p -84.87 44.22 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.297 -1.119 . . . . 0.0 109.759 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.575 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.55 22.58 0.18 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.461 -0.774 . . . . 0.0 109.759 -179.571 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.518 ' HG ' ' HA ' ' A' ' 14' ' ' CYS . 2.9 p 27.78 92.05 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 CA-C-O 121.387 0.613 . . . . 0.0 111.452 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -153.29 -37.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.442 -0.786 . . . . 0.0 110.278 179.833 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.916 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.9 p80 -121.92 116.48 24.45 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.194 -0.941 . . . . 0.0 110.451 179.495 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.572 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 38.0 t80 -79.89 115.47 19.5 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.477 0.656 . . . . 0.0 109.882 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.543 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -82.93 -26.24 31.62 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.295 -0.878 . . . . 0.0 110.038 -179.557 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.665 HD12 ' O ' ' A' ' 35' ' ' GLY . 4.5 mt . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.172 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.758 HG13 ' O ' ' A' ' 1' ' ' VAL . 9.9 p . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.258 0.551 . . . . 0.0 110.289 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.602 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER -109.36 100.73 9.79 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.216 -0.927 . . . . 0.0 110.222 -179.939 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.543 HD11 ' HB ' ' A' ' 20' ' ' ILE . 1.8 tt -121.42 156.3 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.266 -0.896 . . . . 0.0 110.248 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.702 ' O ' HG22 ' A' ' 20' ' ' ILE . 4.9 t -141.56 -150.59 0.32 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.334 -0.854 . . . . 0.0 110.087 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.666 ' N ' HG23 ' A' ' 4' ' ' THR . 7.6 mttt -118.18 -174.82 2.73 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.502 -0.749 . . . . 0.0 110.446 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.506 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 67.4 m -109.97 -150.04 0.45 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.344 -0.848 . . . . 0.0 110.201 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.12 -170.69 1.93 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.27 -0.893 . . . . 0.0 110.17 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.78 15.54 11.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.238 -0.913 . . . . 0.0 110.224 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -128.9 31.36 4.94 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.215 -0.928 . . . . 0.0 110.181 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.4 ttt -148.21 20.03 1.09 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.267 -0.896 . . . . 0.0 110.337 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -101.82 75.02 1.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.897 . . . . 0.0 110.145 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -136.15 20.54 3.57 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -119.49 -58.56 1.9 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.12 -1.223 . . . . 0.0 110.297 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.721 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 26.0 p -97.06 121.71 39.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.321 -0.862 . . . . 0.0 110.349 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.561 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.8 mt -90.79 -45.55 8.75 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.222 -0.924 . . . . 0.0 110.382 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.57 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 6.3 m80 -108.81 77.03 1.05 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.257 -0.902 . . . . 0.0 110.148 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -173.09 -163.61 27.1 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -123.32 135.49 54.22 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.218 -1.166 . . . . 0.0 110.209 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.506 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t -79.9 144.94 32.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -0.887 . . . . 0.0 110.11 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.751 HD12 ' CD1' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -158.18 -179.86 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.22 -0.925 . . . . 0.0 109.565 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.511 ' O ' HG13 ' A' ' 3' ' ' ILE . 17.9 t80 -144.22 128.58 17.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.886 -1.134 . . . . 0.0 110.449 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.598 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.7 mm? -85.14 130.63 34.57 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.15 -0.969 . . . . 0.0 110.789 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.602 HG11 ' CB ' ' A' ' 2' ' ' SER . 6.0 p -90.86 -25.74 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.345 -0.847 . . . . 0.0 110.564 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -78.08 -3.62 43.21 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.008 -1.057 . . . . 0.0 108.925 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.522 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -159.81 68.41 0.4 Allowed 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 179.18 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.509 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.58 91.76 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.981 0.896 . . . . 0.0 111.2 -178.409 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -160.18 147.95 16.53 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.517 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 23.1 t30 -63.21 128.71 37.09 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.373 -0.83 . . . . 0.0 110.235 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.751 ' CD1' HD12 ' A' ' 20' ' ' ILE . 6.5 t80 -122.16 116.58 24.43 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.357 -0.839 . . . . 0.0 110.108 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.721 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 1.8 m -122.57 112.69 18.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.223 -0.923 . . . . 0.0 110.142 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -80.13 102.06 9.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.173 -0.954 . . . . 0.0 109.842 179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 74.4 m -79.54 170.42 16.59 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.875 . . . . 0.0 110.041 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 32.2 tt0 -79.45 125.45 29.57 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.221 -0.924 . . . . 0.0 109.807 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.422 ' H ' HG23 ' A' ' 34' ' ' VAL . 10.5 t -66.43 -20.72 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.398 -0.814 . . . . 0.0 110.182 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.418 ' O ' HD12 ' A' ' 46' ' ' LEU . . . -66.93 -10.6 56.35 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.57 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.79 176.52 9.65 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -1.185 . . . . 0.0 109.912 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.956 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -108.64 27.48 9.37 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.907 -1.121 . . . . 0.0 110.343 179.573 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.754 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -159.29 155.59 26.68 Favored Glycine 0 N--CA 1.488 2.137 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.541 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.5 p -84.63 43.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.289 -1.124 . . . . 0.0 109.815 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -157.02 20.11 0.31 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.32 -0.862 . . . . 0.0 110.051 -179.557 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 8.9 p 29.22 91.42 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.495 0.664 . . . . 0.0 111.614 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.3 tt0 -155.56 -36.96 0.09 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.339 -0.851 . . . . 0.0 110.158 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.956 ' CD2' HG23 ' A' ' 37' ' ' THR . 30.1 p-80 -121.13 121.07 37.05 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.143 -0.973 . . . . 0.0 110.462 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.597 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 33.8 t80 -83.88 121.94 28.03 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.378 0.609 . . . . 0.0 109.839 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.566 ' HB2' HG21 ' A' ' 37' ' ' THR . 0.2 OUTLIER -92.22 -19.83 21.8 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.28 -0.888 . . . . 0.0 110.069 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.597 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.0 mt . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.327 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 1' ' ' VAL . 20.9 m . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.229 0.538 . . . . 0.0 110.21 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.425 ' H ' HG11 ' A' ' 23' ' ' VAL . 0.2 OUTLIER -96.67 62.86 1.99 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.137 -0.977 . . . . 0.0 110.469 -179.882 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.683 ' CG1' HG22 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -79.93 153.97 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.242 -0.911 . . . . 0.0 109.913 179.675 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.507 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.4 m -136.05 162.19 33.59 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.281 -0.887 . . . . 0.0 110.252 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -93.6 -178.8 4.82 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.433 -0.792 . . . . 0.0 110.099 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.546 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 15.5 m -110.97 -163.42 0.85 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.219 -0.926 . . . . 0.0 110.274 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.55 -158.84 0.9 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.271 -0.893 . . . . 0.0 110.159 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.0 p -81.77 168.65 17.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.234 -0.917 . . . . 0.0 110.121 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 46.5 23.68 0.25 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.141 -0.974 . . . . 0.0 110.345 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -120.75 -0.77 10.1 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 110.163 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -120.56 101.41 7.74 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.237 -0.914 . . . . 0.0 110.257 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -138.65 16.44 3.32 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -114.74 -53.4 2.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.313 -1.11 . . . . 0.0 110.284 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -93.62 123.11 36.72 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.295 -0.878 . . . . 0.0 110.632 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.5 mt -90.31 -42.85 10.73 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.267 -0.896 . . . . 0.0 110.315 179.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.569 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.9 m80 -109.8 88.27 2.71 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.302 -0.874 . . . . 0.0 110.165 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.13 -167.61 40.6 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -123.23 159.43 28.73 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.227 -1.16 . . . . 0.0 110.357 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.546 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.3 OUTLIER -99.94 149.21 23.66 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.231 -0.918 . . . . 0.0 110.504 -179.807 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.763 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.4 mt -155.0 -171.64 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.364 -0.835 . . . . 0.0 109.531 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.507 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 18.7 t80 -145.55 133.56 21.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.042 -1.036 . . . . 0.0 109.644 179.369 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.63 HD23 ' HB2' ' A' ' 29' ' ' TYR . 2.1 mm? -99.4 137.96 37.16 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.129 -0.982 . . . . 0.0 111.076 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.425 HG11 ' H ' ' A' ' 2' ' ' SER . 7.2 p -90.38 -26.01 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.38 -0.825 . . . . 0.0 110.52 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 25' ' ' MET . 49.0 p30 -77.9 -4.73 48.24 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.119 -0.988 . . . . 0.0 109.095 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.556 ' O ' ' N ' ' A' ' 27' ' ' GLN . 8.8 mtm -157.95 65.57 0.46 Allowed 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 179.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.474 ' C ' ' O ' ' A' ' 25' ' ' MET . 68.4 p -29.28 86.93 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 CA-C-O 121.614 0.721 . . . . 0.0 111.831 -178.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.556 ' N ' ' O ' ' A' ' 25' ' ' MET . 2.9 pt20 -160.9 174.91 13.13 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.707 -0.621 . . . . 0.0 109.405 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -79.28 146.85 32.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.345 -0.847 . . . . 0.0 110.549 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.763 ' CD1' HD12 ' A' ' 20' ' ' ILE . 8.1 t80 -129.88 108.54 10.21 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.53 -0.732 . . . . 0.0 109.592 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 5.8 m -111.72 107.77 16.97 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.104 -0.998 . . . . 0.0 110.74 -179.419 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.49 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -79.57 121.63 25.48 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.182 -0.948 . . . . 0.0 109.218 179.182 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.65 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 89.9 m -79.38 173.67 12.34 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.221 -0.925 . . . . 0.0 110.137 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -78.94 115.1 18.4 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.229 -0.919 . . . . 0.0 109.8 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.415 ' H ' HG23 ' A' ' 34' ' ' VAL . 22.0 t -51.93 100.89 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.498 -0.751 . . . . 0.0 109.883 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 151.69 -13.64 0.78 Allowed Glycine 0 N--CA 1.493 2.449 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.433 ' CZ ' ' HD1' ' A' ' 44' ' ' PHE . 1.2 m-85 -79.13 170.54 16.5 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.012 -1.287 . . . . 0.0 110.049 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.839 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -112.38 35.72 3.69 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.937 -1.102 . . . . 0.0 110.544 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.817 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.29 154.9 25.97 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.549 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.0 p -85.18 45.43 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.21 -1.171 . . . . 0.0 109.47 179.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.575 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -158.76 20.01 0.21 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.518 -0.739 . . . . 0.0 109.979 -179.179 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.65 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 2.8 p 27.12 93.56 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.577 -0.702 . . . . 0.0 111.541 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 4.4 tt0 -160.73 -35.65 0.05 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.549 -0.719 . . . . 0.0 110.323 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.839 ' CD2' HG23 ' A' ' 37' ' ' THR . 35.0 p-80 -124.15 112.55 17.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.111 -0.993 . . . . 0.0 110.652 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.433 ' HD1' ' CZ ' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -79.89 134.25 36.28 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.297 -0.877 . . . . 0.0 109.508 179.309 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.55 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -91.14 -24.05 20.08 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.362 -0.836 . . . . 0.0 110.212 -179.303 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.547 ' HG ' ' CD2' ' A' ' 45' ' ' PHE . 1.9 mt . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.277 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 69.2 t . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.24 0.543 . . . . 0.0 110.239 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.845 ' HB2' HG11 ' A' ' 23' ' ' VAL . 1.0 OUTLIER -119.74 47.42 1.73 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.258 -0.901 . . . . 0.0 110.255 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 1.089 HD11 HD12 ' A' ' 20' ' ' ILE . 6.4 tt -79.93 157.29 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.529 HG23 ' N ' ' A' ' 5' ' ' LYS . 6.4 t -142.58 -153.85 0.49 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.296 -0.877 . . . . 0.0 110.006 179.817 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.529 ' N ' HG23 ' A' ' 4' ' ' THR . 11.7 mtpt -102.73 178.61 4.52 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.394 -0.816 . . . . 0.0 110.258 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 59.6 m -105.69 -150.87 0.44 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.175 -0.953 . . . . 0.0 110.247 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.5 m -111.2 -170.03 1.57 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.209 -0.932 . . . . 0.0 110.203 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.68 13.34 8.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -0.888 . . . . 0.0 110.185 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.63 21.78 5.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.293 -0.88 . . . . 0.0 110.214 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -127.04 3.53 6.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.255 -0.903 . . . . 0.0 110.136 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.53 ' O ' ' ND2' ' A' ' 11' ' ' ASN . 0.6 OUTLIER -86.07 48.65 1.64 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.287 -0.883 . . . . 0.0 110.103 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -126.06 3.55 7.88 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -101.22 -48.49 4.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.15 -1.206 . . . . 0.0 110.27 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 22.1 p -105.16 116.18 31.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.291 -0.881 . . . . 0.0 110.63 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.596 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.6 mt -90.43 -39.05 12.87 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.301 -0.875 . . . . 0.0 110.506 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.596 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 21.3 m80 -110.73 63.11 0.61 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.109 -0.995 . . . . 0.0 110.555 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.481 ' HA3' ' SG ' ' A' ' 32' ' ' CYS . . . -173.51 -160.32 21.69 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -122.66 136.25 54.82 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.292 -1.122 . . . . 0.0 110.177 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t -84.64 146.73 27.33 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.326 -0.859 . . . . 0.0 110.449 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.089 HD12 HD11 ' A' ' 3' ' ' ILE . 5.0 pt -157.78 -170.61 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.379 -0.826 . . . . 0.0 110.104 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.474 ' O ' HG13 ' A' ' 3' ' ' ILE . 4.6 t80 -140.9 133.7 28.94 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.112 -0.993 . . . . 0.0 110.097 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.733 HD12 ' OD2' ' A' ' 24' ' ' ASP . 1.2 mm? -86.7 133.74 33.65 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.122 -0.986 . . . . 0.0 111.113 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.845 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.2 p -90.83 -25.23 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.412 -0.805 . . . . 0.0 110.67 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.733 ' OD2' HD12 ' A' ' 22' ' ' LEU . 2.9 p30 -78.64 -15.52 58.41 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.047 -1.033 . . . . 0.0 108.9 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.6 mtt -147.43 67.0 1.13 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.1 p -29.11 88.76 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.693 0.758 . . . . 0.0 111.661 -178.421 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.3 OUTLIER -160.28 173.44 15.7 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.673 -0.642 . . . . 0.0 109.561 179.643 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -77.18 136.89 38.6 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.368 -0.832 . . . . 0.0 110.522 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.877 ' CD1' HD11 ' A' ' 20' ' ' ILE . 8.6 t80 -135.82 154.42 51.19 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.461 -0.774 . . . . 0.0 109.653 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.617 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 3.0 m -153.64 123.51 6.83 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.926 -1.109 . . . . 0.0 110.94 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.412 ' HA ' ' HD3' ' A' ' 31' ' ' ARG . 15.3 tpp85 -103.04 106.72 17.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.175 -0.953 . . . . 0.0 109.093 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 27.0 m -111.27 -164.82 0.94 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.293 -0.88 . . . . 0.0 110.592 -178.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.418 ' CG ' ' H ' ' A' ' 35' ' ' GLY . 21.2 tt0 -78.24 123.05 26.49 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.244 -0.91 . . . . 0.0 109.615 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.4 t -64.5 -10.59 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.447 -0.783 . . . . 0.0 109.707 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.418 ' H ' ' CG ' ' A' ' 33' ' ' GLU . . . -68.72 -7.09 53.86 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.595 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.6 m-85 -79.46 165.13 23.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.18 -1.188 . . . . 0.0 109.407 179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . 1.037 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.61 34.0 4.22 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.878 -1.139 . . . . 0.0 111.478 -178.823 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.68 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.7 159.5 31.02 Favored Glycine 0 N--CA 1.491 2.336 0 C-N-CA 119.351 -1.404 . . . . 0.0 110.075 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -84.33 13.04 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -1.119 . . . . 0.0 109.362 178.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 28.0 ttp180 -109.08 -17.62 13.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.569 -0.707 . . . . 0.0 110.116 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 21.9 m 61.11 58.65 2.18 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.315 -0.866 . . . . 0.0 110.607 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER -136.35 -19.53 1.44 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.482 -0.761 . . . . 0.0 111.278 179.93 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 1.037 ' CD2' HG23 ' A' ' 37' ' ' THR . 17.3 p-80 -127.52 119.93 27.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.736 -1.227 . . . . 0.0 110.7 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.628 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 21.1 t80 -81.75 108.22 15.12 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.327 0.584 . . . . 0.0 109.964 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.564 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -64.61 -15.9 61.87 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.222 -0.924 . . . . 0.0 109.912 -179.773 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.628 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.0 mt . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.27 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.232 0.539 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 1.028 ' CB ' HG11 ' A' ' 23' ' ' VAL . 48.3 m -129.44 85.92 2.37 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.243 -0.91 . . . . 0.0 110.147 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.826 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.8 OUTLIER -139.18 153.0 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.297 -0.877 . . . . 0.0 110.043 -179.954 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -132.83 162.23 32.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.261 -0.899 . . . . 0.0 110.425 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -101.93 168.16 9.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.335 -0.853 . . . . 0.0 110.129 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.723 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 58.4 m -108.83 -145.66 0.4 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.227 -0.92 . . . . 0.0 110.253 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.495 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.3 OUTLIER -153.79 -158.27 0.85 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.311 -0.868 . . . . 0.0 110.062 179.877 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.495 ' N ' ' OG ' ' A' ' 7' ' ' SER . 3.0 t -80.5 168.62 18.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.154 -0.966 . . . . 0.0 110.231 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.6 t0 47.88 22.86 0.4 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.097 -1.002 . . . . 0.0 110.286 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.19 8.17 8.53 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.326 -0.859 . . . . 0.0 110.176 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.428 ' ND2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -114.75 -142.72 0.38 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.285 -0.885 . . . . 0.0 110.04 -179.98 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 116.94 -0.17 19.62 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.426 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 65.2 t80 -110.48 -51.35 2.88 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.222 -1.163 . . . . 0.0 110.132 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.532 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.2 p -96.67 120.74 37.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.307 -0.871 . . . . 0.0 110.163 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.596 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 10.8 mt -88.17 -40.96 13.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.201 -0.937 . . . . 0.0 110.377 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.596 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.1 m80 -114.2 80.3 1.37 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.216 -0.928 . . . . 0.0 110.037 -179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.507 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -179.74 -168.25 38.25 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -115.04 167.55 10.71 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.298 -1.119 . . . . 0.0 110.283 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.723 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 1.3 t -103.68 126.36 50.77 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.394 -0.816 . . . . 0.0 110.378 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.885 HD13 ' HD2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -130.25 -172.9 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.322 -0.861 . . . . 0.0 109.555 -179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.507 ' O ' HD12 ' A' ' 3' ' ' ILE . 14.5 t80 -145.82 142.85 29.23 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.894 -1.129 . . . . 0.0 110.19 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.622 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.2 mm? -104.14 136.64 43.38 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.108 -0.995 . . . . 0.0 111.37 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 1.028 HG11 ' CB ' ' A' ' 2' ' ' SER . 14.7 p -90.78 -27.69 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.352 -0.842 . . . . 0.0 110.556 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -78.77 -19.04 53.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.035 -1.041 . . . . 0.0 108.839 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -138.84 63.6 1.51 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.735 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.486 ' C ' ' O ' ' A' ' 25' ' ' MET . 11.5 p -28.75 89.03 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.679 0.752 . . . . 0.0 111.543 -178.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 5.5 pt20 -159.73 176.74 11.61 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.609 -0.682 . . . . 0.0 109.73 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -88.09 115.94 25.92 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.495 -0.753 . . . . 0.0 110.352 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.885 ' HD2' HD13 ' A' ' 20' ' ' ILE . 28.7 t80 -91.08 157.03 17.47 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.493 -0.755 . . . . 0.0 109.73 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.532 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -141.15 112.85 7.64 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.067 -1.02 . . . . 0.0 110.403 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.772 ' H ' HD11 ' A' ' 20' ' ' ILE . 11.1 tpp180 -88.66 115.77 26.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.262 -0.898 . . . . 0.0 109.479 179.485 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.504 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 91.4 m -79.05 170.12 17.15 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.281 -0.887 . . . . 0.0 110.391 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -79.44 113.97 18.0 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.316 -0.865 . . . . 0.0 110.143 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.411 HG23 ' H ' ' A' ' 34' ' ' VAL . 47.4 t -48.12 104.62 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.362 -0.836 . . . . 0.0 109.786 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.92 -9.18 2.27 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.525 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.41 175.58 10.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.13 -1.217 . . . . 0.0 109.832 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -116.95 13.14 14.85 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.025 -1.047 . . . . 0.0 110.818 -179.583 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -128.74 161.73 22.36 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.641 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.3 p -87.67 31.55 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.298 -1.119 . . . . 0.0 109.743 179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.37 29.62 0.16 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.332 -0.855 . . . . 0.0 109.962 -179.655 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.504 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 8.1 p 31.76 90.8 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.616 -0.677 . . . . 0.0 111.13 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 4.0 tm-20 -154.02 -39.88 0.09 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.295 -0.878 . . . . 0.0 110.098 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.2 p-80 -117.21 128.49 55.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.093 -1.004 . . . . 0.0 110.202 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.588 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 34.9 t80 -88.62 130.49 35.27 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.436 0.636 . . . . 0.0 110.528 -178.549 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -93.48 -36.8 12.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.409 -0.807 . . . . 0.0 110.001 -179.741 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.588 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.379 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.511 ' O ' HG22 ' A' ' 1' ' ' VAL . 11.8 p . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.272 0.558 . . . . 0.0 110.273 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.687 ' HB3' HG11 ' A' ' 23' ' ' VAL . 3.7 t -149.48 84.09 1.42 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.152 -0.967 . . . . 0.0 110.376 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.884 HG12 HG22 ' A' ' 20' ' ' ILE . 5.5 tt -80.03 -178.25 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.209 -0.932 . . . . 0.0 110.003 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -155.19 160.74 41.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.238 -0.914 . . . . 0.0 110.246 -179.896 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.5 mtmm -110.36 161.93 15.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.297 -0.877 . . . . 0.0 110.218 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.1 m -103.73 -144.64 0.37 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.269 -0.895 . . . . 0.0 110.101 179.991 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB3' ' HB2' ' A' ' 10' ' ' MET . 0.5 OUTLIER -127.61 -154.43 0.63 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.183 -0.948 . . . . 0.0 110.214 179.943 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.3 m -82.35 -61.1 1.99 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.245 -0.909 . . . . 0.0 110.18 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -91.51 27.65 1.93 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.227 -0.92 . . . . 0.0 110.182 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.42 ' HB2' ' HB3' ' A' ' 7' ' ' SER . 0.0 OUTLIER -108.97 -11.83 14.93 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.274 -0.891 . . . . 0.0 110.217 -180.0 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 11' ' ' ASN . 7.7 p-10 -132.77 96.85 3.9 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.307 -0.87 . . . . 0.0 110.202 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.17 52.73 0.67 Allowed Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -121.79 -59.36 1.68 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -1.151 . . . . 0.0 110.184 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -87.75 118.75 27.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 110.296 -179.877 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.744 ' HB2' ' CD2' ' A' ' 16' ' ' HIS . 11.2 mt -78.72 -43.01 26.81 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.303 -0.873 . . . . 0.0 110.288 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.744 ' CD2' ' HB2' ' A' ' 15' ' ' LEU . 14.7 m-70 -116.99 77.54 1.13 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.329 -0.857 . . . . 0.0 110.496 -178.919 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.441 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -175.85 167.71 39.64 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.832 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -89.96 145.55 25.03 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -1.209 . . . . 0.0 110.27 179.956 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 15.9 t -88.9 142.6 27.51 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.331 -0.856 . . . . 0.0 110.349 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.884 HG22 HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -158.74 -175.44 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.314 -0.866 . . . . 0.0 109.697 179.979 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.51 ' O ' HG13 ' A' ' 3' ' ' ILE . 9.4 t80 -152.68 123.27 7.29 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.037 -1.039 . . . . 0.0 109.963 -179.852 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.667 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.9 mm? -82.16 130.98 35.23 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.214 -0.929 . . . . 0.0 111.048 -179.366 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.687 HG11 ' HB3' ' A' ' 2' ' ' SER . 7.7 p -90.39 -23.81 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.298 -0.876 . . . . 0.0 110.42 179.518 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.39 -10.23 59.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.067 -1.021 . . . . 0.0 108.771 178.9 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.547 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.5 mpp? -150.86 69.0 0.96 Allowed 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.466 ' C ' ' O ' ' A' ' 25' ' ' MET . 6.9 p -29.49 87.64 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 121.575 0.702 . . . . 0.0 111.91 -178.183 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 tt0 -158.67 154.1 25.86 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.703 -0.623 . . . . 0.0 109.85 179.595 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.97 127.35 32.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.468 -0.77 . . . . 0.0 110.232 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.799 ' CD1' HD12 ' A' ' 20' ' ' ILE . 15.5 t80 -116.57 123.6 47.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.313 -0.867 . . . . 0.0 109.965 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 5.8 m -125.67 118.58 25.93 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.154 -0.966 . . . . 0.0 110.38 -179.78 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.464 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 5.1 tpp85 -79.43 124.85 28.84 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.218 -0.926 . . . . 0.0 109.421 179.551 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.8 m -79.4 160.4 26.68 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.214 -0.929 . . . . 0.0 109.528 -179.782 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' GLY . 16.2 tt0 -78.79 110.34 13.87 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.072 -1.017 . . . . 0.0 109.411 179.764 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.433 ' C ' ' O ' ' A' ' 33' ' ' GLU . 40.3 t -41.61 94.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.541 -0.724 . . . . 0.0 110.244 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.825 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 152.9 -17.67 0.73 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.868 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.493 ' HH ' ' CG ' ' A' ' 16' ' ' HIS . 2.1 m-85 -79.92 165.97 22.11 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.192 -1.181 . . . . 0.0 110.216 -179.937 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.914 HG23 ' NE2' ' A' ' 43' ' ' HIS . 6.1 t -120.28 35.21 4.94 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 119.103 -1.039 . . . . 0.0 110.902 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.563 ' HA3' ' CE1' ' A' ' 43' ' ' HIS . . . -140.6 153.87 23.87 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 179.721 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.692 HG12 ' O ' ' A' ' 39' ' ' VAL . 43.1 t -85.2 14.05 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.356 -1.085 . . . . 0.0 109.782 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.576 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 2.1 tmm_? -127.9 -15.14 4.91 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.455 -0.778 . . . . 0.0 110.399 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.1 m 71.75 85.59 0.12 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.389 -0.819 . . . . 0.0 109.719 -179.679 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.576 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -152.42 -31.33 0.14 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.638 -0.664 . . . . 0.0 110.715 -179.805 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.914 ' NE2' HG23 ' A' ' 37' ' ' THR . 21.6 p-80 -123.64 118.79 28.09 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.891 -1.131 . . . . 0.0 110.729 179.522 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.612 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 24.6 t80 -80.62 104.06 10.89 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.307 0.575 . . . . 0.0 109.9 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.562 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -64.85 -22.21 66.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.206 -0.934 . . . . 0.0 109.95 -179.774 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.825 HD12 ' O ' ' A' ' 35' ' ' GLY . 4.4 mt . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.139 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.434 ' CG1' HG22 ' A' ' 3' ' ' ILE . 87.2 t . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.294 0.569 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.571 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -125.77 45.49 2.6 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.283 -0.886 . . . . 0.0 110.116 -179.984 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.793 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -143.97 153.62 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.325 -0.86 . . . . 0.0 110.342 -179.769 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.485 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -131.15 173.97 10.5 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.238 -0.914 . . . . 0.0 110.251 179.906 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -106.75 165.14 11.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.234 -0.916 . . . . 0.0 110.149 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.629 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 60.7 m -102.11 -141.17 0.35 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.254 -0.904 . . . . 0.0 110.216 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.5 t -141.25 -160.91 1.13 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.28 -0.888 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.2 28.5 1.41 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.26 -0.9 . . . . 0.0 110.241 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.34 30.85 1.54 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.228 -0.92 . . . . 0.0 110.177 179.962 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -145.44 14.56 1.43 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.97 . . . . 0.0 110.245 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -109.83 75.28 0.93 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.177 -0.952 . . . . 0.0 110.234 -179.967 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.32 -7.47 6.38 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -95.57 -60.28 1.69 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.281 -1.129 . . . . 0.0 110.076 -179.996 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.555 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.1 p -83.89 126.66 33.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.334 -0.854 . . . . 0.0 110.136 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.56 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.5 mt -90.58 -45.72 8.74 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.138 -0.976 . . . . 0.0 110.333 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.56 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.1 m80 -109.33 77.49 1.07 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.257 -0.902 . . . . 0.0 110.233 -179.573 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.484 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -174.5 -163.49 27.86 Favored Glycine 0 N--CA 1.488 2.16 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -128.73 153.15 47.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.328 -1.101 . . . . 0.0 110.285 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.629 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -83.07 152.45 25.35 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.305 -0.872 . . . . 0.0 110.124 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.845 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -153.62 -173.99 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.144 -0.973 . . . . 0.0 109.603 -179.894 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.485 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 23.0 t80 -147.41 133.0 18.76 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.038 -1.039 . . . . 0.0 110.162 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.626 HD22 HD12 ' A' ' 3' ' ' ILE . 1.4 mm? -94.7 134.64 37.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.254 -0.904 . . . . 0.0 110.468 -179.882 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.571 HG11 ' CB ' ' A' ' 2' ' ' SER . 8.1 p -90.38 -27.16 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.344 -0.848 . . . . 0.0 110.599 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' A' ' 25' ' ' MET . 11.2 p30 -78.16 -15.13 59.12 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.106 -0.996 . . . . 0.0 108.757 179.362 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.3 ttm -144.74 65.56 1.27 Allowed 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.852 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 19.8 p -29.05 88.7 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 121.629 0.728 . . . . 0.0 111.751 -178.321 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 7.1 pt20 -160.38 176.15 12.0 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.627 -0.671 . . . . 0.0 109.601 179.488 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -81.68 138.82 35.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.452 -179.836 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.845 ' CD1' HD12 ' A' ' 20' ' ' ILE . 17.7 t80 -128.15 117.32 21.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.372 -0.83 . . . . 0.0 109.838 179.861 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.555 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -114.06 117.39 31.14 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.08 -1.013 . . . . 0.0 110.621 -179.671 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.484 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.0 ttm180 -91.78 129.8 37.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.945 . . . . 0.0 109.749 179.433 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.502 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 71.9 m -79.4 175.12 10.89 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.279 -0.888 . . . . 0.0 110.241 -179.869 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -79.81 112.85 17.49 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -0.891 . . . . 0.0 109.854 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.423 HG23 ' H ' ' A' ' 34' ' ' VAL . 43.4 t -47.27 105.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.361 -0.837 . . . . 0.0 109.887 -179.94 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.47 -8.89 2.37 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.743 -1.343 . . . . 0.0 109.743 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.477 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.33 176.07 10.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.116 -1.226 . . . . 0.0 110.056 179.963 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.608 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -115.12 31.31 6.78 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.119 -0.988 . . . . 0.0 110.378 -179.49 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.06 155.31 26.43 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.519 ' O ' HG22 ' A' ' 39' ' ' VAL . 12.5 p -84.76 43.07 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.275 -1.133 . . . . 0.0 109.789 179.61 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.568 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.27 22.21 0.16 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.412 -0.805 . . . . 0.0 109.918 -179.537 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.502 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 6.6 p 28.95 92.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.697 -0.627 . . . . 0.0 111.472 179.767 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.4 OUTLIER -154.2 -42.85 0.09 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.378 -0.826 . . . . 0.0 110.139 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.608 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.4 p-80 -118.24 127.75 54.03 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.09 -1.006 . . . . 0.0 110.364 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.604 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 37.6 t80 -86.86 128.07 35.04 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.387 0.613 . . . . 0.0 110.508 -178.65 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -92.59 -35.2 13.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.385 -0.822 . . . . 0.0 109.964 -179.758 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.604 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.22 -179.713 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.419 ' O ' HG13 ' A' ' 1' ' ' VAL . 9.3 p . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.254 0.549 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.534 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -147.26 147.16 30.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.916 . . . . 0.0 110.173 179.946 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.705 HD11 ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -147.8 156.73 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.28 -0.887 . . . . 0.0 110.161 -179.948 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.496 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.8 m -133.43 164.32 27.4 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.294 -0.879 . . . . 0.0 110.158 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 19' ' ' CYS . 10.6 tttt -126.41 155.05 42.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.205 -0.935 . . . . 0.0 110.181 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.2 m -99.91 -146.14 0.34 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.255 -0.903 . . . . 0.0 110.227 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.5 t -122.23 -164.42 1.16 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.294 -0.879 . . . . 0.0 110.221 179.912 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -87.13 11.52 13.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.227 -0.92 . . . . 0.0 110.321 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -121.98 26.35 8.63 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.24 -0.913 . . . . 0.0 110.188 179.938 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.4 14.16 4.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.297 -0.877 . . . . 0.0 110.138 179.935 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -102.47 66.5 0.98 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.931 . . . . 0.0 110.269 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.26 26.26 10.62 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -145.86 -55.8 0.29 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -1.133 . . . . 0.0 110.249 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.553 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.4 p -90.51 127.34 36.21 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.26 -0.9 . . . . 0.0 110.354 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.67 ' N ' HD23 ' A' ' 15' ' ' LEU . 3.5 mt -90.52 -44.88 9.29 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.231 -0.918 . . . . 0.0 110.344 179.885 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 18.0 m80 -110.51 89.38 3.01 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.318 -0.864 . . . . 0.0 110.487 -179.168 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.474 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.23 -161.46 31.55 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 179.931 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -134.14 149.3 51.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.292 -1.122 . . . . 0.0 110.229 179.881 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.3 t -79.9 120.29 23.93 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.216 -0.928 . . . . 0.0 110.027 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.705 ' CG2' HD11 ' A' ' 3' ' ' ILE . 21.2 mm -122.32 168.64 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 110.224 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.496 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 18.3 t80 -139.47 129.94 25.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 109.994 -179.988 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.608 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 3.6 mm? -90.06 134.42 34.26 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.214 -0.929 . . . . 0.0 110.638 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.534 HG11 ' HB3' ' A' ' 2' ' ' SER . 11.3 p -90.48 -25.58 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.269 -0.894 . . . . 0.0 110.541 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -78.34 -14.45 59.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.086 -1.009 . . . . 0.0 108.82 179.323 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.3 ttm -147.47 66.66 1.13 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.992 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 58.8 p -29.21 88.57 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.675 0.75 . . . . 0.0 111.467 -178.437 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.39 146.38 15.26 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.493 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -55.81 161.55 2.15 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.132 -0.98 . . . . 0.0 110.388 -179.711 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.608 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 5.9 t80 -154.59 86.31 1.14 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.402 -0.811 . . . . 0.0 109.906 -179.908 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.553 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.2 m -82.8 104.71 13.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.188 -0.945 . . . . 0.0 110.53 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.494 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 11.5 tpp85 -81.7 123.17 28.5 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.212 -0.93 . . . . 0.0 110.118 179.698 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.494 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 97.7 m -79.79 172.78 13.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.328 -0.858 . . . . 0.0 110.145 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -79.81 128.81 33.88 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.891 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.3 t -58.54 105.84 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.249 -0.907 . . . . 0.0 110.084 -179.937 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 1.019 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 145.17 -14.16 1.88 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.716 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.589 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.2 m-85 -79.75 154.24 28.67 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.344 -1.092 . . . . 0.0 109.903 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.952 HG23 ' NE2' ' A' ' 43' ' ' HIS . 5.1 t -109.42 46.58 0.99 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.954 -1.092 . . . . 0.0 110.782 -179.762 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.2 156.18 27.4 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.693 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.651 ' O ' HG22 ' A' ' 39' ' ' VAL . 10.6 p -87.11 37.2 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.261 -1.141 . . . . 0.0 109.753 179.609 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.593 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.09 22.36 0.16 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.418 -0.801 . . . . 0.0 109.839 -179.483 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.486 ' C ' ' O ' ' A' ' 40' ' ' ARG . 4.2 p 29.74 91.5 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.609 -0.682 . . . . 0.0 111.645 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.593 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 0.7 OUTLIER -144.92 -36.91 0.3 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.552 -0.717 . . . . 0.0 109.906 179.382 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.952 ' NE2' HG23 ' A' ' 37' ' ' THR . 19.5 p-80 -124.21 117.78 25.35 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.164 -0.96 . . . . 0.0 109.9 178.798 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.615 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 46.2 t80 -79.58 103.09 9.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.73 -0.606 . . . . 0.0 110.218 -179.365 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.584 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -65.85 -28.47 69.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.43 -0.794 . . . . 0.0 110.15 -179.763 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 1.019 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.6 mt . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.342 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 12.9 p . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.313 0.578 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -151.26 129.77 12.17 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.194 -0.941 . . . . 0.0 110.201 179.979 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.548 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.7 tt -122.95 155.52 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.34 -0.85 . . . . 0.0 110.167 -179.997 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.537 ' CB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -119.77 -167.8 1.49 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.128 -0.983 . . . . 0.0 110.32 -179.959 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.4 mttp -126.36 -179.89 4.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.214 -0.929 . . . . 0.0 110.468 -179.825 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.71 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 1.9 m -114.95 -161.25 0.77 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.288 -0.882 . . . . 0.0 110.18 179.972 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.7 t -132.29 -144.84 0.25 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.121 -0.987 . . . . 0.0 110.442 -179.826 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 79.4 p -79.61 2.74 21.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.308 -0.87 . . . . 0.0 110.392 -179.821 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -96.93 28.41 3.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 109.868 179.849 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.494 ' HG3' ' HB2' ' A' ' 19' ' ' CYS . 8.9 tmm? -116.75 5.4 13.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.395 -0.816 . . . . 0.0 110.323 -179.676 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -90.02 60.74 4.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.207 -0.933 . . . . 0.0 109.923 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -157.17 -36.06 0.02 OUTLIER Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.576 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 43.4 t80 -93.86 -54.99 3.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.149 -1.206 . . . . 0.0 110.698 -179.692 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.577 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 19.2 p -117.83 117.07 28.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.081 -1.012 . . . . 0.0 110.607 -179.641 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.591 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 17.5 mt -91.33 -50.28 5.9 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.391 -0.818 . . . . 0.0 110.449 179.725 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 6.8 m80 -98.45 79.03 2.46 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.498 -0.751 . . . . 0.0 110.342 -178.813 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.46 163.85 26.98 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -94.33 143.87 26.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.282 -1.128 . . . . 0.0 109.916 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.772 ' C ' HD13 ' A' ' 20' ' ' ILE . 8.1 t -98.68 153.01 19.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.2 -0.938 . . . . 0.0 110.571 -179.747 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.805 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -159.88 -174.51 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.491 -0.755 . . . . 0.0 109.9 -179.932 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.537 ' HB3' ' CB ' ' A' ' 4' ' ' THR . 15.1 t80 -133.21 129.46 37.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.198 -0.938 . . . . 0.0 110.1 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.662 HD23 ' CB ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -87.52 131.38 34.39 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.153 -0.967 . . . . 0.0 110.782 -179.714 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.9 p -90.7 -26.74 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.24 -0.913 . . . . 0.0 110.602 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -78.12 -14.52 59.45 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.111 -0.993 . . . . 0.0 108.927 179.264 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.537 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.3 mtt -148.19 67.32 1.09 Allowed 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.862 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.456 ' C ' ' O ' ' A' ' 25' ' ' MET . 64.1 p -29.87 87.83 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.59 0.71 . . . . 0.0 111.968 -178.446 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -158.18 165.43 34.93 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.583 -0.698 . . . . 0.0 109.843 179.497 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.43 113.48 14.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.485 -0.76 . . . . 0.0 110.441 -179.738 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.662 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.0 t80 -101.53 117.34 34.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.397 -0.815 . . . . 0.0 109.53 179.642 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.577 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.1 m -117.47 112.76 21.08 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.122 -0.986 . . . . 0.0 110.852 -179.181 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.494 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.4 tpp85 -86.97 110.17 19.86 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.309 -0.87 . . . . 0.0 109.629 179.267 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 84.9 m -79.53 -179.84 7.07 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.171 -0.956 . . . . 0.0 110.382 -179.602 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -82.72 115.85 21.83 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.28 -0.888 . . . . 0.0 110.291 -179.809 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.7 t -52.21 105.9 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.299 -0.876 . . . . 0.0 109.611 179.701 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 139.42 -4.7 2.84 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.782 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.605 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.27 163.92 24.54 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.019 -1.283 . . . . 0.0 109.567 179.756 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 37' ' ' THR . . . . . 1.066 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -97.71 27.22 4.51 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.832 -1.167 . . . . 0.0 110.077 -179.834 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.532 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.09 152.94 23.85 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 179.545 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.592 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.9 p -84.15 44.0 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.198 -1.178 . . . . 0.0 109.952 -179.969 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.587 ' NH1' ' CG ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -160.14 20.29 0.16 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.307 -0.871 . . . . 0.0 110.531 -179.537 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.8 p 33.54 93.66 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.576 -0.702 . . . . 0.0 111.792 179.926 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.587 ' CG ' ' NH1' ' A' ' 40' ' ' ARG . 1.7 tm-20 -151.13 -40.32 0.12 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.531 -0.73 . . . . 0.0 109.655 179.127 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 1.066 ' CD2' HG23 ' A' ' 37' ' ' THR . 14.9 p-80 -122.82 112.43 17.88 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.911 0.862 . . . . 0.0 108.714 178.622 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 20.4 t80 -78.54 108.7 12.11 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.674 0.75 . . . . 0.0 110.126 -178.441 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.556 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -66.15 -9.75 34.52 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.431 0.634 . . . . 0.0 109.982 -179.492 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.618 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.9 mt . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.203 -179.718 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 88.4 t . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.083 0.468 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.447 ' HB3' ' CG1' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -122.54 51.2 1.41 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.226 -0.921 . . . . 0.0 110.172 179.828 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.558 HD11 ' HB ' ' A' ' 20' ' ' ILE . 1.1 tt -138.8 154.69 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.277 -0.89 . . . . 0.0 110.146 -179.95 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.2 m -127.73 161.52 28.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 -179.991 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.03 178.79 7.71 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.272 -0.892 . . . . 0.0 110.31 -179.903 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.846 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 68.7 m -109.66 -147.53 0.42 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.253 -0.905 . . . . 0.0 110.075 179.936 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 t -133.99 -167.64 1.99 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.255 -0.903 . . . . 0.0 110.119 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.6 t -83.96 12.69 5.84 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.267 -0.896 . . . . 0.0 110.274 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -132.25 23.98 4.49 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.299 -0.876 . . . . 0.0 110.253 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -121.82 -5.27 9.11 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.246 -0.909 . . . . 0.0 110.213 -179.976 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.484 ' O ' ' ND2' ' A' ' 11' ' ' ASN . 0.6 OUTLIER -90.88 54.16 2.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.277 -0.89 . . . . 0.0 110.272 -179.998 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -119.43 0.44 14.16 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -106.92 -64.92 1.13 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.197 -1.178 . . . . 0.0 110.26 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.2 p -84.53 124.54 31.51 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.209 -0.932 . . . . 0.0 110.351 -179.926 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.598 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.5 mt -90.07 -44.36 9.87 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.269 -0.895 . . . . 0.0 110.273 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.598 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 3.6 m80 -114.62 92.04 3.82 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.29 -0.881 . . . . 0.0 110.159 -179.719 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.467 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.53 -169.43 42.4 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.997 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -110.49 143.91 40.11 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.28 -1.129 . . . . 0.0 110.165 179.853 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.846 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 1.0 OUTLIER -95.92 128.69 43.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.316 -0.865 . . . . 0.0 110.419 -179.903 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.8 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -146.46 -171.82 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.305 -0.872 . . . . 0.0 110.008 179.878 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.439 ' O ' HG13 ' A' ' 3' ' ' ILE . 17.5 t80 -142.83 135.13 27.46 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.334 -0.854 . . . . 0.0 109.811 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.629 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.4 mm? -87.62 129.61 35.06 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.046 -1.034 . . . . 0.0 110.839 -179.589 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.447 ' CG1' ' HB3' ' A' ' 2' ' ' SER . 8.9 p -90.71 -24.98 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.247 -0.908 . . . . 0.0 110.454 179.746 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -78.31 -12.13 59.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.994 -1.066 . . . . 0.0 108.802 179.206 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.0 OUTLIER -151.78 68.83 0.9 Allowed 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 178.915 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 56.0 p -29.19 89.78 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.791 0.805 . . . . 0.0 111.412 -178.545 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.531 ' HG3' ' N ' ' A' ' 28' ' ' ASN . 1.5 tt0 -159.88 148.13 17.16 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.621 -0.674 . . . . 0.0 109.562 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.531 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 15.9 p30 -61.46 126.46 27.43 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.253 -0.904 . . . . 0.0 110.42 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.629 ' CB ' HD23 ' A' ' 22' ' ' LEU . 9.8 t80 -118.85 133.82 55.58 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.35 -0.844 . . . . 0.0 109.705 179.696 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -135.95 113.92 11.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.096 -1.002 . . . . 0.0 110.594 -179.561 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.467 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.2 tpp180 -81.78 106.07 13.42 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.215 -0.928 . . . . 0.0 109.587 179.373 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 94.1 m -79.49 171.34 15.29 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.255 -0.903 . . . . 0.0 110.186 -179.763 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.423 ' CG ' ' H ' ' A' ' 35' ' ' GLY . 15.4 tt0 -78.91 129.45 34.53 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.222 -0.924 . . . . 0.0 109.662 179.873 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.407 HG23 ' H ' ' A' ' 34' ' ' VAL . 11.8 t -66.12 -14.72 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.332 -0.855 . . . . 0.0 110.287 -179.542 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.423 ' H ' ' CG ' ' A' ' 33' ' ' GLU . . . -69.17 -17.42 72.01 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.836 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.491 ' CE1' ' N ' ' A' ' 43' ' ' HIS . 1.5 m-85 -79.92 166.39 21.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.326 -1.102 . . . . 0.0 110.065 179.828 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.759 HG23 ' NE2' ' A' ' 43' ' ' HIS . 14.2 t -102.39 29.22 5.33 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.979 -1.076 . . . . 0.0 110.516 -179.788 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.467 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -160.42 160.28 31.63 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 179.778 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.545 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.8 p -84.7 43.73 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.121 -1.223 . . . . 0.0 109.897 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.567 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -148.99 12.18 0.85 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.381 -0.825 . . . . 0.0 110.279 -179.384 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 6.9 p 32.05 87.85 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.608 -0.683 . . . . 0.0 110.493 -179.67 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.567 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 2.1 tt0 -160.32 -33.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.214 -0.929 . . . . 0.0 111.023 -179.515 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.759 ' NE2' HG23 ' A' ' 37' ' ' THR . 23.8 p-80 -126.72 119.25 26.49 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.708 -1.245 . . . . 0.0 111.937 -179.677 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.546 ' CE2' ' C ' ' A' ' 46' ' ' LEU . 44.4 t80 -87.24 92.15 8.96 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.091 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.869 ' CE2' HD11 ' A' ' 46' ' ' LEU . 0.4 OUTLIER -66.85 -5.39 12.17 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.443 -0.786 . . . . 0.0 110.72 -179.012 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.869 HD11 ' CE2' ' A' ' 45' ' ' PHE . 2.2 mm? . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.072 -1.018 . . . . 0.0 110.192 -179.865 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 61.7 t . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.229 0.538 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.53 ' HA ' ' CB ' ' A' ' 23' ' ' VAL . 1.0 OUTLIER -160.04 -160.43 0.8 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.235 -0.915 . . . . 0.0 110.145 -179.95 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.475 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 2.2 tt -79.56 148.6 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.266 -0.896 . . . . 0.0 110.341 179.975 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -160.98 -178.32 6.72 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.297 -0.877 . . . . 0.0 110.636 179.68 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -97.8 -178.71 4.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.465 -0.772 . . . . 0.0 110.27 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 49.0 m -98.13 -93.98 0.23 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.274 -0.891 . . . . 0.0 110.287 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.45 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 172.45 -167.2 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.097 -1.002 . . . . 0.0 110.122 -179.927 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.426 ' O ' ' N ' ' A' ' 10' ' ' MET . 6.6 t -80.1 169.63 17.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -0.904 . . . . 0.0 110.096 179.927 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 8' ' ' SER . 25.7 t70 43.13 26.25 0.08 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.146 -0.971 . . . . 0.0 110.214 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.426 ' N ' ' O ' ' A' ' 8' ' ' SER . 1.3 ttt -123.6 3.03 8.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.247 -0.908 . . . . 0.0 110.226 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.588 ' ND2' ' SG ' ' A' ' 14' ' ' CYS . 2.7 m120 -101.97 70.42 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.896 . . . . 0.0 110.035 179.883 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.61 -24.29 14.08 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.871 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -86.7 -64.32 1.17 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.171 -1.194 . . . . 0.0 110.112 -179.989 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -81.34 119.45 23.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.287 -0.883 . . . . 0.0 110.382 -179.677 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.578 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 5.5 mt -90.62 -46.15 8.46 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.196 -0.94 . . . . 0.0 110.676 -179.882 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.598 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 12.3 m80 -111.72 78.63 1.14 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.168 -0.957 . . . . 0.0 110.353 -178.932 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.428 ' HA3' ' HA ' ' A' ' 32' ' ' CYS . . . 178.72 -160.9 26.99 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.963 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -127.56 138.7 52.96 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.401 -1.058 . . . . 0.0 110.221 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.864 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -81.5 134.88 35.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.246 -0.909 . . . . 0.0 110.199 179.969 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.864 HD13 ' O ' ' A' ' 19' ' ' CYS . 24.3 mm -142.59 172.81 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.262 -0.899 . . . . 0.0 110.262 -179.908 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.477 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 8.8 t80 -137.03 138.25 40.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.242 -0.911 . . . . 0.0 109.58 179.866 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.594 HD23 ' HB2' ' A' ' 29' ' ' TYR . 3.3 mm? -100.51 136.42 40.42 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.973 -1.079 . . . . 0.0 111.28 -179.26 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.53 ' CB ' ' HA ' ' A' ' 2' ' ' SER . 10.7 p -90.72 -27.18 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.509 -0.744 . . . . 0.0 110.497 179.847 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.24 -17.21 56.99 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.122 -0.986 . . . . 0.0 108.886 179.426 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.532 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.9 mtm -143.38 64.86 1.33 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.726 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.465 ' C ' ' O ' ' A' ' 25' ' ' MET . 66.1 p -29.12 88.4 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.699 0.761 . . . . 0.0 111.733 -178.32 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.532 ' N ' ' O ' ' A' ' 25' ' ' MET . 4.4 pt20 -160.39 177.79 10.24 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.659 -0.651 . . . . 0.0 109.444 179.557 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -81.1 156.08 25.96 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.233 -0.917 . . . . 0.0 110.235 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.594 ' HB2' HD23 ' A' ' 22' ' ' LEU . 2.8 t80 -150.22 95.34 2.26 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.307 -0.871 . . . . 0.0 110.132 -179.959 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 4.0 m -102.36 106.9 17.75 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.195 -0.941 . . . . 0.0 110.105 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.3 tpp85 -79.52 97.93 6.64 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.177 -0.952 . . . . 0.0 109.504 179.602 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 77.9 m -79.73 175.91 10.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.445 -0.785 . . . . 0.0 110.525 -179.39 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 35' ' ' GLY . 10.6 tt0 -79.85 124.76 28.93 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.395 -0.815 . . . . 0.0 109.618 179.864 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.413 ' H ' HG23 ' A' ' 34' ' ' VAL . 14.1 t -65.16 -9.0 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.388 -0.82 . . . . 0.0 110.335 -179.423 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.719 ' O ' HD12 ' A' ' 46' ' ' LEU . . . -78.48 -3.22 86.13 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 179.863 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.598 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.9 OUTLIER -79.9 168.22 19.53 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.036 -1.273 . . . . 0.0 109.684 179.75 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 37' ' ' THR . . . . . 1.098 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -108.22 32.09 5.06 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.929 -1.107 . . . . 0.0 110.784 -179.595 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.514 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -147.93 171.38 28.45 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.269 -1.532 . . . . 0.0 109.269 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.407 ' O ' HG22 ' A' ' 39' ' ' VAL . 9.0 p -86.18 21.13 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.17 -1.194 . . . . 0.0 109.946 179.828 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.544 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 41.0 ttp180 -137.48 -95.62 0.21 Allowed 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.285 -0.885 . . . . 0.0 110.03 -179.674 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.9 p 163.62 73.04 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.78 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.544 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 2.0 tt0 -133.71 -28.93 1.37 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.418 -0.801 . . . . 0.0 110.673 -179.48 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 1.098 ' CD2' HG23 ' A' ' 37' ' ' THR . 15.1 p-80 -128.34 113.46 15.64 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.907 -1.121 . . . . 0.0 109.922 179.236 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.62 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 37.2 t80 -79.41 106.43 11.44 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.463 0.649 . . . . 0.0 110.041 -179.253 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.86 -29.46 70.41 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.286 -0.884 . . . . 0.0 109.936 -179.679 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.719 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.4 mt . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.244 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.613 ' O ' HG22 ' A' ' 1' ' ' VAL . 7.2 p . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.248 0.547 . . . . 0.0 110.21 . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.404 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.7 OUTLIER -110.72 81.45 1.44 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.253 -0.905 . . . . 0.0 110.114 179.922 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.571 HD11 ' HB ' ' A' ' 20' ' ' ILE . 2.8 tt -144.74 156.1 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.211 -0.931 . . . . 0.0 110.308 -179.816 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.26 157.16 25.36 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.902 . . . . 0.0 110.244 179.919 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -96.19 165.46 12.21 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.231 -0.918 . . . . 0.0 110.219 -179.987 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.714 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 84.3 m -109.26 -152.86 0.5 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 110.342 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.94 -170.45 2.24 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.268 -0.895 . . . . 0.0 110.294 -179.916 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 m -85.24 11.55 9.8 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.904 . . . . 0.0 110.097 179.864 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.36 16.23 11.37 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.9 . . . . 0.0 110.114 -179.903 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.67 20.86 9.36 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.254 -0.904 . . . . 0.0 110.286 -179.87 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -104.09 72.47 1.09 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.171 -0.956 . . . . 0.0 110.236 -179.988 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -120.51 2.04 12.45 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.466 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 24.7 t80 -119.65 -57.4 1.98 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.184 -1.186 . . . . 0.0 110.246 179.964 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.588 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.4 p -90.33 121.65 32.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.237 -0.914 . . . . 0.0 110.366 -179.951 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.621 ' N ' HD23 ' A' ' 15' ' ' LEU . 3.9 mt -90.72 -56.98 2.98 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.152 -0.968 . . . . 0.0 110.714 -179.853 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.593 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 13.2 m80 -100.21 83.74 2.72 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.259 -0.901 . . . . 0.0 110.395 -178.885 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.516 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 176.53 -160.4 27.9 Favored Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.846 -1.301 . . . . 0.0 109.846 -179.8 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.404 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 2.2 mm100 -124.7 147.43 48.6 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.356 -1.085 . . . . 0.0 110.192 -179.968 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.714 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 4.7 t -93.73 130.12 39.81 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.382 -0.824 . . . . 0.0 110.318 -179.961 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.824 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -142.66 -176.95 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.42 -0.8 . . . . 0.0 109.978 179.867 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.471 ' O ' HG13 ' A' ' 3' ' ' ILE . 9.7 t80 -143.47 124.81 14.66 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.152 -0.968 . . . . 0.0 109.957 -179.92 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.529 HD22 ' HD2' ' A' ' 29' ' ' TYR . 1.9 mp -79.49 128.36 33.26 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.003 -1.061 . . . . 0.0 111.317 -179.269 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.404 HG11 ' HB3' ' A' ' 2' ' ' SER . 5.5 p -90.38 -26.16 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.688 -0.633 . . . . 0.0 110.417 179.788 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -78.17 -11.89 59.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.099 -1.001 . . . . 0.0 108.659 178.951 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 10.0 ttm -150.55 68.24 0.96 Allowed 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.929 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 13.7 p -29.19 89.86 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 121.745 0.783 . . . . 0.0 111.344 -178.471 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.1 147.65 18.14 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.738 -0.602 . . . . 0.0 109.725 -179.965 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.528 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.0 m-20 -64.87 124.49 22.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.442 -0.786 . . . . 0.0 110.133 -179.953 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.529 ' HD2' HD22 ' A' ' 22' ' ' LEU . 4.8 t80 -116.54 132.43 56.68 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.413 -0.805 . . . . 0.0 109.931 -179.866 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.588 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -129.64 112.63 13.87 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.092 -1.005 . . . . 0.0 110.374 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.516 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.7 OUTLIER -86.0 115.04 23.36 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.255 -0.903 . . . . 0.0 109.451 179.389 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.702 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 91.9 m -78.89 179.41 7.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.15 -0.969 . . . . 0.0 110.61 -179.408 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.463 ' OE2' ' CE1' ' A' ' 44' ' ' PHE . 22.3 tt0 -83.89 116.51 22.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.392 -0.818 . . . . 0.0 110.404 -179.543 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.1 t -52.43 101.67 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.192 -0.943 . . . . 0.0 109.555 179.523 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.905 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 147.9 -10.61 1.22 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.61 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.593 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.4 m-85 -78.78 160.21 27.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.897 -1.354 . . . . 0.0 109.465 179.769 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 37' ' ' THR . . . . . 1.109 HG23 ' CE1' ' A' ' 43' ' ' HIS . 1.0 OUTLIER -105.72 -4.62 20.74 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.841 -1.162 . . . . 0.0 111.125 -179.084 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.527 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -98.34 140.89 15.28 Favored Glycine 0 N--CA 1.488 2.11 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.778 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.425 ' C ' ' O ' ' A' ' 38' ' ' GLY . 8.5 p -44.85 -25.73 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.133 -1.216 . . . . 0.0 108.807 179.072 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.546 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 7.4 ttp180 -102.15 -130.67 0.25 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.218 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.702 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -151.72 75.64 1.16 Allowed 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 179.011 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.546 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 0.9 OUTLIER -123.82 -29.9 3.62 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.394 -0.816 . . . . 0.0 110.336 -179.264 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 1.109 ' CE1' HG23 ' A' ' 37' ' ' THR . 3.0 p80 -130.45 117.09 19.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.961 -1.087 . . . . 0.0 110.05 179.443 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 44.6 t80 -79.28 104.38 9.86 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 121.494 0.664 . . . . 0.0 110.002 -179.351 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.585 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.67 -32.87 74.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.466 -0.771 . . . . 0.0 110.172 -179.515 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.905 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.9 mt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.248 179.963 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 97.8 t . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.331 0.586 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.671 ' H ' HG11 ' A' ' 23' ' ' VAL . 16.5 t -80.06 84.44 5.79 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.12 -0.988 . . . . 0.0 110.222 -179.985 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.797 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.81 149.58 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.328 -0.858 . . . . 0.0 110.124 179.964 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -119.0 161.3 20.45 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 110.241 -179.949 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -110.38 165.9 11.41 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.333 -0.854 . . . . 0.0 110.206 179.957 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 72.5 m -112.96 -155.59 0.57 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.229 -0.919 . . . . 0.0 110.206 -179.991 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 m -135.61 -164.13 1.49 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.256 -0.903 . . . . 0.0 110.318 179.961 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.53 10.3 13.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 0.0 110.216 -179.983 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -123.13 19.23 9.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 0.0 110.181 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.79 23.06 2.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.893 . . . . 0.0 110.175 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -106.25 68.3 0.76 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.221 -0.924 . . . . 0.0 110.206 -179.978 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -109.22 43.65 1.67 Allowed Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 179.948 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -156.93 -58.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.297 -1.119 . . . . 0.0 110.204 -179.914 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.6 p -91.15 118.87 30.79 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.265 -0.897 . . . . 0.0 110.295 -179.912 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.59 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.8 mt -90.43 -43.13 10.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.117 -0.99 . . . . 0.0 110.325 179.8 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.9 m80 -111.65 78.02 1.09 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.251 -0.905 . . . . 0.0 110.163 -179.486 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 176.07 -171.02 44.06 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -114.44 146.41 40.67 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.2 -1.176 . . . . 0.0 110.326 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.4 t -84.47 147.47 27.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.322 -0.861 . . . . 0.0 110.037 179.805 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.809 HD12 ' CD1' ' A' ' 29' ' ' TYR . 0.7 OUTLIER -155.35 -177.59 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.147 -0.971 . . . . 0.0 110.107 -179.805 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.502 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 14.8 t80 -142.36 132.66 24.88 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.282 -0.886 . . . . 0.0 109.98 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.633 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.5 mm? -94.47 134.5 36.94 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.126 -0.984 . . . . 0.0 111.016 -179.339 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.671 HG11 ' H ' ' A' ' 2' ' ' SER . 10.7 p -90.92 -24.94 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.297 -0.877 . . . . 0.0 110.524 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.547 ' OD2' HD12 ' A' ' 22' ' ' LEU . 3.3 p30 -78.56 -15.68 58.29 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.044 -1.035 . . . . 0.0 108.956 179.314 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.544 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.5 ttp -146.01 66.48 1.2 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 178.899 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.91 88.56 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 122.001 0.905 . . . . 0.0 111.877 -178.223 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 tt0 -160.86 173.79 14.82 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 121.318 0.58 . . . . 0.0 109.935 179.401 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -77.19 140.99 40.3 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.462 -0.774 . . . . 0.0 110.23 -179.962 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.809 ' CD1' HD12 ' A' ' 20' ' ' ILE . 9.8 t80 -135.64 113.94 11.51 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.356 -0.84 . . . . 0.0 110.031 179.894 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 15.4 m -117.85 116.97 28.03 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.045 -1.034 . . . . 0.0 110.41 -179.809 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.432 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.2 tpp85 -79.49 118.34 21.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.155 -0.966 . . . . 0.0 109.447 179.431 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.513 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 95.7 m -79.52 170.76 16.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.392 -0.818 . . . . 0.0 110.573 -179.329 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -79.48 117.14 20.16 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.358 -0.839 . . . . 0.0 109.968 179.974 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.415 HG23 ' H ' ' A' ' 34' ' ' VAL . 36.4 t -50.13 103.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.296 -0.877 . . . . 0.0 109.686 179.966 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.74 -12.75 1.32 Allowed Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.67 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.32 172.14 14.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.203 -1.175 . . . . 0.0 109.648 179.85 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.935 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.72 29.78 6.91 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.906 -1.121 . . . . 0.0 110.524 179.974 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.55 160.08 31.5 Favored Glycine 0 N--CA 1.489 2.186 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.547 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.617 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.7 p -88.88 27.09 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.177 -1.19 . . . . 0.0 109.536 179.321 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.559 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -132.95 14.31 4.29 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.48 -0.762 . . . . 0.0 109.738 -179.667 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.513 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 4.9 p 32.62 87.63 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 121.467 0.651 . . . . 0.0 110.601 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.559 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 1.1 tp10 -156.09 -34.81 0.09 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.405 -0.809 . . . . 0.0 110.644 -179.61 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.935 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.4 p80 -120.46 119.21 32.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.882 -1.136 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.632 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 17.3 t80 -84.21 111.74 19.64 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-O 121.247 0.546 . . . . 0.0 109.859 -179.728 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.574 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -68.43 -23.71 64.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.285 -0.884 . . . . 0.0 109.655 -179.78 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.632 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.8 mt . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.269 -179.819 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.405 HG23 ' N ' ' A' ' 2' ' ' SER . 17.6 m . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.258 0.551 . . . . 0.0 110.214 . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.759 ' HB2' HG11 ' A' ' 23' ' ' VAL . 2.6 m -132.78 107.1 8.14 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.217 -0.927 . . . . 0.0 110.403 -179.95 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 1.084 HD11 HD12 ' A' ' 20' ' ' ILE . 1.7 tt -129.51 157.37 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.294 -0.879 . . . . 0.0 109.991 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -121.57 168.06 12.17 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.212 -0.93 . . . . 0.0 110.262 -179.913 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.29 159.51 14.9 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.206 -0.934 . . . . 0.0 110.234 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 65.1 m -104.59 -147.99 0.4 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.242 -0.911 . . . . 0.0 110.147 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -127.48 -171.4 2.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.247 -0.908 . . . . 0.0 110.212 -179.934 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.8 t -79.81 -55.42 5.0 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.253 -0.904 . . . . 0.0 110.167 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -63.07 -11.3 18.67 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.242 -0.911 . . . . 0.0 110.149 179.906 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.7 ttm -88.14 27.37 1.22 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.253 -0.905 . . . . 0.0 110.225 -179.986 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -121.85 69.89 0.94 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.219 -0.926 . . . . 0.0 110.232 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -119.7 3.29 13.44 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -108.77 -50.53 3.0 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.159 -1.201 . . . . 0.0 110.182 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 22.3 p -104.07 120.09 40.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.216 -0.928 . . . . 0.0 110.271 179.932 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.589 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 10.1 mt -90.17 -43.22 10.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.298 -0.876 . . . . 0.0 110.519 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.6 m80 -110.53 86.88 2.4 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.134 -0.979 . . . . 0.0 110.258 -179.503 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.464 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.68 -131.39 2.11 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.968 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 7.3 pt20 -160.35 149.71 17.47 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.233 -1.157 . . . . 0.0 110.236 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.607 ' O ' HG23 ' A' ' 20' ' ' ILE . 1.2 t -94.54 147.54 23.17 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.195 -0.941 . . . . 0.0 110.194 179.948 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.102 HD11 ' CD1' ' A' ' 29' ' ' TYR . 19.0 pt -157.7 167.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.302 -0.874 . . . . 0.0 110.063 179.96 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.508 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 12.4 t80 -120.36 118.84 31.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.205 -0.934 . . . . 0.0 110.065 -179.983 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.786 HD11 ' CD2' ' A' ' 29' ' ' TYR . 11.3 mt -83.45 135.89 34.51 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.242 -0.912 . . . . 0.0 110.766 -179.751 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.759 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.2 p -88.32 -29.0 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.398 -0.814 . . . . 0.0 110.078 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -78.41 -22.8 47.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.208 -0.933 . . . . 0.0 108.716 179.191 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.1 mmt -134.23 61.14 1.68 Allowed 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 178.526 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.466 ' C ' ' O ' ' A' ' 25' ' ' MET . 3.2 p -28.74 86.2 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 121.576 0.703 . . . . 0.0 111.883 -178.46 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 pt20 -161.21 167.56 25.83 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.576 -0.702 . . . . 0.0 109.556 179.526 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.604 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 2.2 p-10 -82.51 90.58 6.77 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.327 -0.858 . . . . 0.0 109.787 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 1.102 ' CD1' HD11 ' A' ' 20' ' ' ILE . 5.4 t80 -79.7 131.92 36.07 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.405 -0.809 . . . . 0.0 110.283 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -120.58 113.21 19.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.169 -0.957 . . . . 0.0 110.368 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.536 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . 3.0 tpm_? -81.73 116.95 21.67 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.193 -0.942 . . . . 0.0 109.461 179.452 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.506 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 66.9 m -79.06 173.63 12.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.279 -0.888 . . . . 0.0 110.136 -179.793 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -79.42 111.65 15.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.284 -0.885 . . . . 0.0 109.909 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.3 t -49.15 103.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.446 -0.784 . . . . 0.0 109.727 -179.959 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 141.71 -7.28 2.46 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -179.741 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.558 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.25 179.97 7.09 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.175 -1.191 . . . . 0.0 109.796 179.853 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -116.5 23.91 11.71 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.915 -1.116 . . . . 0.0 110.731 -179.629 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -149.65 157.78 27.38 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.545 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.528 ' O ' HG13 ' A' ' 39' ' ' VAL . 8.6 p -85.78 40.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.248 -1.149 . . . . 0.0 109.797 179.557 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.56 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.03 21.07 0.16 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.452 -0.78 . . . . 0.0 109.973 -179.522 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.506 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 8.8 p 32.32 84.85 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.665 -0.647 . . . . 0.0 110.745 -179.702 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.56 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 23.8 tt0 -146.01 -41.53 0.21 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.405 -0.809 . . . . 0.0 109.967 -179.878 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.8 p-80 -119.43 128.69 54.26 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.11 -0.994 . . . . 0.0 110.372 179.598 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.617 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 34.4 t80 -86.68 130.32 34.53 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 121.383 0.611 . . . . 0.0 110.434 -178.504 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.557 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -91.64 -37.29 13.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 109.849 -179.878 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.617 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.3 mt . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.201 -179.663 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 42.2 t . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.26 0.553 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.415 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER -140.98 114.33 8.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.264 -0.897 . . . . 0.0 110.336 -179.975 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.68 HD11 ' HB ' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -128.19 150.25 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.259 -0.901 . . . . 0.0 110.086 179.841 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -118.77 -163.61 0.97 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.206 -0.934 . . . . 0.0 110.173 179.93 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -130.74 154.4 48.0 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.13 -0.981 . . . . 0.0 110.352 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.566 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 94.6 m -83.81 -165.35 1.1 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.408 -0.807 . . . . 0.0 110.239 179.926 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.48 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.4 OUTLIER -125.69 -158.41 0.84 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.301 -0.874 . . . . 0.0 110.114 179.812 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.48 ' N ' ' OG ' ' A' ' 7' ' ' SER . 2.8 m -79.93 168.97 18.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.154 -0.967 . . . . 0.0 110.126 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 50.48 20.94 0.76 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.206 -0.934 . . . . 0.0 110.235 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tpp -122.85 -15.52 7.38 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.201 -0.937 . . . . 0.0 110.181 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -89.16 52.48 2.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.315 -0.866 . . . . 0.0 110.354 -179.941 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -109.63 1.94 30.63 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.447 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 45.9 t80 -93.4 -57.3 2.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.203 -1.175 . . . . 0.0 110.128 179.999 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.3 p -97.54 119.74 36.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.271 -0.893 . . . . 0.0 110.111 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.3 mt -90.24 -45.18 9.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.221 -0.924 . . . . 0.0 110.303 -179.999 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.569 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.5 m80 -108.59 85.71 2.16 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.297 -0.877 . . . . 0.0 110.224 -179.591 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.489 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 169.82 -174.75 44.05 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.03 145.76 30.97 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.268 -1.136 . . . . 0.0 110.311 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.566 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 5.6 t -96.08 130.07 43.19 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.365 -0.834 . . . . 0.0 110.385 -179.932 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.804 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.7 177.53 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.372 -0.83 . . . . 0.0 110.102 179.994 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.501 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 13.8 t80 -128.0 135.14 49.49 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.289 -0.882 . . . . 0.0 109.703 179.707 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.675 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.2 mm? -92.86 132.86 36.64 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.979 -1.076 . . . . 0.0 111.149 -179.309 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.415 HG11 ' CB ' ' A' ' 2' ' ' SER . 9.1 p -90.87 -31.7 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.461 -0.775 . . . . 0.0 110.586 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -78.06 -19.67 53.82 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.124 -0.985 . . . . 0.0 108.78 179.403 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 27' ' ' GLN . 35.8 mtt -137.19 61.56 1.62 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.608 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 89.5 p -29.21 87.79 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 121.614 0.721 . . . . 0.0 111.584 -178.499 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.557 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.4 pt20 -160.73 171.46 18.81 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.66 -0.65 . . . . 0.0 109.648 179.689 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -79.72 115.86 19.56 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.447 -0.783 . . . . 0.0 110.292 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.675 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.7 t80 -105.67 141.47 37.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.349 -0.844 . . . . 0.0 109.717 179.804 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 14.3 m -141.58 112.05 7.02 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.017 -1.052 . . . . 0.0 110.694 -179.562 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.489 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.5 OUTLIER -81.04 112.84 18.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.207 -0.933 . . . . 0.0 109.427 179.291 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.529 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 95.8 m -79.36 172.4 13.85 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.307 -0.871 . . . . 0.0 110.519 -179.507 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -79.39 114.03 18.0 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.441 -0.787 . . . . 0.0 109.965 -179.849 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.422 HG23 ' H ' ' A' ' 34' ' ' VAL . 41.1 t -46.08 102.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.27 -0.894 . . . . 0.0 109.709 179.961 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.36 -13.1 1.4 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -179.666 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.568 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -79.28 176.03 10.05 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.162 -1.199 . . . . 0.0 109.852 179.892 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.604 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -117.29 26.33 9.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.906 -1.121 . . . . 0.0 110.784 -179.78 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -147.66 160.5 28.32 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.819 -1.313 . . . . 0.0 109.819 179.607 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.717 HG12 ' O ' ' A' ' 39' ' ' VAL . 69.9 t -86.8 19.14 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.325 -1.103 . . . . 0.0 109.818 179.59 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.549 ' NH2' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -140.23 21.72 2.41 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.522 -0.736 . . . . 0.0 109.672 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.529 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 5.9 p 32.31 93.04 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 CA-C-O 121.493 0.663 . . . . 0.0 111.118 179.711 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.549 ' HB3' ' NH2' ' A' ' 40' ' ' ARG . 30.1 tt0 -156.61 -38.04 0.08 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.358 -0.839 . . . . 0.0 110.232 179.714 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.604 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.2 p-80 -117.36 129.59 55.96 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.029 -1.044 . . . . 0.0 110.611 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.624 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.5 t80 -88.13 130.28 35.08 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.433 0.635 . . . . 0.0 110.376 -178.737 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -94.39 -33.45 13.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.454 -0.779 . . . . 0.0 110.277 -179.65 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.624 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.2 mt . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.291 -179.745 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.687 ' O ' HG22 ' A' ' 1' ' ' VAL . 6.2 p . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.195 0.522 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -139.26 49.56 1.83 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.323 -0.861 . . . . 0.0 110.227 179.998 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.698 HG12 HG22 ' A' ' 20' ' ' ILE . 9.5 tt -83.37 166.48 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.315 -0.866 . . . . 0.0 110.185 -179.987 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 4.2 m -137.98 165.47 26.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.197 -0.939 . . . . 0.0 110.547 -179.631 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -91.83 154.39 18.93 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.241 -0.912 . . . . 0.0 110.223 179.892 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.72 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 60.7 m -91.71 -141.15 0.18 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.32 -0.863 . . . . 0.0 110.259 -179.984 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.519 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.5 OUTLIER -159.47 -155.2 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.286 -0.884 . . . . 0.0 109.962 -179.931 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.519 ' N ' ' OG ' ' A' ' 7' ' ' SER . 0.1 OUTLIER -79.67 166.47 21.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.063 -1.023 . . . . 0.0 109.871 179.936 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 50.84 20.86 0.83 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.083 -1.01 . . . . 0.0 110.19 -179.822 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.99 14.23 5.76 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.175 -0.953 . . . . 0.0 110.202 -179.866 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.4 ' OD1' ' N ' ' A' ' 11' ' ' ASN . 10.3 m-20 -118.35 -141.11 0.36 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.236 -0.915 . . . . 0.0 110.389 -179.878 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.14 49.57 3.03 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.286 -1.526 . . . . 0.0 109.286 -179.817 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.682 ' OH ' HG23 ' A' ' 39' ' ' VAL . 8.6 t80 -155.0 -70.27 0.12 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.314 -1.109 . . . . 0.0 109.938 -179.819 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.486 ' C ' HD23 ' A' ' 15' ' ' LEU . 25.3 p -87.87 125.99 34.78 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.072 -1.017 . . . . 0.0 110.33 179.74 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.62 ' N ' HD23 ' A' ' 15' ' ' LEU . 3.9 mt -90.19 -49.04 6.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.19 -0.943 . . . . 0.0 110.142 179.765 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.54 ' ND1' ' HB2' ' A' ' 15' ' ' LEU . 10.4 m80 -104.83 77.21 1.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.219 -0.926 . . . . 0.0 110.112 -179.838 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.504 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -176.98 -178.97 47.14 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.868 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -108.53 140.46 41.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.255 -1.144 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.72 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 8.4 t -79.76 147.66 31.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.197 -0.939 . . . . 0.0 109.828 179.854 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.698 HG22 HG12 ' A' ' 3' ' ' ILE . 0.3 OUTLIER -154.22 -170.0 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.152 -0.968 . . . . 0.0 110.001 -179.693 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.5 ' O ' HG13 ' A' ' 3' ' ' ILE . 8.6 t80 -147.88 128.39 14.07 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.077 -1.014 . . . . 0.0 109.857 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.651 HD23 ' CD2' ' A' ' 29' ' ' TYR . 0.8 OUTLIER -84.19 131.78 34.73 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.196 -0.94 . . . . 0.0 111.103 -179.31 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.6 p -90.54 -28.31 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.343 -0.848 . . . . 0.0 110.587 179.732 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.52 ' OD2' ' CD1' ' A' ' 22' ' ' LEU . 1.9 p30 -78.43 -15.25 58.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.019 -1.05 . . . . 0.0 108.789 179.229 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -144.45 65.55 1.28 Allowed 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 178.733 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.487 ' C ' ' O ' ' A' ' 25' ' ' MET . 40.3 p -29.15 89.38 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.702 0.763 . . . . 0.0 111.542 -178.355 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 pt20 -157.81 168.89 25.9 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.737 -0.602 . . . . 0.0 109.419 179.51 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -77.22 124.96 28.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.283 -0.886 . . . . 0.0 110.594 -179.615 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.651 ' CD2' HD23 ' A' ' 22' ' ' LEU . 35.5 t80 -110.83 158.39 18.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.402 -0.811 . . . . 0.0 109.77 179.73 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.407 ' SG ' ' O ' ' A' ' 29' ' ' TYR . 1.9 m -158.1 108.38 2.13 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.058 -1.026 . . . . 0.0 110.503 -179.95 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.504 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.8 tpp180 -81.29 115.04 20.48 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.88 . . . . 0.0 109.666 179.681 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 97.5 m -79.4 175.06 10.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.167 -0.958 . . . . 0.0 110.521 -179.56 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -79.46 117.94 20.88 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.367 -0.833 . . . . 0.0 110.383 -179.792 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -49.94 99.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.283 -0.886 . . . . 0.0 109.914 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 152.35 -16.84 0.77 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.847 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.472 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.0 OUTLIER -79.55 172.92 13.14 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.147 -1.207 . . . . 0.0 110.023 179.947 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.598 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -113.29 31.47 6.44 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.017 -1.052 . . . . 0.0 110.518 -179.636 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.32 162.9 33.62 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.448 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.682 HG23 ' OH ' ' A' ' 13' ' ' TYR . 2.4 m -84.34 14.73 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.345 -1.091 . . . . 0.0 109.733 179.546 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.584 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -128.26 18.18 6.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.386 -0.821 . . . . 0.0 109.852 -179.444 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.6 p 27.33 91.06 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 CA-C-O 121.402 0.62 . . . . 0.0 111.369 179.493 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.584 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 10.8 tm-20 -156.6 -37.79 0.08 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.398 -0.814 . . . . 0.0 110.284 179.752 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.598 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 3.1 p-80 -114.86 128.44 56.29 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.008 -1.058 . . . . 0.0 110.523 179.887 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.654 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 15.7 t80 -86.63 126.33 34.44 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.459 0.647 . . . . 0.0 109.842 -179.009 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.584 ' O ' ' CG ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -85.27 12.47 8.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.447 -0.783 . . . . 0.0 109.955 -179.329 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.654 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.5 mt . . . . . 0 C--N 1.302 -1.479 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.395 -179.748 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 17.3 t . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 121.31 0.576 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' SER . . . . . 1.032 ' HB2' HG11 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -157.22 156.56 32.77 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.31 -0.869 . . . . 0.0 109.959 179.871 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.588 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -153.68 164.94 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.238 -0.914 . . . . 0.0 110.267 -179.802 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 3.7 m -148.52 167.16 26.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 0.0 110.219 179.984 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.457 ' HD2' HD13 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -110.41 168.99 9.04 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 110.027 179.908 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 57.0 m -86.49 -166.3 1.51 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.177 -0.952 . . . . 0.0 110.169 -179.937 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.84 -64.85 0.69 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.313 -0.867 . . . . 0.0 110.314 -179.963 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.44 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 0.5 OUTLIER -153.69 -71.17 0.14 Allowed 'General case' 0 C--N 1.291 -1.946 0 O-C-N 121.78 -0.575 . . . . 0.0 110.377 -179.961 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -62.72 -11.18 15.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.205 -0.934 . . . . 0.0 110.218 -179.972 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.438 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -104.27 39.5 1.64 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.258 -0.901 . . . . 0.0 110.159 179.898 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.44 ' OD1' ' O ' ' A' ' 8' ' ' SER . 41.4 p-10 -137.74 21.44 2.88 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.284 -0.885 . . . . 0.0 110.337 -179.885 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -100.18 75.14 0.44 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.971 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -160.28 -58.43 0.06 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.264 -1.139 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -97.25 118.2 33.15 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.342 -0.849 . . . . 0.0 110.605 -179.718 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.756 ' HB2' ' CD2' ' A' ' 16' ' ' HIS . 15.7 mt -75.77 -40.69 54.84 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 109.887 179.706 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.756 ' CD2' ' HB2' ' A' ' 15' ' ' LEU . 10.2 m-70 -119.85 89.36 3.11 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.414 -0.804 . . . . 0.0 110.584 -179.096 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.469 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 171.08 -177.81 43.83 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 179.791 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -108.06 153.46 23.09 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.294 -1.121 . . . . 0.0 110.306 179.86 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.909 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -92.05 133.66 35.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.377 -0.827 . . . . 0.0 110.539 -179.809 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.909 HD13 ' O ' ' A' ' 19' ' ' CYS . 9.4 mm -142.71 178.67 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.35 -0.844 . . . . 0.0 109.883 179.968 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.556 ' H ' HG22 ' A' ' 20' ' ' ILE . 20.6 t80 -147.68 129.45 15.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.986 -1.071 . . . . 0.0 110.252 179.952 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.613 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 2.9 mm? -88.65 131.78 34.84 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.267 -0.896 . . . . 0.0 110.749 -179.662 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 1.032 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.4 p -90.57 -23.19 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.341 -0.849 . . . . 0.0 110.612 179.88 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -78.59 -12.43 60.02 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.003 -1.061 . . . . 0.0 108.806 179.28 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -151.01 68.9 0.95 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.957 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.489 ' C ' ' O ' ' A' ' 25' ' ' MET . 40.1 p -29.02 89.52 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.791 0.805 . . . . 0.0 111.308 -178.419 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.55 148.09 17.69 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.726 -0.609 . . . . 0.0 109.367 -179.883 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.53 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.2 m-80 -60.68 146.21 46.46 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.197 -0.94 . . . . 0.0 110.399 -179.635 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.613 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 3.5 t80 -142.73 102.85 4.12 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.441 -0.787 . . . . 0.0 109.991 179.984 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.9 m -108.62 119.03 38.33 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.108 -0.995 . . . . 0.0 110.278 -179.951 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.469 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -78.98 137.33 37.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.107 -0.996 . . . . 0.0 109.216 179.476 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.8 m -79.54 169.3 18.23 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.281 -0.887 . . . . 0.0 110.025 -179.528 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.529 ' O ' ' N ' ' A' ' 35' ' ' GLY . 9.6 tt0 -78.59 112.26 15.49 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.309 -0.869 . . . . 0.0 108.709 179.21 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.465 ' C ' ' O ' ' A' ' 33' ' ' GLU . 38.3 t -36.12 93.17 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 121.479 0.657 . . . . 0.0 110.475 -179.071 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.999 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 149.72 -15.77 1.07 Allowed Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.649 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.503 ' CE2' ' C ' ' A' ' 43' ' ' HIS . 2.4 m-85 -81.12 169.24 17.66 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.137 -1.213 . . . . 0.0 109.922 179.939 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.899 HG23 ' NE2' ' A' ' 43' ' ' HIS . 5.2 t -122.55 45.55 2.35 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.968 -1.082 . . . . 0.0 111.171 -179.77 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.53 156.08 27.32 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.963 -1.255 . . . . 0.0 109.963 179.568 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.7 HG12 ' O ' ' A' ' 39' ' ' VAL . 79.2 t -89.07 21.27 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.327 -1.102 . . . . 0.0 109.487 179.288 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.578 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 6.5 ttp180 -122.78 -19.23 6.28 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.568 -0.708 . . . . 0.0 109.978 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.7 m 69.51 70.26 0.25 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.172 -0.955 . . . . 0.0 110.234 179.281 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.578 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -141.03 -29.25 0.66 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.19 -0.944 . . . . 0.0 111.255 -179.838 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.899 ' NE2' HG23 ' A' ' 37' ' ' THR . 21.3 p-80 -125.63 120.46 30.84 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.623 -1.298 . . . . 0.0 111.214 179.963 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.612 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 51.6 t80 -82.57 103.14 11.88 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.295 0.569 . . . . 0.0 109.678 179.773 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.578 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.59 -30.34 71.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.239 -0.913 . . . . 0.0 110.237 -179.29 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.999 HD12 ' O ' ' A' ' 35' ' ' GLY . 3.2 mt . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.13 -0.981 . . . . 0.0 110.147 -179.986 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.24 0.543 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.533 ' HB3' HG11 ' A' ' 23' ' ' VAL . 6.3 t -101.8 54.46 0.81 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.171 -0.956 . . . . 0.0 110.205 -179.979 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.799 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -80.63 141.18 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.29 -0.881 . . . . 0.0 110.216 -179.933 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.424 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -101.33 158.53 15.98 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.306 -179.97 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -108.17 151.49 25.85 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.302 -0.874 . . . . 0.0 110.019 179.864 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.4 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 61.3 m -97.81 -159.86 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.269 -0.895 . . . . 0.0 110.365 -179.94 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.7 t -145.12 -146.47 0.19 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.204 -0.935 . . . . 0.0 110.198 179.996 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.435 ' O ' ' N ' ' A' ' 10' ' ' MET . 23.7 t -79.87 168.02 19.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.224 -0.922 . . . . 0.0 110.134 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' A' ' 8' ' ' SER . 20.0 t0 42.08 26.93 0.06 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.262 -0.899 . . . . 0.0 110.288 179.954 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.435 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -125.78 -0.86 7.33 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.261 -0.9 . . . . 0.0 110.321 -179.892 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.422 ' O ' ' CG ' ' A' ' 11' ' ' ASN . 24.4 p-10 -140.03 105.53 5.09 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.169 -0.957 . . . . 0.0 110.194 -179.976 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.45 20.79 6.9 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.902 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.455 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 71.0 t80 -110.62 -55.57 2.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.189 -1.183 . . . . 0.0 110.273 -179.899 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.2 p -93.52 123.27 36.72 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.274 -0.891 . . . . 0.0 110.268 -179.818 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.563 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -90.18 -43.65 10.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.111 -0.993 . . . . 0.0 110.416 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.563 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 9.2 m80 -107.87 85.89 2.2 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.265 -0.897 . . . . 0.0 110.233 -179.513 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.93 -165.1 36.1 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.983 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -121.28 134.79 55.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.38 -1.07 . . . . 0.0 110.31 -179.955 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.576 ' O ' HG23 ' A' ' 20' ' ' ILE . 10.7 t -84.47 141.76 30.55 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 110.125 179.903 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.887 HD11 ' CD1' ' A' ' 29' ' ' TYR . 9.5 pt -157.7 -167.38 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.183 -0.948 . . . . 0.0 110.059 -179.778 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.499 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 12.1 t80 -144.18 133.54 23.23 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.269 -0.895 . . . . 0.0 110.086 179.984 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.68 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.6 mm? -87.66 132.62 34.03 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.138 -0.976 . . . . 0.0 110.671 -179.642 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.533 HG11 ' HB3' ' A' ' 2' ' ' SER . 4.8 p -90.71 -22.31 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.256 -0.903 . . . . 0.0 110.674 179.797 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.555 ' OD2' HD12 ' A' ' 22' ' ' LEU . 12.5 p30 -78.46 -9.63 59.38 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.014 -1.054 . . . . 0.0 108.913 179.26 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -157.35 70.85 0.62 Allowed 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.146 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.499 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 12.5 p -29.32 89.43 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 121.768 0.794 . . . . 0.0 111.307 -178.587 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.18 149.61 17.7 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.704 -0.623 . . . . 0.0 109.478 -179.7 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.519 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 3.3 t-20 -61.09 135.13 57.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.215 -0.928 . . . . 0.0 110.227 -179.857 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.887 ' CD1' HD11 ' A' ' 20' ' ' ILE . 7.2 t80 -129.07 126.24 38.99 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.445 -0.785 . . . . 0.0 109.74 -179.936 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 8.2 m -123.47 112.78 17.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.98 . . . . 0.0 110.718 -179.554 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.481 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 8.9 tpp85 -79.51 111.35 15.7 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.272 -0.893 . . . . 0.0 109.686 179.568 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.467 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 68.5 m -79.32 167.74 20.49 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.222 -0.924 . . . . 0.0 110.027 -179.871 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -79.82 106.36 11.78 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.295 -0.878 . . . . 0.0 110.225 -179.727 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.435 ' H ' HG22 ' A' ' 34' ' ' VAL . 5.6 m -47.25 107.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 O-C-N 121.399 -0.813 . . . . 0.0 109.674 179.583 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.13 -10.77 2.04 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.305 -1.518 . . . . 0.0 109.305 -179.369 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.562 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -78.66 178.97 7.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.197 -1.178 . . . . 0.0 109.692 179.862 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.845 HG21 ' CE1' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -106.7 -43.92 4.58 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 118.538 -1.265 . . . . 0.0 110.584 -179.989 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.73 158.03 42.5 Favored Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.635 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.638 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.8 p -84.99 44.88 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.12 -1.224 . . . . 0.0 109.696 179.756 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.26 27.21 0.17 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.407 -0.808 . . . . 0.0 109.746 -179.438 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.49 ' C ' ' O ' ' A' ' 40' ' ' ARG . 15.2 p 31.33 93.47 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.63 -0.669 . . . . 0.0 111.026 179.778 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 9.9 tm-20 -159.24 -41.77 0.06 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.481 -0.762 . . . . 0.0 110.035 179.938 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.845 ' CE1' HG21 ' A' ' 37' ' ' THR . 0.1 OUTLIER -120.14 129.47 54.17 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.06 -1.025 . . . . 0.0 110.669 179.83 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.591 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 35.6 t80 -88.76 125.15 34.75 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.404 -178.758 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.56 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.2 OUTLIER -98.05 -11.83 22.53 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.362 -0.836 . . . . 0.0 110.45 -179.534 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.591 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 6.3 mt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.052 -1.03 . . . . 0.0 110.241 -179.711 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.215 0.531 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.52 ' HA ' ' HB ' ' A' ' 23' ' ' VAL . 3.1 m -160.3 174.44 14.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.316 -0.865 . . . . 0.0 109.898 179.979 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.479 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 2.7 tt -79.6 148.67 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.233 -0.917 . . . . 0.0 109.803 179.595 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.672 HG23 ' N ' ' A' ' 5' ' ' LYS . 4.9 t -160.25 -150.12 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.144 -0.972 . . . . 0.0 110.759 -179.928 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.672 ' N ' HG23 ' A' ' 4' ' ' THR . 35.6 mtpt -117.28 174.96 5.83 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.417 -0.802 . . . . 0.0 110.28 -179.806 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.558 ' O ' ' CB ' ' A' ' 7' ' ' SER . 14.3 m -113.37 -11.16 13.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.276 -0.89 . . . . 0.0 110.257 -179.802 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.558 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 1.1 m 79.69 -175.26 0.07 Allowed 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.662 -0.649 . . . . 0.0 110.654 179.99 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.472 ' O ' ' ND2' ' A' ' 11' ' ' ASN . 0.2 OUTLIER -78.97 -39.2 34.99 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.299 -0.876 . . . . 0.0 111.363 -179.108 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -84.36 46.13 1.19 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.941 -1.099 . . . . 0.0 109.68 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.53 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -155.17 24.2 0.42 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.429 -0.794 . . . . 0.0 109.815 -179.226 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.472 ' ND2' ' O ' ' A' ' 8' ' ' SER . 15.5 p30 -118.78 -158.24 0.72 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.108 -0.995 . . . . 0.0 109.922 -179.905 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.38 44.6 0.43 Allowed Glycine 0 N--CA 1.488 2.155 0 N-CA-C 109.267 -1.533 . . . . 0.0 109.267 -179.903 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.417 ' HD2' ' HG ' ' A' ' 14' ' ' CYS . 25.5 t80 -159.7 -44.38 0.05 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.392 -1.064 . . . . 0.0 110.002 -179.676 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -106.37 131.45 53.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.569 -0.707 . . . . 0.0 109.934 -179.588 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.666 HD11 ' OE2' ' A' ' 42' ' ' GLU . 13.1 mt -90.78 -42.58 10.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.346 -0.846 . . . . 0.0 110.438 179.667 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.608 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.8 m80 -113.52 79.24 1.22 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.2 -0.938 . . . . 0.0 110.235 -179.567 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 178.53 -166.83 36.94 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.951 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -131.33 149.18 52.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.282 -1.129 . . . . 0.0 110.239 -179.995 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.563 ' C ' HG23 ' A' ' 20' ' ' ILE . 4.7 t -95.87 146.08 24.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.23 -0.919 . . . . 0.0 110.073 179.993 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.097 HD11 ' CD1' ' A' ' 29' ' ' TYR . 15.1 pt -156.11 -173.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.253 -0.904 . . . . 0.0 110.234 -179.795 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.479 ' HB3' HG22 ' A' ' 4' ' ' THR . 12.7 t80 -131.67 145.79 51.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.306 -0.871 . . . . 0.0 109.859 179.782 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.744 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.4 mm? -103.64 137.75 41.26 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.054 -1.029 . . . . 0.0 111.366 -179.33 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.52 ' HB ' ' HA ' ' A' ' 2' ' ' SER . 9.3 p -91.16 -27.66 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 110.855 179.865 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.429 ' O ' ' HG3' ' A' ' 25' ' ' MET . 10.7 m-20 -77.79 -17.68 57.23 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.071 -1.018 . . . . 0.0 108.831 179.666 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 27' ' ' GLN . 7.0 mtt -144.48 64.38 1.3 Allowed 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 178.698 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 25' ' ' MET . 58.9 p -29.31 86.24 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.711 0.767 . . . . 0.0 111.814 -178.461 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.6 pt20 -161.29 -175.8 5.04 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.605 -0.684 . . . . 0.0 109.467 179.677 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -81.86 145.35 30.42 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.263 -0.898 . . . . 0.0 109.97 179.645 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 1.097 ' CD1' HD11 ' A' ' 20' ' ' ILE . 12.3 t80 -141.02 108.67 5.62 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.357 -0.839 . . . . 0.0 109.82 -179.682 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 25.4 m -103.33 112.88 25.96 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.254 -0.904 . . . . 0.0 110.797 -179.499 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -90.33 95.46 10.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.157 -0.964 . . . . 0.0 109.736 179.492 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.507 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 92.8 m -79.71 178.91 7.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.224 -0.922 . . . . 0.0 110.057 -179.91 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.51 131.32 36.01 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.237 -0.914 . . . . 0.0 109.803 179.864 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.4 t -66.64 -18.33 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.333 -0.854 . . . . 0.0 110.353 -179.494 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.13 -7.13 49.76 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 179.93 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -90.43 168.32 11.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.219 -1.165 . . . . 0.0 110.233 -179.913 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.924 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -110.86 34.03 4.24 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.119 -0.988 . . . . 0.0 110.497 179.797 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.43 156.93 28.29 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.643 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.775 HG12 ' O ' ' A' ' 39' ' ' VAL . 77.0 t -85.07 44.96 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.288 -1.125 . . . . 0.0 109.568 179.54 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.58 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.83 20.92 0.17 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.347 -0.845 . . . . 0.0 109.97 -179.375 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.521 ' C ' ' O ' ' A' ' 40' ' ' ARG . 3.3 p 26.71 90.94 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 121.485 0.66 . . . . 0.0 111.574 179.631 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.666 ' OE2' HD11 ' A' ' 15' ' ' LEU . 1.6 tt0 -155.57 -34.62 0.09 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.835 . . . . 0.0 110.597 179.749 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.924 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.3 p80 -121.89 119.9 32.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.977 -1.077 . . . . 0.0 110.683 179.725 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.577 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 35.4 t80 -83.02 119.34 24.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.718 -0.614 . . . . 0.0 109.743 179.938 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.737 ' HB2' HG21 ' A' ' 37' ' ' THR . 0.4 OUTLIER -89.14 -21.19 23.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.393 -0.817 . . . . 0.0 110.343 -179.435 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.577 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.4 mt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.349 -179.636 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 63.2 t . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.247 0.546 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.546 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -113.99 41.45 2.24 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.212 -0.93 . . . . 0.0 110.102 179.915 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.882 HD12 HD22 ' A' ' 22' ' ' LEU . 5.0 tt -81.69 156.41 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.304 -0.873 . . . . 0.0 110.344 179.939 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.623 HG23 ' N ' ' A' ' 5' ' ' LYS . 5.6 t -136.94 -150.67 0.37 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.311 -0.868 . . . . 0.0 110.063 179.87 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.623 ' N ' HG23 ' A' ' 4' ' ' THR . 11.1 ttpt -107.67 -178.64 3.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.476 -0.765 . . . . 0.0 110.266 179.986 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.727 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 79.5 m -111.95 -154.32 0.54 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.3 -0.875 . . . . 0.0 110.171 -179.947 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.506 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.4 OUTLIER -137.49 -156.57 0.7 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.243 -0.911 . . . . 0.0 110.095 -179.91 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.506 ' N ' ' OG ' ' A' ' 7' ' ' SER . 21.9 t -79.81 167.66 20.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.181 -0.949 . . . . 0.0 110.04 179.93 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 53.11 19.18 1.35 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.176 -0.953 . . . . 0.0 110.173 -179.86 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -119.67 4.51 11.07 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.345 -0.847 . . . . 0.0 110.199 -179.986 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.522 ' ND2' ' O ' ' A' ' 11' ' ' ASN . 1.0 OUTLIER -111.3 90.53 3.36 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.241 -0.912 . . . . 0.0 110.236 -179.959 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -144.76 40.56 1.14 Allowed Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.983 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.418 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 57.5 t80 -148.13 -57.43 0.23 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.201 -1.176 . . . . 0.0 110.271 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.569 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 28.4 p -97.13 118.86 34.51 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.174 -0.954 . . . . 0.0 110.128 -179.958 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.613 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 12.1 mt -89.27 -40.3 12.92 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.246 -0.909 . . . . 0.0 110.307 -179.974 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.613 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -114.35 81.98 1.64 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.046 -1.034 . . . . 0.0 110.193 -179.651 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.404 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -178.28 -173.77 43.97 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.968 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -101.43 144.41 30.26 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.286 -1.126 . . . . 0.0 110.413 -179.985 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.727 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 14.8 t -98.35 125.53 43.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.287 -0.883 . . . . 0.0 110.262 -179.959 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.805 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.0 -175.74 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.453 -0.779 . . . . 0.0 110.139 -179.954 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.472 ' O ' HG13 ' A' ' 3' ' ' ILE . 11.8 t80 -138.27 125.96 22.25 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.165 -0.959 . . . . 0.0 110.107 179.975 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.882 HD22 HD12 ' A' ' 3' ' ' ILE . 1.0 OUTLIER -80.3 129.8 34.75 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.174 -0.954 . . . . 0.0 110.838 -179.584 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.546 HG11 ' CB ' ' A' ' 2' ' ' SER . 5.0 p -90.59 -28.07 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.391 -0.818 . . . . 0.0 110.438 179.731 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -78.27 -13.52 59.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.069 -1.019 . . . . 0.0 108.719 179.097 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.531 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -147.45 66.31 1.13 Allowed 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.902 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.492 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.9 p -29.29 89.8 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.757 0.789 . . . . 0.0 111.436 -178.604 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -159.08 147.63 18.17 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.693 -0.629 . . . . 0.0 109.481 -179.998 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.519 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.3 m-20 -63.77 109.9 1.88 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.304 -0.872 . . . . 0.0 110.084 -179.987 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.616 ' CB ' HD23 ' A' ' 22' ' ' LEU . 6.2 t80 -98.01 141.25 31.2 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.238 -0.914 . . . . 0.0 109.684 179.871 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.569 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 19.5 m -141.95 113.25 7.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.089 -1.007 . . . . 0.0 110.586 -179.497 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.404 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 12.2 tpp180 -81.5 104.46 11.95 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.197 -0.94 . . . . 0.0 109.625 179.511 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.634 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 94.8 m -79.5 168.29 19.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.331 -0.856 . . . . 0.0 110.186 -179.65 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.41 ' CG ' ' H ' ' A' ' 35' ' ' GLY . 7.9 tt0 -78.8 127.44 32.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.188 -0.945 . . . . 0.0 109.504 179.783 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.4 t -66.93 -10.3 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.346 -0.846 . . . . 0.0 110.613 -179.19 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.41 ' H ' ' CG ' ' A' ' 33' ' ' GLU . . . -79.44 -5.94 89.09 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 179.835 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.58 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -83.14 178.65 8.01 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.195 -1.18 . . . . 0.0 110.194 -179.95 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.629 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -111.85 28.5 8.69 Favored 'General case' 0 N--CA 1.498 1.974 0 C-N-CA 119.046 -1.062 . . . . 0.0 110.16 179.663 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.22 157.75 29.1 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 179.527 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.564 ' O ' HG13 ' A' ' 39' ' ' VAL . 8.8 p -84.68 43.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -1.162 . . . . 0.0 109.723 179.522 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.571 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -157.03 18.71 0.3 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.463 -0.773 . . . . 0.0 110.135 -179.405 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.634 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 13.7 p 29.76 91.4 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.432 -0.793 . . . . 0.0 111.566 179.393 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.571 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.7 tt0 -158.62 -37.74 0.06 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -0.925 . . . . 0.0 110.42 179.507 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.629 ' CE1' HG23 ' A' ' 37' ' ' THR . 0.6 OUTLIER -119.0 125.13 48.67 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.049 -1.032 . . . . 0.0 110.523 179.83 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.603 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.6 t80 -88.2 126.56 35.21 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.467 0.651 . . . . 0.0 109.865 -179.173 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.578 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.2 OUTLIER -92.71 -28.39 16.67 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.471 -0.768 . . . . 0.0 110.164 -179.394 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.603 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.4 mt . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.45 -179.689 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.275 0.559 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.511 ' HB2' HG11 ' A' ' 23' ' ' VAL . 0.8 OUTLIER -142.79 113.18 7.27 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.313 -0.867 . . . . 0.0 110.148 -179.992 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.537 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 2.4 tt -107.95 177.69 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.302 -0.874 . . . . 0.0 110.234 -179.941 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -153.46 169.65 22.64 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.243 -0.911 . . . . 0.0 110.139 -179.936 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.71 167.51 9.85 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 110.196 -179.988 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 39.9 m -102.14 -149.45 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 110.217 179.994 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -139.8 -169.65 2.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.227 -0.921 . . . . 0.0 110.064 -179.979 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 78.4 p -82.46 9.82 8.43 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.938 . . . . 0.0 110.221 179.999 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -123.34 20.29 9.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.19 -0.944 . . . . 0.0 110.209 -179.953 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 9.8 ttt -146.05 22.31 1.39 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.227 -0.92 . . . . 0.0 110.301 -179.971 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -118.19 94.97 4.69 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.305 -0.872 . . . . 0.0 110.203 179.942 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -155.12 28.64 0.64 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.933 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -122.98 -61.74 1.41 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.21 -1.17 . . . . 0.0 110.261 179.94 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.515 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.6 p -90.8 119.26 30.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.204 -0.935 . . . . 0.0 110.351 -179.816 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.608 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.4 mt -80.89 -42.9 20.7 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.326 -0.859 . . . . 0.0 109.999 179.794 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.608 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.2 m80 -118.36 80.98 1.61 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.355 -0.841 . . . . 0.0 110.36 -179.421 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.402 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -170.31 165.94 39.19 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.943 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.476 ' HB2' ' HB3' ' A' ' 31' ' ' ARG . 3.3 mt-30 -80.89 148.92 29.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.212 -1.17 . . . . 0.0 110.149 179.946 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 15.3 t -103.38 119.64 39.27 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.34 -0.85 . . . . 0.0 110.255 179.911 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.804 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -142.35 -175.69 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.205 -0.934 . . . . 0.0 110.372 179.959 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.475 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 6.3 t80 -143.51 126.68 16.54 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.241 -0.912 . . . . 0.0 109.696 179.89 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.537 HD13 ' CB ' ' A' ' 29' ' ' TYR . 1.6 mp -79.46 132.11 36.26 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.191 -0.943 . . . . 0.0 111.011 -179.529 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.511 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.6 p -90.31 -29.37 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.487 -0.758 . . . . 0.0 110.241 179.942 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -78.31 -15.69 58.48 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.129 -0.982 . . . . 0.0 108.735 179.042 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.524 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -142.57 64.43 1.37 Allowed 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.037 -1.098 . . . . 0.0 108.037 178.642 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.475 ' C ' ' O ' ' A' ' 25' ' ' MET . 44.8 p -29.14 89.64 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.725 0.774 . . . . 0.0 111.476 -178.52 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.524 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.03 146.7 16.03 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.713 -0.617 . . . . 0.0 109.484 179.93 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.607 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 1.0 OUTLIER -63.6 110.1 1.89 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 110.189 -179.953 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.537 ' CB ' HD13 ' A' ' 22' ' ' LEU . 5.4 t80 -99.39 134.6 42.03 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.367 -0.833 . . . . 0.0 109.729 179.889 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.2 m -130.22 114.48 15.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.082 -1.011 . . . . 0.0 110.566 -179.682 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.476 ' HB3' ' HB2' ' A' ' 18' ' ' GLN . 3.6 tpp180 -79.81 130.98 35.78 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.162 -0.961 . . . . 0.0 109.531 179.525 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 12.2 m -79.78 159.53 26.52 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.222 -0.924 . . . . 0.0 110.121 -179.689 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 35' ' ' GLY . 9.9 tt0 -79.17 107.28 11.82 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.24 -0.912 . . . . 0.0 109.481 179.694 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.442 HG23 ' H ' ' A' ' 34' ' ' VAL . 37.3 t -42.87 97.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.638 -0.664 . . . . 0.0 110.02 -179.558 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 152.78 -16.07 0.72 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.958 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.572 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.5 m-85 -79.67 169.23 18.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.077 -1.249 . . . . 0.0 110.11 179.964 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 37' ' ' THR . . . . . 1.057 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -113.44 31.86 6.19 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.997 -1.064 . . . . 0.0 110.711 -179.764 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.665 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -152.46 157.22 27.15 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.671 -1.371 . . . . 0.0 109.671 179.676 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.445 ' O ' HG22 ' A' ' 39' ' ' VAL . 9.4 p -87.86 20.63 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.271 -1.135 . . . . 0.0 109.965 179.814 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.589 ' CZ ' ' CB ' ' A' ' 42' ' ' GLU . 4.3 tmm_? -124.05 -20.36 5.36 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.191 179.851 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.2 m 72.79 82.53 0.13 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.326 -0.859 . . . . 0.0 109.945 179.75 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.589 ' CB ' ' CZ ' ' A' ' 40' ' ' ARG . 0.9 OUTLIER -155.54 -30.7 0.1 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.453 -0.78 . . . . 0.0 111.047 -179.871 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 1.057 ' CD2' HG23 ' A' ' 37' ' ' THR . 22.4 p-80 -122.15 121.51 37.06 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.69 -1.256 . . . . 0.0 110.881 179.783 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.607 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.6 t80 -83.66 108.65 16.88 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.243 0.544 . . . . 0.0 109.891 -179.884 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.573 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -69.74 -16.84 63.39 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.318 -0.864 . . . . 0.0 109.958 -179.707 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.607 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.307 -179.835 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 45.4 t . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.165 0.507 . . . . 0.0 110.122 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.572 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.8 OUTLIER -160.14 156.09 26.15 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.251 -0.905 . . . . 0.0 110.216 179.985 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.563 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -124.93 160.72 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.254 -0.904 . . . . 0.0 110.169 179.823 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.477 ' O ' HG22 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -135.97 -178.39 5.12 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.264 -0.897 . . . . 0.0 110.079 -179.559 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.415 ' H ' HG22 ' A' ' 4' ' ' THR . 22.3 mttt -84.5 -177.72 6.7 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.237 -0.914 . . . . 0.0 110.028 179.9 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.424 ' O ' ' CB ' ' A' ' 7' ' ' SER . 63.1 m -108.85 -104.14 0.36 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.182 -0.949 . . . . 0.0 110.396 -179.923 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.482 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.1 OUTLIER 174.07 -164.35 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.954 -1.091 . . . . 0.0 110.195 -179.886 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.482 ' N ' ' OG ' ' A' ' 7' ' ' SER . 0.7 OUTLIER -82.75 169.68 15.9 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.178 -0.951 . . . . 0.0 110.121 179.895 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.404 ' C ' ' O ' ' A' ' 8' ' ' SER . 12.1 m-20 43.17 26.41 0.09 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.247 -0.908 . . . . 0.0 110.2 -179.917 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.415 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.8 OUTLIER -124.68 4.33 8.2 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.24 -0.913 . . . . 0.0 110.334 -179.88 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -106.69 82.58 1.73 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.215 -0.928 . . . . 0.0 110.218 179.943 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -137.34 25.55 3.0 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.973 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -125.17 -52.74 1.63 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.227 -1.16 . . . . 0.0 110.241 -179.967 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.52 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 20.1 p -106.82 120.47 42.11 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.337 -0.852 . . . . 0.0 110.43 -179.974 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.592 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.7 mt -89.83 -43.39 10.67 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.256 -0.902 . . . . 0.0 110.432 -179.973 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.592 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.0 m80 -110.26 88.5 2.78 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.278 -0.889 . . . . 0.0 110.077 -179.482 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.429 ' C ' ' OE1' ' A' ' 18' ' ' GLN . . . 174.91 -126.61 1.2 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 -179.873 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.579 ' NE2' ' CG ' ' A' ' 31' ' ' ARG . 14.6 pm0 -160.5 134.72 7.26 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.433 -1.04 . . . . 0.0 110.248 179.642 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.486 ' C ' ' CG1' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -81.45 148.9 29.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.262 -0.899 . . . . 0.0 110.374 -179.692 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.002 HD12 ' CD1' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -159.57 -172.22 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.235 -0.915 . . . . 0.0 109.643 179.913 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.45 ' O ' HG13 ' A' ' 3' ' ' ILE . 4.5 t80 -151.81 128.92 11.12 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.076 -1.015 . . . . 0.0 110.271 -179.636 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.57 HD11 ' HD2' ' A' ' 29' ' ' TYR . 36.4 mt -79.34 130.39 35.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.146 -0.971 . . . . 0.0 110.866 -179.696 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.572 HG12 ' O ' ' A' ' 2' ' ' SER . 4.6 p -90.3 -34.05 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.157 -0.964 . . . . 0.0 109.968 179.361 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 25' ' ' MET . 3.0 p30 -78.23 -20.88 50.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.152 -0.967 . . . . 0.0 108.586 179.101 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.506 ' O ' ' C ' ' A' ' 26' ' ' SER . 3.9 ttm -136.78 61.5 1.63 Allowed 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.559 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.506 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -29.52 92.66 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 122.106 0.955 . . . . 0.0 111.206 -178.608 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -158.73 141.25 14.24 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.933 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -55.81 113.88 1.67 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.104 -0.997 . . . . 0.0 110.504 -179.511 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 1.002 ' CD1' HD12 ' A' ' 20' ' ' ILE . 4.4 t80 -105.93 120.98 43.13 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.349 -0.844 . . . . 0.0 109.789 179.73 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.52 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -127.17 111.41 13.95 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.113 -0.992 . . . . 0.0 110.18 179.804 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.579 ' CG ' ' NE2' ' A' ' 18' ' ' GLN . 13.2 tpp180 -84.64 103.88 14.14 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.129 -0.982 . . . . 0.0 110.036 179.777 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 73.6 m -80.57 173.98 12.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.323 -0.861 . . . . 0.0 110.28 -179.842 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -79.89 133.46 36.23 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.277 -0.889 . . . . 0.0 109.896 179.892 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.8 t -71.35 -26.38 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.282 -0.887 . . . . 0.0 110.469 -179.531 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.45 -12.12 31.19 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.805 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.573 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.0 OUTLIER -79.57 178.4 8.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.182 -1.187 . . . . 0.0 110.279 -179.974 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 37' ' ' THR . . . . . 1.022 HG23 ' CD2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -110.39 25.28 11.95 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.128 -0.982 . . . . 0.0 110.267 179.61 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.768 ' HA3' ' HE1' ' A' ' 43' ' ' HIS . . . -158.28 157.52 28.39 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.652 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.785 HG12 ' O ' ' A' ' 39' ' ' VAL . 70.7 t -84.67 44.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.219 -1.165 . . . . 0.0 109.823 179.715 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.591 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.4 OUTLIER -157.32 20.04 0.29 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.441 -0.787 . . . . 0.0 109.972 -179.523 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.1 p 28.24 89.75 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.429 0.633 . . . . 0.0 111.399 179.724 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.591 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.8 tm-20 -153.63 -37.03 0.1 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.432 -0.793 . . . . 0.0 110.143 179.865 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 1.022 ' CD2' HG23 ' A' ' 37' ' ' THR . 29.0 p-80 -119.59 121.52 39.51 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.0 110.221 179.209 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.606 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 24.7 t80 -84.95 120.16 26.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.696 -0.627 . . . . 0.0 110.064 -179.505 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.542 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -87.14 -12.16 47.86 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.479 -0.763 . . . . 0.0 109.916 -179.572 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.606 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.8 mt . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 117.926 -1.035 . . . . 0.0 110.274 -179.882 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.0 m . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.331 0.586 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.514 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.4 OUTLIER -98.72 42.43 1.1 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.253 -0.904 . . . . 0.0 110.105 -179.924 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.836 HD11 ' HB ' ' A' ' 20' ' ' ILE . 3.0 tt -142.74 161.71 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.313 -0.867 . . . . 0.0 110.179 179.96 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.483 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.3 m -143.57 162.25 36.37 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.223 -0.923 . . . . 0.0 110.221 179.755 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 mtmp? -86.56 167.73 14.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.222 -0.924 . . . . 0.0 110.178 -179.882 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 75.5 m -90.59 -178.39 5.29 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.305 -0.872 . . . . 0.0 110.233 179.983 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.7 t -108.25 -153.17 0.5 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.923 . . . . 0.0 110.265 -179.895 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.5 172.04 11.29 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.341 -0.849 . . . . 0.0 110.304 -179.991 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t0 45.26 25.3 0.19 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.222 -0.924 . . . . 0.0 110.157 -179.953 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.16 2.86 8.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.178 -0.951 . . . . 0.0 110.291 179.992 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -101.55 47.63 0.9 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.273 -0.892 . . . . 0.0 110.261 -179.985 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -120.44 16.0 9.84 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.997 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.0 t80 -105.45 -53.23 2.69 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -1.161 . . . . 0.0 110.276 179.972 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.466 ' HB2' ' SG ' ' A' ' 41' ' ' CYS . 23.4 p -109.89 118.05 35.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.264 -0.897 . . . . 0.0 110.31 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.581 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -90.35 -43.11 10.54 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.233 -0.917 . . . . 0.0 110.338 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.581 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.3 m80 -107.85 83.94 1.88 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.31 -0.869 . . . . 0.0 110.015 -179.538 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.492 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 175.73 -161.22 29.89 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.813 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -121.78 133.98 54.92 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.251 -1.147 . . . . 0.0 110.119 179.827 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.587 ' C ' HG23 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -85.61 140.34 30.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.226 -0.921 . . . . 0.0 110.318 -179.831 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.068 HD11 ' CD1' ' A' ' 29' ' ' TYR . 32.8 pt -157.65 -167.95 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 110.075 -179.949 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.529 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 11.2 t80 -147.08 139.69 24.88 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.907 . . . . 0.0 110.04 -179.919 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.663 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.5 mm? -92.2 134.52 34.8 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.105 -0.997 . . . . 0.0 110.743 -179.725 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.514 HG11 ' CB ' ' A' ' 2' ' ' SER . 7.5 p -90.66 -28.32 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.239 -0.913 . . . . 0.0 110.658 179.997 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.541 ' OD1' HD12 ' A' ' 22' ' ' LEU . 58.0 p30 -78.17 -12.98 60.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.922 -1.111 . . . . 0.0 108.892 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -146.41 65.78 1.19 Allowed 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.777 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.529 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 20.5 p -30.03 87.93 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.64 0.733 . . . . 0.0 111.928 -178.466 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.7 tt0 -158.59 168.05 27.93 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.581 -0.7 . . . . 0.0 109.763 179.531 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -76.52 127.47 32.89 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.398 -0.814 . . . . 0.0 110.373 -179.86 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 1.068 ' CD1' HD11 ' A' ' 20' ' ' ILE . 6.3 t80 -122.31 119.83 32.29 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.422 -0.798 . . . . 0.0 109.816 179.906 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 22.2 m -123.79 115.15 20.89 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.128 -0.983 . . . . 0.0 110.51 -179.561 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.492 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 8.1 tpp85 -80.97 115.71 20.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.263 -0.898 . . . . 0.0 109.675 179.528 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 87.4 m -79.68 168.84 18.82 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.237 -0.914 . . . . 0.0 110.512 -179.667 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -79.84 115.44 19.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.415 -0.803 . . . . 0.0 110.216 -179.866 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.439 ' H ' HG23 ' A' ' 34' ' ' VAL . 37.2 t -54.83 110.06 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.347 -0.846 . . . . 0.0 109.778 179.748 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 138.9 -8.23 3.3 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.701 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.22 177.09 9.09 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.158 -1.201 . . . . 0.0 109.908 179.943 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.606 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.62 29.88 7.33 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.92 -1.112 . . . . 0.0 110.115 -179.913 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.01 155.77 26.92 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.384 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.57 ' O ' HG22 ' A' ' 39' ' ' VAL . 14.8 p -85.12 44.27 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.24 -1.153 . . . . 0.0 109.628 179.547 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.22 22.26 0.16 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.491 -0.755 . . . . 0.0 109.909 -179.374 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 11.8 p 29.63 90.28 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.612 -0.68 . . . . 0.0 111.351 179.625 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.6 tm-20 -151.85 -45.04 0.11 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.162 -0.961 . . . . 0.0 110.415 179.943 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.606 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 3.0 p-80 -117.85 129.62 55.76 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.074 -1.017 . . . . 0.0 110.817 179.883 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.664 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 14.8 t80 -87.03 126.44 34.75 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.399 0.619 . . . . 0.0 109.978 -178.794 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.576 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -84.92 2.48 42.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.473 -0.767 . . . . 0.0 109.954 -179.598 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.664 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.4 mt . . . . . 0 C--N 1.302 -1.496 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.31 -179.518 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.8 m . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.275 0.56 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.819 ' H ' HG11 ' A' ' 23' ' ' VAL . 40.8 t -106.91 102.62 11.96 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.27 -0.894 . . . . 0.0 110.2 179.909 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.811 HD11 ' CG2' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -100.02 156.66 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.326 -0.859 . . . . 0.0 110.349 179.974 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.513 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 3.2 m -137.25 166.72 23.09 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.141 179.955 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.9 mttt -106.61 156.08 18.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.214 -0.929 . . . . 0.0 110.35 -179.945 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.637 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 90.7 m -81.8 -160.82 0.38 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.276 -0.89 . . . . 0.0 110.149 -179.948 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.0 t -131.81 -159.62 0.98 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.252 -0.905 . . . . 0.0 110.221 179.967 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.0 m -80.33 171.23 15.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.263 -0.898 . . . . 0.0 110.214 179.967 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 46.5 24.02 0.27 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.279 -0.888 . . . . 0.0 110.238 -179.951 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.11 7.73 7.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.218 -0.926 . . . . 0.0 110.28 -179.981 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -115.22 96.79 5.85 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.223 -0.923 . . . . 0.0 110.229 -179.93 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.56 39.19 1.31 Allowed Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.995 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.445 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 82.6 t80 -142.42 -53.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -1.143 . . . . 0.0 110.262 -179.932 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.3 p -100.86 118.34 36.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.458 -179.833 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.568 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.8 mt -90.49 -43.05 10.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.248 -0.907 . . . . 0.0 110.328 179.838 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.568 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.3 m80 -108.24 83.13 1.73 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.269 -0.894 . . . . 0.0 110.289 -179.403 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 179.33 -134.26 2.25 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.999 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.5 pt20 -160.28 142.6 13.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -1.136 . . . . 0.0 110.387 179.981 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.837 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -83.37 135.51 34.68 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.192 -0.943 . . . . 0.0 110.036 179.739 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.837 HD13 ' O ' ' A' ' 19' ' ' CYS . 37.9 mm -143.13 169.74 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.155 -0.966 . . . . 0.0 110.257 -179.643 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.513 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 23.6 t80 -131.45 140.2 49.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.021 -1.049 . . . . 0.0 110.052 179.813 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.576 HD23 ' HB2' ' A' ' 29' ' ' TYR . 3.2 mm? -102.63 138.61 39.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.125 -0.985 . . . . 0.0 110.927 -179.57 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.819 HG11 ' H ' ' A' ' 2' ' ' SER . 7.5 p -90.4 -28.29 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.279 -0.888 . . . . 0.0 110.479 179.936 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -78.23 -17.81 56.23 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.087 -1.008 . . . . 0.0 108.769 179.351 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.576 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -139.57 62.78 1.51 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.685 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.6 p -29.21 85.54 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 121.565 0.698 . . . . 0.0 112.003 -178.284 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.576 ' N ' ' O ' ' A' ' 25' ' ' MET . 9.9 pt20 -161.39 -177.29 5.89 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.577 -0.702 . . . . 0.0 109.385 179.354 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -82.14 163.94 21.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.27 -0.894 . . . . 0.0 110.254 179.937 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.576 ' HB2' HD23 ' A' ' 22' ' ' LEU . 8.6 t80 -150.91 90.45 1.62 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.282 -0.886 . . . . 0.0 109.97 179.875 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.7 m -91.84 101.67 14.26 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.292 -0.88 . . . . 0.0 110.388 -179.735 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.455 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.9 OUTLIER -79.28 118.39 21.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.194 -0.941 . . . . 0.0 109.654 179.589 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 82.1 m -79.73 170.45 16.5 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.373 -0.83 . . . . 0.0 110.36 -179.738 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -79.78 116.22 19.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.356 -0.84 . . . . 0.0 110.118 -179.931 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 t -53.65 105.48 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.266 -0.896 . . . . 0.0 109.678 179.897 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.94 -10.7 1.85 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.663 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.547 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.15 178.6 7.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.12 -1.223 . . . . 0.0 109.673 179.876 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.601 HG23 ' O ' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -109.65 25.77 11.42 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 118.793 -1.163 . . . . 0.0 110.57 -179.799 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.42 160.28 31.62 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 179.29 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.517 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.5 p -87.09 38.13 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.115 -1.226 . . . . 0.0 109.622 179.382 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.57 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -146.31 14.01 1.26 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.562 -0.711 . . . . 0.0 109.65 -179.684 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 8.0 p 31.07 93.29 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.515 -0.74 . . . . 0.0 111.242 179.757 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.57 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.1 tm-20 -159.5 -38.38 0.06 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.509 -0.745 . . . . 0.0 110.022 179.612 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.601 ' O ' HG23 ' A' ' 37' ' ' THR . 2.1 p-80 -120.28 125.6 48.5 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 122.166 0.984 . . . . 0.0 110.538 179.78 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.616 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.2 t80 -85.59 127.48 34.47 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.338 0.589 . . . . 0.0 109.88 -179.026 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.55 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -86.89 -35.48 18.95 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.359 -0.838 . . . . 0.0 110.023 -179.5 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.616 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.7 mt . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.295 -179.775 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 1' ' ' VAL . 6.4 m . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.183 0.516 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -115.18 120.08 38.53 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.274 -0.891 . . . . 0.0 110.228 -179.996 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.971 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -143.9 154.74 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.281 -0.887 . . . . 0.0 110.186 -179.938 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.02 164.07 18.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.264 -0.898 . . . . 0.0 110.311 179.98 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.4 168.06 9.56 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.295 -0.878 . . . . 0.0 110.204 179.993 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.615 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 71.8 m -107.84 -170.93 1.77 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.213 -0.929 . . . . 0.0 110.223 179.99 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -116.85 -155.17 0.58 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.339 -0.851 . . . . 0.0 110.184 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.81 170.26 16.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.206 -0.933 . . . . 0.0 110.184 179.986 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.3 15.1 3.2 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.226 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.94 15.06 9.99 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.0 110.305 -179.977 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -128.71 114.17 16.28 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.225 -0.922 . . . . 0.0 110.088 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.15 27.71 0.19 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 -179.944 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -131.02 -47.59 1.01 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.246 -1.149 . . . . 0.0 110.204 179.914 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.547 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 17.1 p -102.78 123.38 46.34 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.296 -0.877 . . . . 0.0 110.134 179.901 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.6 ' N ' HD23 ' A' ' 15' ' ' LEU . 4.2 mt -90.5 -52.33 4.96 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.276 -0.89 . . . . 0.0 110.406 -179.823 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.502 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 10.5 m80 -99.04 82.81 2.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.37 -0.831 . . . . 0.0 110.358 -179.267 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 178.69 -135.31 2.57 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.93 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.464 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 5.0 pt20 -160.34 145.82 14.99 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -1.102 . . . . 0.0 110.23 179.863 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.615 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 41.9 t -89.43 131.13 35.64 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -0.876 . . . . 0.0 110.051 179.963 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.038 HD11 ' CD1' ' A' ' 29' ' ' TYR . 20.5 pt -143.46 -172.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.374 -0.829 . . . . 0.0 110.085 -179.865 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.53 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 14.9 t80 -142.66 132.53 24.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.242 -0.911 . . . . 0.0 109.868 179.861 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.625 HD23 ' CB ' ' A' ' 29' ' ' TYR . 2.5 mm? -86.49 131.57 34.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.14 -0.975 . . . . 0.0 110.612 -179.726 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.9 p -90.32 -25.04 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.257 -0.902 . . . . 0.0 110.504 179.919 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -78.38 -4.74 49.7 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.024 -1.048 . . . . 0.0 108.858 179.015 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.2 ttt -159.12 68.5 0.44 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 179.183 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 17.9 p -29.51 88.79 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.708 0.766 . . . . 0.0 111.471 -178.484 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.0 OUTLIER -160.49 148.44 16.3 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.629 -0.669 . . . . 0.0 109.462 -179.963 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.6 t-20 -59.08 148.93 29.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.283 -0.886 . . . . 0.0 109.853 179.921 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 1.038 ' CD1' HD11 ' A' ' 20' ' ' ILE . 5.4 t80 -145.82 114.43 6.8 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.161 -0.962 . . . . 0.0 110.328 -179.517 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.547 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.7 m -108.3 111.46 23.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.056 -1.028 . . . . 0.0 110.241 -179.964 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.49 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 1.6 tpp180 -85.61 114.48 22.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.253 -0.904 . . . . 0.0 110.017 179.717 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 96.6 m -79.82 175.99 10.13 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.315 -0.865 . . . . 0.0 110.509 -179.921 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -81.16 115.82 20.76 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.273 -0.892 . . . . 0.0 110.249 -179.944 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 59.7 t -52.16 105.84 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.194 -0.942 . . . . 0.0 109.909 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.547 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 146.62 -13.57 1.56 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 -179.872 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.502 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.54 174.34 11.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.35 -1.088 . . . . 0.0 109.951 179.886 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 37' ' ' THR . . . . . 1.025 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.4 OUTLIER -106.01 -32.45 8.29 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 118.86 -1.136 . . . . 0.0 111.117 -179.674 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.515 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -92.13 159.51 25.42 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.928 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.601 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.9 p -84.85 44.41 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.247 -1.149 . . . . 0.0 109.531 179.455 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.6 27.11 0.19 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.544 -0.722 . . . . 0.0 109.789 -179.339 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 3.2 p 28.5 91.94 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.606 -0.684 . . . . 0.0 111.472 179.577 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 15.4 tm-20 -157.47 -37.96 0.07 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.36 -0.838 . . . . 0.0 110.199 179.599 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 1.025 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.0 p80 -125.29 128.47 48.29 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.048 -1.032 . . . . 0.0 111.159 179.678 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.59 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 89.4 t80 -93.93 112.81 24.71 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.724 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.592 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -94.94 -10.54 30.76 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.266 -0.896 . . . . 0.0 110.197 -179.102 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.59 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 7.5 mt . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.213 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.57 ' HB2' HG11 ' A' ' 23' ' ' VAL . 94.0 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.265 0.555 . . . . 0.0 110.084 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.821 HG12 HG22 ' A' ' 20' ' ' ILE . 9.4 tt -141.23 169.58 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.349 -0.844 . . . . 0.0 110.066 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.518 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 4.0 m -141.35 167.27 22.56 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.303 -0.873 . . . . 0.0 110.423 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -80.98 -170.43 2.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.2 -0.937 . . . . 0.0 110.151 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 99.5 m -116.08 172.67 7.02 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.206 -0.934 . . . . 0.0 110.255 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 t -110.91 -151.28 0.48 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.339 -0.851 . . . . 0.0 110.32 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.8 m -84.62 172.76 11.32 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.336 -0.853 . . . . 0.0 110.318 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 45.29 24.84 0.17 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.36 -0.838 . . . . 0.0 110.296 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.5 2.17 10.16 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.187 -0.945 . . . . 0.0 110.211 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.67 76.47 1.4 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 110.126 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -135.02 27.83 3.12 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -135.64 -60.49 0.74 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.236 -1.155 . . . . 0.0 110.199 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -91.47 120.28 32.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.323 -0.861 . . . . 0.0 110.145 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.8 mt -90.08 -41.88 11.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.19 -0.944 . . . . 0.0 110.493 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.597 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.8 m80 -114.4 85.09 2.17 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.258 -0.901 . . . . 0.0 110.098 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.505 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.03 178.18 42.11 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -99.75 140.61 33.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.311 -1.111 . . . . 0.0 110.143 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 1.004 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -85.43 134.32 34.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.311 -0.868 . . . . 0.0 110.278 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.004 HD13 ' O ' ' A' ' 19' ' ' CYS . 0.4 OUTLIER -139.4 -174.34 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.825 0 O-C-N 121.204 -0.935 . . . . 0.0 109.58 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.493 ' O ' HG13 ' A' ' 3' ' ' ILE . 11.3 t80 -149.31 123.46 9.5 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.919 -1.113 . . . . 0.0 110.504 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.734 HD12 ' NE2' ' A' ' 27' ' ' GLN . 21.0 mt -79.52 132.11 36.23 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.236 -0.915 . . . . 0.0 110.947 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.57 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.7 p -90.09 -33.36 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.244 -0.91 . . . . 0.0 109.864 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -78.29 -20.92 50.53 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.231 -0.918 . . . . 0.0 108.58 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.523 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.1 tpt -133.06 60.27 1.71 Allowed 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.479 ' C ' ' O ' ' A' ' 25' ' ' MET . 3.6 p -29.21 89.45 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.667 0.746 . . . . 0.0 111.611 -178.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.734 ' NE2' HD12 ' A' ' 22' ' ' LEU . 2.6 pt20 -159.85 170.44 21.43 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.712 -0.617 . . . . 0.0 109.431 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -81.15 116.23 20.96 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.261 -0.899 . . . . 0.0 110.508 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HD2' HD11 ' A' ' 22' ' ' LEU . 4.3 t80 -109.96 103.92 12.76 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.394 -0.816 . . . . 0.0 109.475 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 65.9 m -108.26 114.67 28.72 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.191 -0.943 . . . . 0.0 110.395 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.505 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.8 tpp85 -79.54 120.73 24.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.896 . . . . 0.0 109.401 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.561 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 95.5 m -78.98 171.84 14.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.138 -0.976 . . . . 0.0 110.471 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -79.38 121.24 24.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.391 -0.818 . . . . 0.0 110.037 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 32.6 t -52.51 104.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.222 -0.924 . . . . 0.0 109.73 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.612 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 144.56 -10.77 1.94 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.34 172.02 14.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.214 -1.168 . . . . 0.0 109.843 179.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.909 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -113.39 31.67 6.31 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.891 -1.13 . . . . 0.0 111.066 -179.253 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.43 155.44 26.59 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.56 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.5 p -85.69 43.5 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.308 -1.113 . . . . 0.0 109.475 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.574 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -156.64 20.14 0.33 Allowed 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.565 -0.709 . . . . 0.0 109.787 -179.353 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.561 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 5.2 p 27.57 90.73 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.685 -0.634 . . . . 0.0 111.614 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.574 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 10.4 tm-20 -154.89 -36.51 0.09 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.469 -0.769 . . . . 0.0 110.197 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.909 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.9 p80 -120.42 119.51 33.26 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.016 -1.053 . . . . 0.0 110.626 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.597 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 41.3 t80 -82.78 114.79 21.35 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.332 0.587 . . . . 0.0 110.045 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.532 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -77.98 -35.07 50.59 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.315 -0.866 . . . . 0.0 110.105 -179.69 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.612 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.6 mt . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.338 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.546 ' HB2' ' CG1' ' A' ' 23' ' ' VAL . 1.4 p . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.291 0.567 . . . . 0.0 110.121 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.685 ' CG1' HG22 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -155.93 166.58 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.363 -0.836 . . . . 0.0 110.464 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.4 m -149.11 172.22 15.15 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.365 -0.835 . . . . 0.0 110.142 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.67 175.54 5.41 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.229 -0.92 . . . . 0.0 110.227 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 93.7 m -117.09 176.63 5.04 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.291 -0.881 . . . . 0.0 110.26 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -155.96 17.22 0.36 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 0.0 110.672 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.0 m -151.79 -70.39 0.16 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.187 -0.946 . . . . 0.0 110.246 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -80.25 12.9 2.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.161 -0.962 . . . . 0.0 110.552 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.544 ' HB3' ' CB ' ' A' ' 6' ' ' CYS . 22.2 ptm -78.89 -27.69 43.98 Favored 'General case' 0 C--N 1.308 -1.232 0 O-C-N 121.106 -0.996 . . . . 0.0 110.186 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.5 p30 -100.69 44.89 0.99 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.213 -0.929 . . . . 0.0 110.184 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -129.16 -39.11 0.31 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.8 t80 -94.08 -65.04 1.01 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.194 -1.18 . . . . 0.0 110.403 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.583 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 25.2 p -91.24 119.73 31.56 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.162 -0.961 . . . . 0.0 110.269 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.6 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.8 mt -87.59 -40.96 13.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.195 -0.94 . . . . 0.0 110.254 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.6 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.8 m80 -113.53 88.03 2.75 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.16 -0.963 . . . . 0.0 110.091 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.83 -168.43 41.27 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -117.24 134.62 54.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -1.117 . . . . 0.0 110.052 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 3.8 t -79.84 146.8 32.04 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.228 -0.92 . . . . 0.0 109.94 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.809 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.2 mt -152.35 -176.83 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.152 -0.967 . . . . 0.0 109.841 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.508 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 20.6 t80 -147.99 117.88 7.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.111 -0.993 . . . . 0.0 109.971 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.593 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.2 mm? -79.93 130.15 35.06 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.098 -1.001 . . . . 0.0 110.195 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.546 ' CG1' ' HB2' ' A' ' 2' ' ' SER . 7.2 p -89.34 -26.05 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.245 -0.909 . . . . 0.0 110.153 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -78.39 -13.77 59.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.163 -0.96 . . . . 0.0 108.683 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.534 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -148.1 66.91 1.09 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 178.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.489 ' C ' ' O ' ' A' ' 25' ' ' MET . 80.7 p -29.15 89.14 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 121.761 0.791 . . . . 0.0 111.743 -178.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.534 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -156.8 144.36 19.08 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.607 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.452 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 9.1 t30 -62.85 108.04 1.11 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.194 -0.941 . . . . 0.0 110.455 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.809 ' CD1' HD12 ' A' ' 20' ' ' ILE . 5.7 t80 -94.31 106.06 18.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.327 -0.858 . . . . 0.0 110.017 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.583 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 1.8 m -111.74 110.07 20.24 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 110.344 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.2 tpp180 -80.05 103.62 10.06 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.169 -0.957 . . . . 0.0 109.668 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 79.3 m -79.54 171.69 14.81 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.305 -0.872 . . . . 0.0 110.247 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -79.33 126.66 31.09 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.234 -0.916 . . . . 0.0 109.836 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 12.7 t -65.99 -15.15 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 110.114 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.27 -15.62 68.05 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.529 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.5 m-85 -79.75 169.86 17.34 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.219 -1.165 . . . . 0.0 109.955 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.891 HG23 ' CE1' ' A' ' 43' ' ' HIS . 15.2 t -101.43 26.48 7.19 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 118.874 -1.131 . . . . 0.0 110.655 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.08 160.64 31.81 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 39' ' ' VAL . 10.7 p -85.04 43.76 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.1 -1.235 . . . . 0.0 109.716 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.635 ' NH2' ' CD2' ' A' ' 43' ' ' HIS . 1.1 ttp180 -150.29 13.8 0.77 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.464 -0.772 . . . . 0.0 110.224 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.3 p 29.56 88.52 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.494 -0.754 . . . . 0.0 110.886 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.561 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 3.4 tt0 -154.85 -36.9 0.09 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.267 -0.895 . . . . 0.0 110.385 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.891 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.6 p80 -127.88 124.05 36.53 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.025 -1.047 . . . . 0.0 111.327 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.543 ' CE2' ' C ' ' A' ' 46' ' ' LEU . 87.3 t80 -90.63 89.78 7.68 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.598 ' HB3' ' CB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -64.51 -21.67 66.75 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.365 -0.834 . . . . 0.0 110.322 -179.094 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.543 ' C ' ' CE2' ' A' ' 44' ' ' PHE . 7.2 mt . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.211 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.649 ' HB2' HG11 ' A' ' 23' ' ' VAL . 6.6 m . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.24 0.543 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.635 HD11 ' HB ' ' A' ' 20' ' ' ILE . 1.3 tt -112.21 150.79 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.487 ' HG1' ' HD1' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -116.23 161.53 18.85 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.272 -0.893 . . . . 0.0 110.204 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.0 tptt -85.09 158.62 20.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.172 -0.955 . . . . 0.0 110.186 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 75.6 m -90.13 -173.46 3.85 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.326 -0.859 . . . . 0.0 110.252 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.7 t -124.96 -152.2 0.51 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.869 . . . . 0.0 110.203 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.34 170.73 10.31 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.297 -0.877 . . . . 0.0 110.1 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.2 t70 52.68 19.57 1.29 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.244 -0.91 . . . . 0.0 110.232 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -118.15 5.33 11.98 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.333 -0.855 . . . . 0.0 110.276 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -105.84 76.21 1.17 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.203 -0.935 . . . . 0.0 110.215 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -125.87 -27.19 1.17 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.834 -1.307 . . . . 0.0 109.834 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.41 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 72.4 t80 -81.43 -52.77 6.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -1.179 . . . . 0.0 110.469 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 28.0 p -99.61 119.77 38.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.259 -0.901 . . . . 0.0 110.511 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.573 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.8 mt -90.49 -43.49 10.21 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.191 -0.943 . . . . 0.0 110.367 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 7.1 m80 -110.98 86.28 2.28 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.223 -0.923 . . . . 0.0 110.219 -179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.503 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 173.83 177.41 43.01 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -97.6 148.27 23.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.24 -1.153 . . . . 0.0 110.059 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -97.75 134.65 40.63 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.25 -0.906 . . . . 0.0 110.231 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.764 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -148.85 -172.36 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 110.048 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.487 ' HD1' ' HG1' ' A' ' 4' ' ' THR . 17.7 t80 -142.19 133.38 26.18 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.174 -0.954 . . . . 0.0 110.067 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.632 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.1 mm? -86.26 130.88 34.37 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.08 -1.012 . . . . 0.0 110.604 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.649 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.5 p -90.51 -25.7 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.265 -0.897 . . . . 0.0 110.47 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.602 ' OD1' HG13 ' A' ' 23' ' ' VAL . 22.1 m-20 -78.37 -11.69 59.96 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.106 -0.996 . . . . 0.0 108.792 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -151.18 67.9 0.92 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.017 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 25' ' ' MET . 67.2 p -29.3 90.1 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.673 0.749 . . . . 0.0 111.282 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -159.42 148.6 18.23 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.521 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 2.8 p-10 -64.04 116.71 6.15 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.247 -0.908 . . . . 0.0 110.284 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.632 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.8 t80 -105.86 138.45 42.03 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.26 -0.9 . . . . 0.0 109.775 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 6.8 m -135.55 120.64 18.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.022 -1.049 . . . . 0.0 110.702 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.503 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -94.28 119.21 32.72 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.213 -0.929 . . . . 0.0 109.524 179.303 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.531 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 91.7 m -79.45 173.82 12.2 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.304 -0.873 . . . . 0.0 110.514 -179.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.54 117.57 20.6 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.354 -0.841 . . . . 0.0 109.927 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.1 t -49.09 102.07 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.242 -0.911 . . . . 0.0 109.761 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.539 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 147.16 -12.24 1.41 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.3 167.18 21.27 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.176 -1.191 . . . . 0.0 109.698 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.932 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.95 35.0 3.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.959 -1.088 . . . . 0.0 110.91 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.25 158.99 30.39 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 39' ' ' VAL . 6.5 p -88.04 29.43 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.224 -1.162 . . . . 0.0 109.866 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -145.91 20.31 1.45 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.444 -0.785 . . . . 0.0 109.749 -179.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.531 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 6.4 p 30.55 94.56 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 CA-C-O 121.529 0.681 . . . . 0.0 111.308 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -155.07 -37.0 0.09 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.514 -0.741 . . . . 0.0 110.097 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.932 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.6 p80 -121.72 117.63 27.11 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.14 -0.975 . . . . 0.0 110.295 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 39.9 t80 -80.32 111.46 16.72 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.36 0.6 . . . . 0.0 109.991 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.532 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -74.05 -31.94 63.1 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.435 -0.791 . . . . 0.0 110.133 -179.659 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.247 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.755 ' HB3' HG11 ' A' ' 23' ' ' VAL . 29.2 t . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.233 0.54 . . . . 0.0 110.219 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.675 HD11 ' HB ' ' A' ' 20' ' ' ILE . 5.7 tt -79.56 156.04 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.232 -0.917 . . . . 0.0 110.386 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.484 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.2 OUTLIER -124.29 -171.45 2.34 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.356 -0.84 . . . . 0.0 110.162 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 20' ' ' ILE . 14.1 mtpt -125.94 158.42 35.24 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.296 -0.877 . . . . 0.0 110.231 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.495 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 23.2 m -86.7 -150.62 0.16 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.878 . . . . 0.0 110.146 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -149.96 -155.35 0.62 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.218 -0.926 . . . . 0.0 110.125 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.9 m -90.32 27.92 1.56 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.245 -0.91 . . . . 0.0 110.124 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.444 ' OD1' ' O ' ' A' ' 9' ' ' ASP . 56.2 t0 -144.87 31.42 1.15 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.28 -0.888 . . . . 0.0 110.201 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.2 tpp -152.39 17.51 0.63 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.331 -0.856 . . . . 0.0 110.208 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -106.54 81.92 1.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -133.69 4.4 4.72 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -115.22 -56.63 2.34 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.254 -1.145 . . . . 0.0 110.113 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.581 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -96.55 116.48 29.16 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.167 -0.958 . . . . 0.0 110.516 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.621 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.3 mt -87.37 -40.36 14.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.389 -0.819 . . . . 0.0 110.129 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.9 m80 -118.0 87.22 2.67 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.317 -0.864 . . . . 0.0 110.325 -179.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.468 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -178.31 -169.28 38.92 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.445 ' O ' ' CD1' ' A' ' 20' ' ' ILE . 8.6 mm-40 -106.85 134.82 49.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.304 -1.115 . . . . 0.0 110.306 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.495 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -92.14 126.82 37.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.28 -0.887 . . . . 0.0 110.116 179.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.761 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -147.67 -169.64 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.233 -0.917 . . . . 0.0 110.511 -179.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.5 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 10.2 t80 -145.7 133.13 20.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.38 -0.825 . . . . 0.0 109.705 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.622 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.5 mm? -86.75 131.85 34.02 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.737 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.755 HG11 ' HB3' ' A' ' 2' ' ' SER . 4.5 p -90.7 -22.76 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.235 -0.915 . . . . 0.0 110.741 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -78.14 -9.51 59.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.069 -1.019 . . . . 0.0 108.893 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -157.11 71.02 0.64 Allowed 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.061 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.5 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 40.6 p -29.26 89.89 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.689 0.757 . . . . 0.0 111.227 -178.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -157.37 147.78 21.03 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.769 -0.582 . . . . 0.0 109.517 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.529 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.0 m120 -64.01 122.98 17.83 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.325 -0.86 . . . . 0.0 110.433 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.622 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.8 t80 -112.52 131.24 55.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.359 -0.838 . . . . 0.0 109.762 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.581 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.4 m -131.64 112.14 12.31 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.159 -0.963 . . . . 0.0 110.624 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.468 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 16.7 tpp85 -84.86 134.58 34.28 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.265 -0.897 . . . . 0.0 110.03 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.631 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 6.1 t -79.71 164.07 24.02 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.252 -0.905 . . . . 0.0 110.066 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 14.9 tt0 -79.58 110.69 15.14 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.285 -0.884 . . . . 0.0 109.495 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.427 ' C ' ' O ' ' A' ' 33' ' ' GLU . 37.6 t -43.36 96.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.503 -0.748 . . . . 0.0 109.719 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.842 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 151.52 -14.73 0.82 Allowed Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.581 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.4 m-85 -79.04 -178.33 6.06 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.109 -1.23 . . . . 0.0 109.826 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.672 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.3 OUTLIER -106.03 -57.37 2.05 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.036 -1.04 . . . . 0.0 110.662 -179.683 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.452 ' H ' ' CE1' ' A' ' 43' ' ' HIS . . . -85.41 152.86 26.99 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 39' ' ' VAL . 44.1 t -76.23 2.17 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.237 -1.155 . . . . 0.0 109.96 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.593 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 4.5 tmm_? -80.28 -10.0 59.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.336 -0.852 . . . . 0.0 109.878 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.631 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 11.2 m 59.95 66.9 0.92 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.392 -0.817 . . . . 0.0 110.476 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.593 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER -152.59 -28.25 0.16 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.067 -1.021 . . . . 0.0 111.965 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.672 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.1 p80 -122.78 121.21 35.74 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.56 -1.338 . . . . 0.0 111.659 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.638 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.8 t80 -80.14 110.46 15.57 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.869 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.564 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -74.93 -14.66 60.67 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.104 -0.998 . . . . 0.0 109.958 -179.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.842 HD12 ' O ' ' A' ' 35' ' ' GLY . 6.0 mt . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.275 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.716 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.257 0.551 . . . . 0.0 110.076 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.548 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -160.19 167.88 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.291 -0.881 . . . . 0.0 110.403 -179.656 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.517 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.2 m -144.98 162.4 37.01 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.427 -0.796 . . . . 0.0 110.039 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -119.08 157.73 27.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.252 -0.905 . . . . 0.0 110.133 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 86.3 m -91.91 -124.55 0.08 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.294 -0.879 . . . . 0.0 109.976 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.2 t -146.77 -154.38 0.55 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.972 -1.08 . . . . 0.0 110.122 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -85.04 -59.04 2.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.233 -0.917 . . . . 0.0 110.338 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -83.44 11.89 6.31 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.269 -0.895 . . . . 0.0 110.356 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 8.5 tpt -100.0 -4.42 30.07 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.264 -0.898 . . . . 0.0 110.202 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.441 ' OD1' ' O ' ' A' ' 11' ' ' ASN . 39.4 t-20 -120.89 67.87 0.87 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.232 -0.918 . . . . 0.0 110.144 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.67 24.72 16.03 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.469 ' O ' ' NH1' ' A' ' 40' ' ' ARG . 7.5 t80 -110.19 -50.04 3.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.239 -1.154 . . . . 0.0 110.231 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 1.9 m -89.04 138.16 31.66 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.428 -0.795 . . . . 0.0 110.392 -179.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.578 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.6 mt -91.44 -46.96 7.71 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.564 -0.71 . . . . 0.0 110.2 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.578 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.4 m80 -119.44 91.66 3.6 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.332 -0.855 . . . . 0.0 110.217 -179.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.13 -167.13 39.64 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -127.19 164.02 22.58 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.283 -1.127 . . . . 0.0 110.272 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.84 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.4 OUTLIER -96.23 135.2 38.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.282 -0.886 . . . . 0.0 110.315 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.84 HD13 ' O ' ' A' ' 19' ' ' CYS . 17.2 mm -134.58 173.35 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.351 -0.843 . . . . 0.0 109.825 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.517 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 19.7 t80 -144.51 127.84 16.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.923 -1.111 . . . . 0.0 110.399 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.582 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.5 mm? -89.78 133.76 34.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.258 -0.901 . . . . 0.0 110.485 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.716 HG11 ' CB ' ' A' ' 2' ' ' SER . 12.6 p -90.42 -30.55 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.171 -0.955 . . . . 0.0 110.462 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.426 ' OD1' HD12 ' A' ' 22' ' ' LEU . 3.4 p30 -78.3 -18.18 55.58 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.115 -0.991 . . . . 0.0 108.814 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.503 ' O ' ' N ' ' A' ' 27' ' ' GLN . 18.0 ttt -138.13 62.27 1.57 Allowed 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.493 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.56 92.0 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 122.119 0.961 . . . . 0.0 111.148 -178.532 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.512 ' HG3' ' N ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER -159.95 147.63 16.73 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.366 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 6.5 m120 -67.52 105.85 1.97 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.263 -0.898 . . . . 0.0 110.121 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.582 ' HB2' HD23 ' A' ' 22' ' ' LEU . 5.7 t80 -87.61 90.62 8.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.424 -0.797 . . . . 0.0 110.233 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 7.5 m -82.05 115.25 21.11 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 110.553 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -94.75 111.2 22.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.205 -0.934 . . . . 0.0 110.108 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.504 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 79.4 m -79.93 178.07 8.47 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.243 -0.911 . . . . 0.0 110.376 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -80.15 146.27 31.9 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.324 -0.86 . . . . 0.0 109.854 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.414 HG12 ' O ' ' A' ' 34' ' ' VAL . 5.1 t -76.28 29.59 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.143 -0.973 . . . . 0.0 111.818 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.689 ' O ' HD12 ' A' ' 46' ' ' LEU . . . -126.52 -5.06 6.12 Favored Glycine 0 N--CA 1.487 2.044 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.577 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 15.9 m-85 -95.4 157.51 15.86 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.354 -1.086 . . . . 0.0 109.57 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.85 HG23 ' CE1' ' A' ' 43' ' ' HIS . 10.2 t -108.85 43.47 1.25 Allowed 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 118.468 -1.293 . . . . 0.0 110.633 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.84 161.5 32.84 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.515 ' O ' HG13 ' A' ' 39' ' ' VAL . 8.8 p -87.55 35.64 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.081 -1.247 . . . . 0.0 109.568 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 0.5 OUTLIER -143.1 8.11 1.63 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.472 -0.767 . . . . 0.0 110.279 -179.428 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.504 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 2.5 p 34.02 78.8 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.379 -0.826 . . . . 0.0 111.012 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 33.5 tt0 -142.24 -33.65 0.47 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.406 -0.809 . . . . 0.0 110.159 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.85 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.5 p80 -118.76 114.61 22.95 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.995 -1.065 . . . . 0.0 109.485 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.593 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 27.0 t80 -78.68 98.07 6.08 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 121.776 0.798 . . . . 0.0 109.323 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.575 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.2 OUTLIER -64.57 -9.15 17.19 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 121.751 -0.593 . . . . 0.0 110.537 -179.015 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.689 HD12 ' O ' ' A' ' 35' ' ' GLY . 8.1 mt . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.724 ' HB3' HG11 ' A' ' 23' ' ' VAL . 3.0 t . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.277 0.561 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.623 HD11 ' HB ' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.79 152.22 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.278 -0.889 . . . . 0.0 110.146 179.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.47 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -124.03 -165.14 1.31 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.245 -0.909 . . . . 0.0 110.187 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -106.58 -175.33 2.76 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.232 -0.917 . . . . 0.0 110.207 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 80.5 m -105.23 -155.83 0.55 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 110.356 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -147.42 -138.31 0.09 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.278 -0.889 . . . . 0.0 110.006 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.3 4.82 14.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.054 -1.028 . . . . 0.0 110.059 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -107.19 17.55 22.79 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.324 -0.86 . . . . 0.0 109.823 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.478 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 7.0 ptm -79.49 -26.61 41.58 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.359 -0.838 . . . . 0.0 110.639 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.16 58.19 1.81 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.144 -0.972 . . . . 0.0 110.307 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -146.89 13.17 1.49 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.559 ' CE1' ' HA ' ' A' ' 40' ' ' ARG . 8.4 t80 -157.28 -57.8 0.08 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.168 -1.196 . . . . 0.0 110.312 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.3 p -107.97 114.75 28.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.192 -0.943 . . . . 0.0 110.933 -179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.614 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.2 mt -90.13 -42.48 11.05 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.435 -0.791 . . . . 0.0 109.886 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.614 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -111.26 76.91 1.0 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.231 -0.918 . . . . 0.0 110.134 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -172.46 179.5 43.97 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.476 ' HB2' ' HB3' ' A' ' 31' ' ' ARG . 1.0 OUTLIER -93.39 148.07 22.39 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.3 -1.118 . . . . 0.0 110.186 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -109.07 121.02 44.26 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.271 -0.893 . . . . 0.0 110.371 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.769 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -144.3 179.52 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.385 -0.822 . . . . 0.0 110.087 -179.819 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 20.9 t80 -127.48 133.68 49.87 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.146 -0.971 . . . . 0.0 110.124 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.719 HD23 ' CB ' ' A' ' 29' ' ' TYR . 0.6 OUTLIER -89.17 133.58 34.35 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.243 -0.911 . . . . 0.0 110.545 -179.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.724 HG11 ' HB3' ' A' ' 2' ' ' SER . 8.8 p -90.24 -26.34 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.238 -0.914 . . . . 0.0 110.44 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -78.56 -15.72 58.24 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.056 -1.028 . . . . 0.0 108.821 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -145.47 65.93 1.23 Allowed 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.829 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.494 ' C ' ' O ' ' A' ' 25' ' ' MET . 32.5 p -29.02 89.21 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 CA-C-O 121.648 0.737 . . . . 0.0 111.464 -178.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.3 OUTLIER -159.8 170.14 22.11 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.671 -0.643 . . . . 0.0 109.552 179.731 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.52 100.85 8.78 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.306 -0.871 . . . . 0.0 110.351 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.719 ' CB ' HD23 ' A' ' 22' ' ' LEU . 12.2 t80 -86.99 130.14 34.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.327 -0.858 . . . . 0.0 109.453 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 7.6 m -130.55 116.75 18.58 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.875 -1.14 . . . . 0.0 110.855 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.476 ' HB3' ' HB2' ' A' ' 18' ' ' GLN . 8.0 tpp85 -79.23 128.68 33.61 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.132 -0.98 . . . . 0.0 109.113 179.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.623 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 5.7 m -79.67 159.0 26.87 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.15 -0.969 . . . . 0.0 110.133 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 34' ' ' VAL . 31.3 tt0 -78.36 107.85 11.29 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.258 -0.901 . . . . 0.0 109.166 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.442 ' H ' HG23 ' A' ' 34' ' ' VAL . 39.6 t -40.99 101.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 121.697 -0.627 . . . . 0.0 110.436 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.84 ' O ' HD23 ' A' ' 46' ' ' LEU . . . 140.76 -8.42 2.79 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.565 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -84.79 173.01 11.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.029 -1.277 . . . . 0.0 110.486 -179.798 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.916 HG23 ' CE1' ' A' ' 43' ' ' HIS . 3.9 t -127.57 38.37 4.06 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 118.895 -1.122 . . . . 0.0 111.155 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.534 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -151.35 155.16 25.99 Favored Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.417 -1.373 . . . . 0.0 109.976 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.64 HG12 ' O ' ' A' ' 39' ' ' VAL . 79.6 t -83.55 12.68 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.379 -1.071 . . . . 0.0 109.844 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.574 ' N ' ' CD ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -123.26 -7.74 8.19 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.412 -0.805 . . . . 0.0 109.431 179.638 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.623 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 26.8 m 58.77 65.73 1.18 Allowed 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -178.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -135.32 -30.83 1.01 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.561 -0.712 . . . . 0.0 110.868 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.916 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.1 p80 -120.2 123.75 44.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.756 -1.215 . . . . 0.0 111.349 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.619 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 43.9 t80 -86.7 104.25 15.92 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.382 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.93 ' CE2' HD11 ' A' ' 46' ' ' LEU . 0.2 OUTLIER -71.82 -3.19 20.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.396 -0.815 . . . . 0.0 110.163 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.93 HD11 ' CE2' ' A' ' 45' ' ' PHE . 2.1 mm? . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.344 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.469 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 3.2 m . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.325 0.583 . . . . 0.0 110.356 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.821 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -141.56 122.66 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.138 -0.976 . . . . 0.0 110.659 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.533 ' HB ' ' CB ' ' A' ' 21' ' ' TYR . 4.2 m -90.96 167.28 12.52 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.387 -0.821 . . . . 0.0 109.765 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -122.34 169.29 11.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.274 -0.891 . . . . 0.0 110.13 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 62.8 m -110.61 -144.33 0.39 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.31 -0.869 . . . . 0.0 110.18 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 t -139.84 -166.27 2.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.229 -0.919 . . . . 0.0 110.111 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.18 7.48 13.53 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.208 -0.933 . . . . 0.0 110.283 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.12 25.81 10.07 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.213 -0.929 . . . . 0.0 110.224 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.436 ' SD ' ' SG ' ' A' ' 6' ' ' CYS . 31.8 ttm -144.67 28.11 1.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.225 -0.922 . . . . 0.0 110.196 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -110.42 27.6 9.47 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.243 -0.91 . . . . 0.0 110.167 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.15 -17.28 79.53 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -83.63 -50.08 8.55 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.251 -1.146 . . . . 0.0 110.327 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -105.79 120.9 42.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.254 -0.904 . . . . 0.0 110.408 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.59 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.6 mt -90.31 -42.29 11.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.336 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.1 m80 -111.17 86.45 2.32 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.173 -0.955 . . . . 0.0 110.1 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.456 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 168.93 -163.0 36.8 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -123.62 152.87 41.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.306 -1.114 . . . . 0.0 110.06 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 6.8 t -92.16 146.88 23.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.0 110.282 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.822 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -153.43 -174.08 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.278 -0.889 . . . . 0.0 109.803 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.533 ' CB ' ' HB ' ' A' ' 4' ' ' THR . 27.0 t80 -148.7 130.49 15.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.077 -1.015 . . . . 0.0 109.835 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.696 HD22 HD12 ' A' ' 3' ' ' ILE . 1.6 mm? -92.14 132.52 36.55 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.036 -1.04 . . . . 0.0 111.041 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.469 ' HB ' ' O ' ' A' ' 2' ' ' SER . 6.1 t -90.74 -27.22 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.33 -0.856 . . . . 0.0 110.382 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -77.52 -19.9 55.06 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.986 -1.072 . . . . 0.0 108.393 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.529 ' O ' ' N ' ' A' ' 27' ' ' GLN . 19.9 mtm -141.99 62.04 1.44 Allowed 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.487 ' C ' ' O ' ' A' ' 25' ' ' MET . 2.6 p -29.18 89.76 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.803 0.811 . . . . 0.0 111.494 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.529 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.32 147.85 17.91 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.734 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 5.9 m-80 -57.13 129.55 42.25 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.152 -0.967 . . . . 0.0 110.379 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.822 ' CD1' HD12 ' A' ' 20' ' ' ILE . 6.6 t80 -120.75 107.97 13.4 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.523 -0.736 . . . . 0.0 109.831 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 4.5 m -113.03 112.71 24.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.118 -0.988 . . . . 0.0 110.409 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.456 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 7.2 tpm_? -79.66 116.78 20.05 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.216 -0.928 . . . . 0.0 109.69 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.485 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 96.8 m -79.26 175.61 10.43 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.226 -0.921 . . . . 0.0 110.021 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -79.25 110.93 14.98 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.229 -0.919 . . . . 0.0 109.724 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.422 ' H ' HG23 ' A' ' 34' ' ' VAL . 39.1 t -44.77 101.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.396 -0.815 . . . . 0.0 109.672 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 146.2 -8.66 1.46 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.478 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.02 176.67 9.44 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.915 -1.344 . . . . 0.0 109.895 -179.967 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.606 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -113.99 28.69 8.56 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.897 -1.127 . . . . 0.0 110.472 -179.724 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -158.15 156.27 27.22 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.578 ' O ' HG13 ' A' ' 39' ' ' VAL . 10.0 p -84.63 42.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.326 -1.102 . . . . 0.0 109.839 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.581 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.27 22.93 0.16 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.341 -0.849 . . . . 0.0 109.849 -179.476 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.501 ' C ' ' O ' ' A' ' 40' ' ' ARG . 5.4 p 28.33 93.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.664 -0.647 . . . . 0.0 111.676 179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.581 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 13.4 tm-20 -154.81 -42.1 0.09 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.39 -0.819 . . . . 0.0 110.067 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.606 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.9 p-80 -118.53 128.35 54.49 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.099 -1.001 . . . . 0.0 110.419 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.611 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 36.8 t80 -87.78 128.08 35.32 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.422 0.63 . . . . 0.0 110.16 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.582 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -89.43 -37.33 14.89 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.387 -0.82 . . . . 0.0 110.087 -179.477 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.611 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.001 -0.999 . . . . 0.0 110.151 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.481 ' HB2' HG11 ' A' ' 23' ' ' VAL . 6.5 m . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.238 0.542 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 1.121 ' CD1' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -107.67 140.85 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 110.098 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.482 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -107.35 170.64 7.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 110.151 179.892 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -104.99 171.82 7.11 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.186 -0.947 . . . . 0.0 110.232 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.468 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 62.5 m -90.6 -143.62 0.17 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.287 -0.883 . . . . 0.0 110.106 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.5 p -158.17 -72.72 0.09 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.235 -0.916 . . . . 0.0 110.328 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.0 m -154.39 -75.14 0.11 Allowed 'General case' 0 C--N 1.292 -1.9 0 O-C-N 121.666 -0.646 . . . . 0.0 110.162 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -62.26 -12.1 18.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.881 . . . . 0.0 110.231 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.1 tpt -91.38 19.41 6.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.202 -0.936 . . . . 0.0 110.185 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.426 ' OD1' ' HB3' ' A' ' 6' ' ' CYS . 4.4 m-20 -126.39 81.09 1.97 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.285 -0.884 . . . . 0.0 110.221 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.09 59.92 0.43 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.535 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 63.8 t80 -160.11 -55.43 0.06 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.283 -1.128 . . . . 0.0 110.253 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.4 p -96.46 118.92 33.98 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.3 -0.875 . . . . 0.0 110.567 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.541 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.1 mt -90.66 -47.37 7.7 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.259 -0.901 . . . . 0.0 110.215 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 10.1 m80 -106.78 82.28 1.68 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.37 -0.831 . . . . 0.0 110.201 -179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.488 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 178.08 -171.02 43.44 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.4 mm-40 -109.36 133.48 53.01 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.198 -1.177 . . . . 0.0 110.168 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.587 ' C ' HG23 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -87.61 135.18 33.46 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.315 -0.865 . . . . 0.0 110.184 179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.121 HD12 ' CD1' ' A' ' 3' ' ' ILE . 26.9 pt -157.46 -168.07 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.214 -0.929 . . . . 0.0 110.235 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.56 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 8.4 t80 -141.3 139.44 33.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.209 -0.932 . . . . 0.0 110.004 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.747 HD23 ' CB ' ' A' ' 29' ' ' TYR . 0.7 OUTLIER -94.92 137.39 34.05 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.229 -0.919 . . . . 0.0 110.979 -179.525 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.481 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.3 p -90.14 -27.23 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.346 -0.846 . . . . 0.0 110.371 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.409 ' O ' ' SD ' ' A' ' 25' ' ' MET . 42.1 t0 -78.36 -15.42 58.72 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.165 -0.959 . . . . 0.0 108.814 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.2 OUTLIER -145.08 65.03 1.27 Allowed 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 179.01 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.56 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 49.7 p -29.41 87.72 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 121.623 0.725 . . . . 0.0 111.753 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 25' ' ' MET . 4.1 pt20 -160.89 175.79 12.14 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.584 -0.698 . . . . 0.0 109.544 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -82.18 111.24 18.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 110.339 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 1.094 ' CD1' HD11 ' A' ' 20' ' ' ILE . 10.0 t80 -100.11 118.75 37.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.343 -0.848 . . . . 0.0 109.706 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 20.7 m -119.66 111.51 18.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.06 -1.025 . . . . 0.0 110.641 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.488 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 13.5 tpp180 -81.03 117.88 22.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.195 -0.94 . . . . 0.0 109.485 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.48 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 98.0 m -79.37 170.47 16.55 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 110.349 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -79.61 114.0 18.2 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.322 -0.861 . . . . 0.0 110.183 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.401 HG23 ' H ' ' A' ' 34' ' ' VAL . 44.2 t -47.21 100.86 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.328 -0.858 . . . . 0.0 109.802 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 149.47 -13.37 1.05 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.711 -1.356 . . . . 0.0 109.711 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.2 m-85 -79.19 170.43 16.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.2 -1.177 . . . . 0.0 109.631 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.901 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -109.98 32.79 4.83 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.829 -1.169 . . . . 0.0 110.886 -179.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.65 159.9 31.37 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 39' ' ' VAL . 10.0 p -88.8 33.59 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.234 -1.156 . . . . 0.0 109.482 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.6 OUTLIER -142.91 17.89 1.96 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.461 -0.774 . . . . 0.0 109.595 -179.602 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.515 ' C ' ' O ' ' A' ' 40' ' ' ARG . 2.2 p 27.83 86.81 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.123 0 CA-C-O 121.442 0.639 . . . . 0.0 111.131 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 12.4 tm-20 -151.81 -34.79 0.13 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.451 -0.781 . . . . 0.0 110.4 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.901 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.2 p80 -120.91 117.64 27.85 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.034 -1.041 . . . . 0.0 110.364 179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.617 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 28.0 t80 -80.23 109.38 14.65 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.313 0.578 . . . . 0.0 109.991 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.567 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -70.45 -16.69 62.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.91 . . . . 0.0 109.682 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.617 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.7 mt . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.279 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.532 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 121.358 0.599 . . . . 0.0 109.91 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 1.097 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -155.78 165.13 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.347 -0.846 . . . . 0.0 110.209 -179.887 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.485 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 2.8 m -142.13 166.02 25.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.938 . . . . 0.0 110.027 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -85.72 163.21 18.37 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -0.875 . . . . 0.0 110.265 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.789 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 21.3 m -93.92 -145.17 0.24 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.231 -0.918 . . . . 0.0 110.209 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.0 t -151.94 -150.2 0.33 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 110.092 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.436 ' O ' ' N ' ' A' ' 10' ' ' MET . 0.3 OUTLIER -84.37 168.71 15.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.291 -0.88 . . . . 0.0 110.209 179.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 8' ' ' SER . 0.4 OUTLIER 42.12 27.15 0.07 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.267 -0.896 . . . . 0.0 110.231 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.452 ' SD ' ' HB3' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -122.68 -4.15 8.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.176 -0.953 . . . . 0.0 110.229 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -116.84 69.73 0.76 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.276 -0.89 . . . . 0.0 110.209 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -129.82 29.56 3.73 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.533 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 47.0 t80 -124.47 -57.25 1.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.333 -1.098 . . . . 0.0 110.295 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.609 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 26.7 p -91.45 122.75 34.32 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.283 -0.885 . . . . 0.0 110.34 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.553 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 5.6 mt -90.44 -45.46 8.97 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.259 -0.901 . . . . 0.0 110.238 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.553 ' ND1' ' HB2' ' A' ' 15' ' ' LEU . 7.1 m80 -109.07 87.44 2.49 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.309 -0.869 . . . . 0.0 110.159 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.488 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 177.98 -175.58 47.57 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -107.99 137.83 45.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.204 -1.174 . . . . 0.0 110.253 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.789 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 1.5 t -86.72 139.6 30.59 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.0 110.225 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.097 HD12 HD11 ' A' ' 3' ' ' ILE . 24.2 pt -157.33 -173.19 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.249 -0.907 . . . . 0.0 109.96 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.485 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 5.7 t80 -144.64 128.54 17.41 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.141 -0.975 . . . . 0.0 110.306 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.659 HD11 ' HD2' ' A' ' 29' ' ' TYR . 15.9 mt -79.54 133.55 36.47 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.339 -0.851 . . . . 0.0 110.779 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.532 HG11 ' HB3' ' A' ' 2' ' ' SER . 12.4 p -89.5 -30.91 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.889 . . . . 0.0 109.916 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -78.49 -20.07 51.65 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.136 -0.978 . . . . 0.0 108.684 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.558 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.0 mtm -136.78 61.72 1.62 Allowed 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 25' ' ' MET . 35.0 p -29.37 87.68 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 CA-C-O 121.7 0.762 . . . . 0.0 111.508 -178.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -160.64 148.17 15.89 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.48 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.7 t30 -62.62 114.97 3.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.196 -0.94 . . . . 0.0 110.304 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 1.07 ' CD1' HD11 ' A' ' 20' ' ' ILE . 4.1 t80 -106.54 121.78 44.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.408 -0.808 . . . . 0.0 109.687 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.609 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 19.9 m -117.52 112.12 20.17 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.078 -1.014 . . . . 0.0 110.478 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.488 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 1.9 tpp180 -81.89 117.52 22.21 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.207 -0.933 . . . . 0.0 109.635 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.463 ' HB3' ' HB3' ' A' ' 41' ' ' CYS . 65.8 m -79.36 170.85 15.99 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.229 -0.919 . . . . 0.0 110.488 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -79.46 113.16 17.38 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.335 -0.853 . . . . 0.0 110.194 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.5 t -48.67 106.71 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.44 -0.787 . . . . 0.0 109.955 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.26 -10.92 2.26 Favored Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -79.53 177.14 9.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.177 -1.19 . . . . 0.0 109.975 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.691 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -110.12 -43.26 3.99 Favored 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 118.732 -1.187 . . . . 0.0 111.21 -179.524 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.59 158.79 43.68 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.269 -1.532 . . . . 0.0 109.269 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.761 HG12 ' O ' ' A' ' 39' ' ' VAL . 80.9 t -84.7 44.45 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.247 -1.149 . . . . 0.0 109.513 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.575 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.28 26.65 0.17 Allowed 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.481 -0.762 . . . . 0.0 109.61 -179.372 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 10.9 p 30.78 93.12 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.512 -0.743 . . . . 0.0 111.335 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 6.6 tm-20 -160.17 -42.7 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 110.388 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.691 ' CE1' HG23 ' A' ' 37' ' ' THR . 0.2 OUTLIER -120.1 136.73 54.49 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 122.177 0.989 . . . . 0.0 110.8 -179.76 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 69.4 t80 -97.32 137.09 36.85 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.142 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.592 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -121.77 13.11 10.69 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 110.605 -179.431 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.6 mt . . . . . 0 N--CA 1.492 1.639 0 O-C-N 120.938 -1.101 . . . . 0.0 110.303 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.508 ' HB3' HG21 ' A' ' 23' ' ' VAL . 4.9 t . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.269 0.557 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.789 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.73 150.8 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.91 . . . . 0.0 110.34 -179.78 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.493 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.3 m -131.41 170.74 14.25 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.388 -0.82 . . . . 0.0 110.205 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -109.26 179.6 4.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.214 -0.929 . . . . 0.0 110.185 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.3 m -106.92 -154.58 0.52 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 110.355 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.0 t -136.23 -145.72 0.22 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.095 -1.003 . . . . 0.0 110.647 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 41.2 t -79.79 -70.67 0.5 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.31 -0.869 . . . . 0.0 110.421 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -76.33 2.96 11.96 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.264 -0.897 . . . . 0.0 110.366 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.18 14.95 25.88 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.13 -0.981 . . . . 0.0 110.191 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -140.95 120.08 12.87 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.31 -0.869 . . . . 0.0 110.245 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.48 62.57 0.19 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.593 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 52.1 t80 -151.45 -57.11 0.15 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.273 -1.134 . . . . 0.0 110.145 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.542 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 23.5 p -85.66 124.85 32.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.263 -0.898 . . . . 0.0 110.319 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.6 mt -89.99 -42.53 11.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.273 -0.892 . . . . 0.0 110.256 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.597 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.7 m80 -113.91 92.85 4.12 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.281 -0.887 . . . . 0.0 110.147 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.48 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 167.53 -132.6 2.64 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.439 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 0.8 OUTLIER -158.81 149.49 19.98 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -1.103 . . . . 0.0 110.285 -179.945 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -89.68 146.2 24.69 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.297 -0.877 . . . . 0.0 110.364 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.789 HG22 ' CG1' ' A' ' 3' ' ' ILE . 1.1 mt -153.03 -166.54 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.296 -0.877 . . . . 0.0 109.579 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.493 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 16.7 t80 -152.65 125.7 8.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.088 -1.007 . . . . 0.0 110.135 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.692 HD22 HD12 ' A' ' 3' ' ' ILE . 1.3 mm? -88.44 132.22 34.56 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.2 -0.937 . . . . 0.0 110.611 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.508 HG21 ' HB3' ' A' ' 2' ' ' SER . 9.4 p -90.38 -24.11 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.243 -0.911 . . . . 0.0 110.462 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.51 -13.69 59.71 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.107 -0.996 . . . . 0.0 108.703 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.537 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.0 tpp -150.0 67.88 0.99 Allowed 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 25' ' ' MET . 12.5 p -29.28 89.44 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.715 0.769 . . . . 0.0 111.536 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.11 147.85 16.58 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.725 -0.609 . . . . 0.0 109.377 179.9 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.515 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 10.8 m-20 -59.79 127.92 34.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.157 -0.964 . . . . 0.0 110.248 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.782 ' CD1' HD12 ' A' ' 20' ' ' ILE . 8.7 t80 -117.82 109.94 17.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.269 -0.894 . . . . 0.0 110.207 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.542 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -112.76 110.23 20.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.23 -0.919 . . . . 0.0 110.163 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.48 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -81.4 123.76 28.84 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.23 -0.919 . . . . 0.0 109.817 179.585 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.525 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 78.7 m -79.73 178.58 8.06 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.324 -0.86 . . . . 0.0 110.251 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -80.69 114.74 19.79 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.25 -0.906 . . . . 0.0 110.176 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.419 HG23 ' H ' ' A' ' 34' ' ' VAL . 42.4 t -47.33 103.0 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.334 -0.854 . . . . 0.0 109.796 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.752 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 145.4 -11.46 1.77 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.579 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.9 OUTLIER -79.54 167.38 20.84 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.127 -1.219 . . . . 0.0 109.923 179.994 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.931 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -108.21 33.96 3.86 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.048 -1.032 . . . . 0.0 110.555 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.5 156.32 27.6 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.48 ' O ' HG22 ' A' ' 39' ' ' VAL . 7.6 p -87.51 33.27 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.2 -1.176 . . . . 0.0 109.834 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.593 ' HG3' ' CE1' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -148.68 20.02 1.03 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.349 -0.845 . . . . 0.0 109.677 -179.65 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.525 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 7.1 p 30.77 94.42 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.65 0.738 . . . . 0.0 111.603 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 6.2 tm-20 -153.8 -36.69 0.1 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.551 -0.718 . . . . 0.0 109.96 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.931 ' CE1' HG23 ' A' ' 37' ' ' THR . 4.8 p80 -122.82 116.28 23.41 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.233 -0.917 . . . . 0.0 109.624 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.626 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 23.9 t80 -79.62 107.94 12.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.763 -0.586 . . . . 0.0 110.486 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.559 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -67.43 -30.55 70.32 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.397 -0.814 . . . . 0.0 109.428 179.663 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.752 HD12 ' O ' ' A' ' 35' ' ' GLY . 4.5 mt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.188 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.875 ' HB2' HG11 ' A' ' 23' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.363 0.601 . . . . 0.0 110.225 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.794 ' CG1' HG22 ' A' ' 20' ' ' ILE . 1.1 tp -144.18 154.47 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.305 -0.872 . . . . 0.0 110.16 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.506 ' O ' ' N ' ' A' ' 21' ' ' TYR . 3.1 m -140.47 168.19 20.37 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.262 -0.898 . . . . 0.0 110.119 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.44 179.55 6.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.176 -0.953 . . . . 0.0 110.302 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 86.4 m -105.22 164.76 11.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.262 -0.898 . . . . 0.0 110.276 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.8 t -102.34 -152.38 0.44 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.326 -0.859 . . . . 0.0 110.141 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.414 ' O ' ' N ' ' A' ' 10' ' ' MET . 0.8 OUTLIER -83.81 171.55 13.02 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.34 -0.85 . . . . 0.0 110.076 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 8' ' ' SER . 3.0 t0 42.42 27.87 0.1 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.185 -0.947 . . . . 0.0 110.191 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.414 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -126.21 3.99 7.1 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.276 -0.89 . . . . 0.0 110.15 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -110.35 86.73 2.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.263 -0.898 . . . . 0.0 110.265 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.01 64.64 0.39 Allowed Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -154.19 -60.62 0.13 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.263 -1.139 . . . . 0.0 110.165 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 40' ' ' ARG . 25.4 p -96.28 117.18 30.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.278 -0.889 . . . . 0.0 110.43 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.589 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.3 mt -69.22 -42.66 75.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.49 -0.756 . . . . 0.0 109.784 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.3 m80 -117.25 80.63 1.52 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.439 -0.788 . . . . 0.0 110.388 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.416 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -177.33 152.76 12.39 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.211 -1.556 . . . . 0.0 109.211 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.545 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -80.85 169.81 17.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.125 -1.22 . . . . 0.0 110.563 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -107.22 130.12 54.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.241 -0.912 . . . . 0.0 110.798 -179.579 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.894 HD13 ' HD2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -132.79 -165.89 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.363 -0.836 . . . . 0.0 109.494 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.506 ' N ' ' O ' ' A' ' 4' ' ' THR . 12.5 t80 -149.57 135.16 18.49 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.054 -1.029 . . . . 0.0 109.871 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.59 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.2 mm? -95.77 134.05 39.16 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.15 -0.969 . . . . 0.0 111.234 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.875 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.0 p -90.73 -25.16 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.434 -0.791 . . . . 0.0 110.385 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.88 -14.53 59.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.096 -1.003 . . . . 0.0 108.82 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.548 ' O ' ' N ' ' A' ' 27' ' ' GLN . 5.5 ttm -147.31 67.38 1.14 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 25' ' ' MET . 17.2 p -29.81 87.68 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.599 0.714 . . . . 0.0 111.922 -178.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.0 OUTLIER -157.83 170.67 21.81 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.67 -0.644 . . . . 0.0 109.782 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -79.4 125.18 29.2 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.413 -0.804 . . . . 0.0 110.582 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.894 ' HD2' HD13 ' A' ' 20' ' ' ILE . 30.1 t80 -105.7 167.49 9.73 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.392 -0.817 . . . . 0.0 109.46 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.493 ' HA ' ' CD1' ' A' ' 20' ' ' ILE . 2.4 m -152.13 117.66 5.35 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.028 -1.045 . . . . 0.0 110.683 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.883 ' H ' HD11 ' A' ' 20' ' ' ILE . 4.8 tpp85 -84.89 125.79 32.93 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.104 -0.998 . . . . 0.0 108.896 179.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.3 m -79.69 163.62 24.39 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.129 -0.982 . . . . 0.0 110.334 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.508 ' O ' ' N ' ' A' ' 35' ' ' GLY . 10.2 tt0 -78.19 111.91 14.62 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.754 -0.779 . . . . 0.0 109.287 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.434 ' C ' ' O ' ' A' ' 33' ' ' GLU . 35.3 t -41.86 94.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.578 -0.701 . . . . 0.0 109.985 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.642 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 153.73 -17.2 0.65 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.565 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.6 m-85 -79.37 167.92 20.2 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.081 -1.247 . . . . 0.0 109.92 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.918 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -113.86 37.01 3.41 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.139 -1.025 . . . . 0.0 110.924 -179.491 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.91 157.38 28.87 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.7 p -88.99 27.56 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.277 -1.131 . . . . 0.0 109.551 179.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.566 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 12.1 ttp180 -127.16 -18.87 4.46 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.539 -0.726 . . . . 0.0 110.276 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.7 m 68.45 78.83 0.22 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.156 -0.965 . . . . 0.0 109.829 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.566 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -152.18 -32.56 0.14 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.473 -0.767 . . . . 0.0 110.984 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.918 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.6 p80 -123.17 118.95 28.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.894 -1.129 . . . . 0.0 110.922 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 40.6 t80 -81.64 105.18 12.58 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.322 0.582 . . . . 0.0 109.798 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.522 ' CD1' ' C ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -64.78 -27.37 68.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.288 -0.883 . . . . 0.0 110.095 -179.567 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.642 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.7 mt . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.348 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.242 0.544 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.547 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.9 tt -121.19 152.79 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.315 -0.865 . . . . 0.0 110.063 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.482 ' CB ' ' HB3' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -110.01 169.69 8.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.902 . . . . 0.0 110.271 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -117.87 159.69 22.67 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.285 -0.884 . . . . 0.0 110.103 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.51 ' CB ' ' HG ' ' A' ' 19' ' ' CYS . 61.4 m -110.65 -151.26 0.47 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.113 -0.992 . . . . 0.0 110.34 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.7 t -152.99 -151.07 0.36 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.291 -0.88 . . . . 0.0 110.086 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.42 ' O ' ' C ' ' A' ' 9' ' ' ASP . 79.2 p -86.99 165.38 15.89 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.182 -0.949 . . . . 0.0 110.119 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.42 ' C ' ' O ' ' A' ' 8' ' ' SER . 2.2 m-20 41.48 31.01 0.16 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.214 -0.929 . . . . 0.0 110.301 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.78 -14.38 9.01 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.344 -0.847 . . . . 0.0 110.362 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -148.65 107.4 3.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.0 110.428 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -104.44 52.82 0.72 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.336 -1.506 . . . . 0.0 109.336 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -126.58 -55.37 1.42 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -1.106 . . . . 0.0 110.447 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.3 p -96.59 117.23 30.52 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.132 -0.98 . . . . 0.0 110.619 -179.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.621 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 14.4 mt -82.26 -39.52 22.89 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.365 -0.835 . . . . 0.0 109.839 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.6 m80 -121.41 84.35 2.23 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.443 -0.786 . . . . 0.0 110.243 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -177.02 175.8 47.82 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -93.22 141.49 28.37 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.269 -1.136 . . . . 0.0 110.276 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.518 ' C ' HD13 ' A' ' 20' ' ' ILE . 7.9 t -98.79 124.12 43.46 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.353 -0.842 . . . . 0.0 110.144 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.826 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.55 -173.7 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.389 -0.82 . . . . 0.0 110.141 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.482 ' HB3' ' CB ' ' A' ' 4' ' ' THR . 10.8 t80 -138.99 136.53 35.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.832 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.651 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.3 mm? -92.41 133.94 35.41 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.02 -1.05 . . . . 0.0 111.009 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.1 p -90.46 -27.7 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.356 -0.84 . . . . 0.0 110.563 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -78.36 -17.79 56.0 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.082 -1.011 . . . . 0.0 108.964 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.548 ' O ' ' N ' ' A' ' 27' ' ' GLN . 14.8 mtt -142.62 64.9 1.36 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.48 ' C ' ' O ' ' A' ' 25' ' ' MET . 11.8 p -29.18 88.69 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.716 0.769 . . . . 0.0 111.553 -178.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.7 pt20 -160.32 171.8 18.48 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.655 -0.653 . . . . 0.0 109.636 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -80.08 122.7 27.1 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.385 -0.822 . . . . 0.0 110.478 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.651 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.3 t80 -113.07 129.75 56.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.507 -0.746 . . . . 0.0 109.429 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.7 m -129.84 113.32 14.52 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.99 -1.069 . . . . 0.0 110.874 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -79.57 133.38 36.45 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.282 -0.886 . . . . 0.0 109.097 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 10.8 m -78.99 160.26 27.27 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.235 -0.916 . . . . 0.0 109.985 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.516 ' O ' ' N ' ' A' ' 35' ' ' GLY . 12.1 tt0 -78.54 112.99 16.17 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.294 -0.879 . . . . 0.0 109.023 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.436 ' C ' ' O ' ' A' ' 33' ' ' GLU . 24.0 t -40.76 94.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.586 -0.696 . . . . 0.0 110.3 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.901 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 153.41 -18.89 0.7 Allowed Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 3.6 m-85 -82.2 166.19 19.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -1.162 . . . . 0.0 109.902 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.972 HG23 ' CE1' ' A' ' 43' ' ' HIS . 9.1 t -121.38 47.81 1.78 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.973 -1.079 . . . . 0.0 111.158 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.63 157.62 29.07 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.7 p -88.59 23.83 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.345 -1.091 . . . . 0.0 109.421 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.588 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 11.2 ttp180 -126.51 -19.66 4.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.578 -0.701 . . . . 0.0 110.291 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.8 m 68.18 68.54 0.33 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.12 -0.987 . . . . 0.0 110.263 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.588 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 5.3 tm-20 -137.99 -27.87 0.89 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.367 -0.833 . . . . 0.0 110.992 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.972 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.4 p80 -126.95 121.82 32.81 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.762 -1.211 . . . . 0.0 111.111 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.627 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.3 t80 -83.16 101.18 11.03 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.54 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.1 OUTLIER -64.31 -14.33 55.4 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.208 -0.933 . . . . 0.0 110.149 -179.362 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.901 HD12 ' O ' ' A' ' 35' ' ' GLY . 6.9 mt . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.228 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.851 ' N ' HG11 ' A' ' 23' ' ' VAL . 2.8 m . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.312 0.577 . . . . 0.0 110.646 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.828 HD11 ' CG2' ' A' ' 20' ' ' ILE . 0.9 OUTLIER -80.11 164.6 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.245 -0.91 . . . . 0.0 109.873 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.544 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 2.3 m -148.7 166.34 28.67 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.11 -0.994 . . . . 0.0 110.259 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.65 162.02 13.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.234 -0.916 . . . . 0.0 110.163 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.8 m -93.19 -150.25 0.28 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.266 -0.896 . . . . 0.0 110.194 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 t -147.37 -155.42 0.62 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.264 -0.898 . . . . 0.0 110.22 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.34 172.11 14.19 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.29 -0.881 . . . . 0.0 110.205 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.5 t0 47.83 23.71 0.49 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.218 -0.926 . . . . 0.0 110.276 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.14 9.65 6.26 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.255 -0.903 . . . . 0.0 110.234 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.403 ' OD1' ' SG ' ' A' ' 14' ' ' CYS . 0.9 OUTLIER -119.52 76.84 1.16 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -0.912 . . . . 0.0 110.402 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -121.74 -8.95 7.21 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -91.67 -49.19 6.42 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.252 -1.146 . . . . 0.0 110.165 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.581 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.0 p -101.46 121.13 41.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.405 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.601 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.4 mt -90.03 -40.18 12.47 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -0.927 . . . . 0.0 110.402 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.601 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.6 m80 -114.19 89.93 3.22 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.204 -0.935 . . . . 0.0 110.12 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 171.1 -167.1 40.27 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -117.68 162.85 17.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.368 -1.078 . . . . 0.0 110.298 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.879 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -98.16 137.97 36.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.262 -0.899 . . . . 0.0 110.185 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.879 HD13 ' O ' ' A' ' 19' ' ' CYS . 15.9 mm -142.38 172.71 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.319 -0.863 . . . . 0.0 110.169 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.544 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 32.1 t80 -134.4 136.02 43.02 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.103 -0.998 . . . . 0.0 109.849 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.562 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 3.4 mm? -99.54 132.37 44.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.019 -1.051 . . . . 0.0 111.043 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.851 HG11 ' N ' ' A' ' 2' ' ' SER . 11.5 p -90.77 -24.58 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.6 -0.688 . . . . 0.0 110.722 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -78.05 -15.14 59.17 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.027 -1.046 . . . . 0.0 108.801 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.544 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -147.17 67.17 1.14 Allowed 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.641 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.492 ' C ' ' O ' ' A' ' 25' ' ' MET . 61.9 p -28.97 88.63 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.762 0.792 . . . . 0.0 111.403 -178.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.65 149.0 16.36 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.974 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.528 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.5 t30 -59.3 157.33 11.02 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.303 -0.873 . . . . 0.0 109.886 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.582 ' CD1' ' N ' ' A' ' 30' ' ' CYS . 12.9 t80 -138.87 159.77 41.34 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.312 -0.867 . . . . 0.0 109.699 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.582 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 28.6 m -153.47 107.61 3.06 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.07 -1.019 . . . . 0.0 110.595 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.483 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 1.3 tpp180 -82.43 121.35 26.62 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.252 -0.905 . . . . 0.0 109.468 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.519 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 75.8 m -79.46 170.75 16.12 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.219 -0.926 . . . . 0.0 110.549 -179.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -79.51 114.47 18.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.399 -0.813 . . . . 0.0 110.052 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 47.2 t -47.54 103.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.392 -0.818 . . . . 0.0 109.75 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 145.93 -10.66 1.62 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.477 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.39 176.16 9.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.112 -1.228 . . . . 0.0 109.84 179.905 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.669 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -115.03 31.56 6.61 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.98 -1.075 . . . . 0.0 110.878 -179.432 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.26 159.84 31.17 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.54 ' O ' HG22 ' A' ' 39' ' ' VAL . 12.7 p -86.98 37.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -1.122 . . . . 0.0 109.545 179.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.579 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -150.7 15.06 0.76 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.463 -0.773 . . . . 0.0 110.005 -179.441 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.519 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 9.4 p 32.67 87.19 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.67 -0.644 . . . . 0.0 110.6 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.579 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 1.5 tt0 -151.2 -38.76 0.12 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.403 -0.81 . . . . 0.0 110.286 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.669 ' CE1' HG23 ' A' ' 37' ' ' THR . 1.6 p-80 -120.53 128.5 53.16 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.04 -1.038 . . . . 0.0 110.703 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.608 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 25.0 t80 -86.76 128.3 35.02 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.424 0.63 . . . . 0.0 110.155 -178.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.593 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -95.38 6.26 49.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.429 -0.794 . . . . 0.0 110.118 -179.391 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 C--N 1.302 -1.48 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.443 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.558 ' HB3' HG11 ' A' ' 23' ' ' VAL . 1.3 t . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.296 0.57 . . . . 0.0 110.287 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 1.001 ' CD1' HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -122.56 152.91 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.308 -0.87 . . . . 0.0 110.139 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.509 ' N ' HG13 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -125.97 172.78 9.65 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.229 -0.919 . . . . 0.0 110.267 -179.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.91 166.25 12.27 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.244 -0.91 . . . . 0.0 110.19 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 21.6 m -92.8 -143.76 0.22 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.211 -0.931 . . . . 0.0 110.186 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 t -137.12 -178.85 5.39 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 110.131 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.6 m -81.76 8.56 9.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.25 -0.906 . . . . 0.0 110.171 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -125.84 21.49 7.59 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.243 -0.911 . . . . 0.0 110.238 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.67 21.86 2.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.226 -0.922 . . . . 0.0 110.188 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -113.58 91.33 3.6 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.224 -0.922 . . . . 0.0 110.163 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -158.99 49.4 0.41 Allowed Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -144.98 -65.75 0.33 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -1.145 . . . . 0.0 110.191 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.632 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 24.6 p -83.64 125.68 32.08 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.224 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -89.48 -41.4 12.08 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.19 -0.944 . . . . 0.0 110.369 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.597 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.7 m80 -112.5 77.21 1.03 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.117 -0.989 . . . . 0.0 110.209 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -170.08 178.5 42.87 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -107.19 140.08 40.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.295 -1.121 . . . . 0.0 110.36 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -82.28 139.85 33.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.218 -0.927 . . . . 0.0 109.965 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.082 HD11 ' CD1' ' A' ' 29' ' ' TYR . 26.3 pt -156.21 -163.58 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.199 -0.938 . . . . 0.0 110.205 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.605 ' O ' HD12 ' A' ' 3' ' ' ILE . 5.3 t80 -153.48 141.61 20.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.156 -0.965 . . . . 0.0 109.882 -179.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.682 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.7 mm? -92.48 136.02 33.57 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.187 -0.946 . . . . 0.0 110.875 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.558 HG11 ' HB3' ' A' ' 2' ' ' SER . 7.7 p -90.94 -27.81 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.387 -0.821 . . . . 0.0 110.706 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' A' ' 25' ' ' MET . 58.3 p30 -78.46 -12.85 60.03 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.91 -1.118 . . . . 0.0 109.002 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 51.2 mtt -147.98 65.82 1.1 Allowed 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.575 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 69.0 p -29.68 89.25 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.703 0.763 . . . . 0.0 111.51 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.26 147.88 16.36 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.864 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.524 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 20.4 p30 -58.36 132.92 55.11 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.127 -0.983 . . . . 0.0 110.141 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 1.082 ' CD1' HD11 ' A' ' 20' ' ' ILE . 10.3 t80 -128.27 123.25 33.66 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.316 -0.865 . . . . 0.0 110.276 -179.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.632 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 1.7 m -113.74 115.2 27.44 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.09 -1.006 . . . . 0.0 110.172 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -86.18 100.6 12.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.13 -0.981 . . . . 0.0 109.569 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.583 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 86.6 m -79.52 172.68 13.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.319 -0.863 . . . . 0.0 110.239 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -79.53 127.64 32.38 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.324 -0.86 . . . . 0.0 109.859 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.9 t -71.49 -13.64 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.353 -0.842 . . . . 0.0 110.236 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -74.85 -7.45 80.86 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.535 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -79.78 177.5 8.85 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.183 -1.187 . . . . 0.0 110.091 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.613 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.59 27.57 9.52 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.922 -1.112 . . . . 0.0 110.13 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -159.07 157.76 28.81 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.321 -1.512 . . . . 0.0 109.321 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.808 HG12 ' O ' ' A' ' 39' ' ' VAL . 67.1 t -84.84 43.52 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.186 -1.185 . . . . 0.0 109.705 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.558 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -155.85 16.26 0.36 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.274 -0.891 . . . . 0.0 110.258 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.583 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 9.0 p 32.17 89.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.59 -0.694 . . . . 0.0 110.639 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.558 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 1.8 tt0 -155.95 -41.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.326 -0.859 . . . . 0.0 110.121 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.613 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.4 p-80 -118.37 126.36 51.94 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.066 -1.022 . . . . 0.0 110.512 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.608 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.4 t80 -87.5 129.02 35.22 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.553 -0.717 . . . . 0.0 109.986 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.557 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -92.64 -32.43 14.77 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.432 -0.793 . . . . 0.0 110.091 -179.412 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.8 mt . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.313 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.657 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.197 0.523 . . . . 0.0 110.221 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.715 HD12 HD23 ' A' ' 22' ' ' LEU . 0.9 OUTLIER -109.86 149.94 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.254 -0.904 . . . . 0.0 110.247 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -115.53 179.46 3.96 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.256 -0.903 . . . . 0.0 110.215 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.62 170.81 8.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.242 -0.911 . . . . 0.0 110.199 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 97.8 m -108.48 -167.98 1.3 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.249 -0.907 . . . . 0.0 110.352 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.4 t -130.12 -138.97 0.22 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.058 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 33.0 t -79.71 5.61 12.95 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.09 -1.006 . . . . 0.0 110.133 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -97.33 8.7 44.06 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.283 -0.886 . . . . 0.0 110.018 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.464 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 22.3 ptt? -79.59 -14.06 59.08 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.323 -0.86 . . . . 0.0 110.455 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -107.96 90.15 3.21 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.21 -0.931 . . . . 0.0 110.087 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -171.4 -35.43 0.03 OUTLIER Glycine 0 N--CA 1.487 2.096 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -107.99 -62.82 1.39 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.219 -1.165 . . . . 0.0 110.418 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.526 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.1 p -87.31 117.93 26.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.196 -0.94 . . . . 0.0 110.483 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.605 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.3 mt -78.88 -42.8 26.4 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.293 -0.88 . . . . 0.0 109.985 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -119.32 86.75 2.61 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.416 -0.803 . . . . 0.0 110.368 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -179.47 171.1 42.83 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -96.86 162.7 13.29 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.239 -1.153 . . . . 0.0 110.495 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -109.78 132.15 54.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.368 -0.833 . . . . 0.0 110.532 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.661 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -147.3 167.91 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.4 -0.812 . . . . 0.0 109.932 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.493 ' CD1' ' C ' ' A' ' 21' ' ' TYR . 7.0 t80 -120.04 120.44 36.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.131 -0.981 . . . . 0.0 110.178 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.758 HD11 ' CD2' ' A' ' 29' ' ' TYR . 11.1 mt -83.7 136.1 34.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.154 -0.966 . . . . 0.0 110.862 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.657 HG11 ' HB3' ' A' ' 2' ' ' SER . 14.8 p -88.66 -29.5 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.466 -0.771 . . . . 0.0 110.1 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -78.63 -21.86 47.81 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.178 -0.951 . . . . 0.0 108.752 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.574 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -134.34 61.13 1.68 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 178.65 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.47 ' C ' ' O ' ' A' ' 25' ' ' MET . 7.3 p -28.89 85.53 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.523 0.678 . . . . 0.0 111.906 -178.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.574 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -161.35 164.74 29.84 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.613 -0.679 . . . . 0.0 109.633 179.522 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -79.51 91.95 5.22 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.407 -0.808 . . . . 0.0 109.701 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.758 ' CD2' HD11 ' A' ' 22' ' ' LEU . 5.9 t80 -79.8 135.6 36.52 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.414 -0.804 . . . . 0.0 109.826 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.526 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -122.23 117.11 25.38 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.092 -1.005 . . . . 0.0 110.591 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.479 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -80.41 136.74 36.41 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.177 -0.952 . . . . 0.0 109.413 179.16 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 6.3 m -80.38 166.25 21.46 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.178 -0.951 . . . . 0.0 109.764 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.521 ' O ' ' N ' ' A' ' 35' ' ' GLY . 17.9 tt0 -78.41 110.06 13.14 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.122 -0.986 . . . . 0.0 108.772 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' A' ' 33' ' ' GLU . 26.0 t -37.49 93.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 CA-C-O 121.422 0.63 . . . . 0.0 110.412 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.754 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 149.87 -15.17 1.04 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.579 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.5 m-85 -80.51 173.95 12.09 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.177 -1.19 . . . . 0.0 110.198 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.672 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.6 OUTLIER -125.47 45.68 2.54 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.055 -1.028 . . . . 0.0 110.835 -179.745 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.03 153.42 24.39 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.3 p -88.23 20.03 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.269 -1.136 . . . . 0.0 109.761 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.594 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 3.1 tmm_? -125.25 -16.78 5.85 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.442 -0.787 . . . . 0.0 110.073 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.8 m 69.79 83.76 0.15 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.312 -0.868 . . . . 0.0 109.919 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.594 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -156.72 -31.11 0.09 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.388 -0.82 . . . . 0.0 111.247 -179.738 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.672 ' CE1' HG23 ' A' ' 37' ' ' THR . 4.2 p80 -123.89 123.65 40.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.634 -1.291 . . . . 0.0 111.084 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.628 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 28.1 t80 -82.9 105.82 14.21 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.129 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -65.03 -16.16 63.14 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.187 -0.945 . . . . 0.0 109.778 -179.781 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.754 HD12 ' O ' ' A' ' 35' ' ' GLY . 5.7 mt . . . . . 0 N--CA 1.488 1.459 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.28 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.652 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.209 0.528 . . . . 0.0 110.239 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 1.033 HD11 HD12 ' A' ' 20' ' ' ILE . 2.5 tt -133.44 161.16 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.296 -0.877 . . . . 0.0 110.194 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.468 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.2 OUTLIER -126.94 -177.99 4.24 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.209 -0.932 . . . . 0.0 110.326 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.77 171.24 7.61 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.226 -0.921 . . . . 0.0 110.275 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 64.4 m -107.25 -163.08 0.88 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.286 -0.884 . . . . 0.0 110.223 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.56 -167.08 1.67 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.322 -0.861 . . . . 0.0 110.207 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.6 t -83.61 9.27 11.89 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.164 -0.96 . . . . 0.0 110.31 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -134.36 26.09 3.8 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.226 -0.921 . . . . 0.0 110.334 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 ttm -143.94 16.03 1.74 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.262 -0.899 . . . . 0.0 110.217 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.1 p-10 -111.75 57.87 0.63 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -0.906 . . . . 0.0 110.279 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -110.81 62.12 0.29 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.435 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 64.2 t80 -160.18 -50.27 0.05 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.381 -1.07 . . . . 0.0 110.196 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -104.39 119.89 39.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.346 -0.846 . . . . 0.0 110.324 -179.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.533 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 5.6 mt -90.49 -48.29 7.19 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.228 -0.92 . . . . 0.0 110.127 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.577 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 11.2 m80 -103.73 69.39 0.97 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.368 -0.833 . . . . 0.0 110.25 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -174.14 -170.59 37.62 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -114.84 137.59 51.78 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.199 -1.177 . . . . 0.0 110.337 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.661 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -85.31 146.91 26.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.262 -0.899 . . . . 0.0 110.045 179.801 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.033 HD12 HD11 ' A' ' 3' ' ' ILE . 8.1 pt -159.46 -174.57 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.282 -0.886 . . . . 0.0 110.272 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.469 ' CD1' ' C ' ' A' ' 21' ' ' TYR . 5.9 t80 -135.97 120.54 18.24 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.283 -0.885 . . . . 0.0 109.825 179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.785 HD11 ' CD2' ' A' ' 29' ' ' TYR . 13.2 mt -79.71 131.69 36.01 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.242 -0.911 . . . . 0.0 110.975 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.652 HG11 ' CB ' ' A' ' 2' ' ' SER . 7.7 p -87.49 -27.98 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 109.839 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -78.65 -20.63 49.84 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 108.739 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.562 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -140.18 63.69 1.47 Allowed 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.79 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.485 ' C ' ' O ' ' A' ' 25' ' ' MET . 20.1 p -29.12 87.55 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 121.682 0.753 . . . . 0.0 111.503 -178.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.562 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.97 148.85 15.71 Favored 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.652 -0.655 . . . . 0.0 109.371 179.937 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.518 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 7.7 p30 -64.44 105.05 0.86 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.316 -0.865 . . . . 0.0 109.762 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.944 ' CD1' HD11 ' A' ' 20' ' ' ILE . 4.9 t80 -99.75 144.66 28.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.343 -0.848 . . . . 0.0 110.018 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 42.9 m -137.44 115.33 11.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.011 -1.056 . . . . 0.0 110.581 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -80.87 114.94 20.09 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.221 -0.925 . . . . 0.0 109.683 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.471 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 91.2 m -79.6 172.99 13.03 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.21 -0.932 . . . . 0.0 110.44 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -79.44 118.41 21.3 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.371 -0.831 . . . . 0.0 109.964 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.2 t -50.87 106.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.301 -0.874 . . . . 0.0 109.763 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.665 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 143.97 -10.76 2.08 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.577 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.37 168.45 19.49 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.159 -1.2 . . . . 0.0 109.829 179.855 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.916 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.71 30.58 6.18 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.952 -1.093 . . . . 0.0 110.791 -179.742 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.12 154.61 25.66 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.496 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.6 p -84.87 44.22 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.297 -1.119 . . . . 0.0 109.759 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.575 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.55 22.58 0.18 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.461 -0.774 . . . . 0.0 109.759 -179.571 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.518 ' HG ' ' HA ' ' A' ' 14' ' ' CYS . 2.9 p 27.78 92.05 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 CA-C-O 121.387 0.613 . . . . 0.0 111.452 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -153.29 -37.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.442 -0.786 . . . . 0.0 110.278 179.833 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.916 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.9 p80 -121.92 116.48 24.45 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.194 -0.941 . . . . 0.0 110.451 179.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.572 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 38.0 t80 -79.89 115.47 19.5 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.477 0.656 . . . . 0.0 109.882 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.543 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -82.93 -26.24 31.62 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.295 -0.878 . . . . 0.0 110.038 -179.557 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.665 HD12 ' O ' ' A' ' 35' ' ' GLY . 4.5 mt . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.172 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.602 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.209 0.528 . . . . 0.0 110.222 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.543 HD11 ' HB ' ' A' ' 20' ' ' ILE . 1.8 tt -121.42 156.3 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.266 -0.896 . . . . 0.0 110.248 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.702 ' O ' HG22 ' A' ' 20' ' ' ILE . 4.9 t -141.56 -150.59 0.32 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.334 -0.854 . . . . 0.0 110.087 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.666 ' N ' HG23 ' A' ' 4' ' ' THR . 7.6 mttt -118.18 -174.82 2.73 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.502 -0.749 . . . . 0.0 110.446 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.506 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 67.4 m -109.97 -150.04 0.45 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.344 -0.848 . . . . 0.0 110.201 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.12 -170.69 1.93 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.27 -0.893 . . . . 0.0 110.17 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.78 15.54 11.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.238 -0.913 . . . . 0.0 110.224 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -128.9 31.36 4.94 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.215 -0.928 . . . . 0.0 110.181 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.4 ttt -148.21 20.03 1.09 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.267 -0.896 . . . . 0.0 110.337 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -101.82 75.02 1.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.897 . . . . 0.0 110.145 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -136.15 20.54 3.57 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -119.49 -58.56 1.9 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.12 -1.223 . . . . 0.0 110.297 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.721 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 26.0 p -97.06 121.71 39.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.321 -0.862 . . . . 0.0 110.349 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.561 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.8 mt -90.79 -45.55 8.75 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.222 -0.924 . . . . 0.0 110.382 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.57 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 6.3 m80 -108.81 77.03 1.05 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.257 -0.902 . . . . 0.0 110.148 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -173.09 -163.61 27.1 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -123.32 135.49 54.22 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.218 -1.166 . . . . 0.0 110.209 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.506 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t -79.9 144.94 32.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -0.887 . . . . 0.0 110.11 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.751 HD12 ' CD1' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -158.18 -179.86 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.22 -0.925 . . . . 0.0 109.565 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.511 ' O ' HG13 ' A' ' 3' ' ' ILE . 17.9 t80 -144.22 128.58 17.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.886 -1.134 . . . . 0.0 110.449 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.598 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.7 mm? -85.14 130.63 34.57 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.15 -0.969 . . . . 0.0 110.789 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.602 HG11 ' CB ' ' A' ' 2' ' ' SER . 6.0 p -90.86 -25.74 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.345 -0.847 . . . . 0.0 110.564 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -78.08 -3.62 43.21 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.008 -1.057 . . . . 0.0 108.925 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.522 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -159.81 68.41 0.4 Allowed 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 179.18 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.509 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.58 91.76 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.981 0.896 . . . . 0.0 111.2 -178.409 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -160.18 147.95 16.53 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.517 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 23.1 t30 -63.21 128.71 37.09 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.373 -0.83 . . . . 0.0 110.235 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.751 ' CD1' HD12 ' A' ' 20' ' ' ILE . 6.5 t80 -122.16 116.58 24.43 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.357 -0.839 . . . . 0.0 110.108 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.721 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 1.8 m -122.57 112.69 18.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.223 -0.923 . . . . 0.0 110.142 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -80.13 102.06 9.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.173 -0.954 . . . . 0.0 109.842 179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 74.4 m -79.54 170.42 16.59 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.875 . . . . 0.0 110.041 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 32.2 tt0 -79.45 125.45 29.57 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.221 -0.924 . . . . 0.0 109.807 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.422 ' H ' HG23 ' A' ' 34' ' ' VAL . 10.5 t -66.43 -20.72 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.398 -0.814 . . . . 0.0 110.182 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.418 ' O ' HD12 ' A' ' 46' ' ' LEU . . . -66.93 -10.6 56.35 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.57 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.79 176.52 9.65 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -1.185 . . . . 0.0 109.912 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.795 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -108.64 27.48 9.37 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.907 -1.121 . . . . 0.0 110.343 179.573 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -159.29 155.59 26.68 Favored Glycine 0 N--CA 1.488 2.137 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.541 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.5 p -84.63 43.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.289 -1.124 . . . . 0.0 109.815 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -157.02 20.11 0.31 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.32 -0.862 . . . . 0.0 110.051 -179.557 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 8.9 p 29.22 91.42 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.495 0.664 . . . . 0.0 111.614 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.3 tt0 -155.56 -36.96 0.09 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.339 -0.851 . . . . 0.0 110.158 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.795 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.4 p80 -121.13 121.07 37.05 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.143 -0.973 . . . . 0.0 110.462 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.597 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 33.8 t80 -83.88 121.94 28.03 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.378 0.609 . . . . 0.0 109.839 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.566 ' HB2' HG21 ' A' ' 37' ' ' THR . 0.2 OUTLIER -92.22 -19.83 21.8 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.28 -0.888 . . . . 0.0 110.069 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.597 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.0 mt . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.327 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 121.216 0.531 . . . . 0.0 110.469 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.683 ' CG1' HG22 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -79.93 153.97 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.242 -0.911 . . . . 0.0 109.913 179.675 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.507 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.4 m -136.05 162.19 33.59 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.281 -0.887 . . . . 0.0 110.252 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -93.6 -178.8 4.82 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.433 -0.792 . . . . 0.0 110.099 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.546 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 15.5 m -110.97 -163.42 0.85 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.219 -0.926 . . . . 0.0 110.274 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.55 -158.84 0.9 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.271 -0.893 . . . . 0.0 110.159 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.0 p -81.77 168.65 17.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.234 -0.917 . . . . 0.0 110.121 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 46.5 23.68 0.25 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.141 -0.974 . . . . 0.0 110.345 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -120.75 -0.77 10.1 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 110.163 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -120.56 101.41 7.74 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.237 -0.914 . . . . 0.0 110.257 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -138.65 16.44 3.32 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -114.74 -53.4 2.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.313 -1.11 . . . . 0.0 110.284 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -93.62 123.11 36.72 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.295 -0.878 . . . . 0.0 110.632 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.5 mt -90.31 -42.85 10.73 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.267 -0.896 . . . . 0.0 110.315 179.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.569 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.9 m80 -109.8 88.27 2.71 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.302 -0.874 . . . . 0.0 110.165 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.13 -167.61 40.6 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -123.23 159.43 28.73 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.227 -1.16 . . . . 0.0 110.357 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.546 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.3 OUTLIER -99.94 149.21 23.66 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.231 -0.918 . . . . 0.0 110.504 -179.807 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.763 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.4 mt -155.0 -171.64 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.364 -0.835 . . . . 0.0 109.531 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.507 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 18.7 t80 -145.55 133.56 21.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.042 -1.036 . . . . 0.0 109.644 179.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.63 HD23 ' HB2' ' A' ' 29' ' ' TYR . 2.1 mm? -99.4 137.96 37.16 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.129 -0.982 . . . . 0.0 111.076 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.408 HG12 ' H ' ' A' ' 23' ' ' VAL . 7.2 p -90.38 -26.01 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.38 -0.825 . . . . 0.0 110.52 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 25' ' ' MET . 49.0 p30 -77.9 -4.73 48.24 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.119 -0.988 . . . . 0.0 109.095 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.556 ' O ' ' N ' ' A' ' 27' ' ' GLN . 8.8 mtm -157.95 65.57 0.46 Allowed 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 179.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.474 ' C ' ' O ' ' A' ' 25' ' ' MET . 68.4 p -29.28 86.93 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 CA-C-O 121.614 0.721 . . . . 0.0 111.831 -178.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.556 ' N ' ' O ' ' A' ' 25' ' ' MET . 2.9 pt20 -160.9 174.91 13.13 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.707 -0.621 . . . . 0.0 109.405 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -79.28 146.85 32.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.345 -0.847 . . . . 0.0 110.549 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.763 ' CD1' HD12 ' A' ' 20' ' ' ILE . 8.1 t80 -129.88 108.54 10.21 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.53 -0.732 . . . . 0.0 109.592 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 5.8 m -111.72 107.77 16.97 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.104 -0.998 . . . . 0.0 110.74 -179.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.49 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -79.57 121.63 25.48 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.182 -0.948 . . . . 0.0 109.218 179.182 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.65 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 89.9 m -79.38 173.67 12.34 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.221 -0.925 . . . . 0.0 110.137 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -78.94 115.1 18.4 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.229 -0.919 . . . . 0.0 109.8 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.415 ' H ' HG23 ' A' ' 34' ' ' VAL . 22.0 t -51.93 100.89 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.498 -0.751 . . . . 0.0 109.883 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 151.69 -13.64 0.78 Allowed Glycine 0 N--CA 1.493 2.449 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.433 ' CZ ' ' HD1' ' A' ' 44' ' ' PHE . 1.2 m-85 -79.13 170.54 16.5 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.012 -1.287 . . . . 0.0 110.049 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.739 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -112.38 35.72 3.69 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.937 -1.102 . . . . 0.0 110.544 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.414 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -160.29 154.9 25.97 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.549 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.0 p -85.18 45.43 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.21 -1.171 . . . . 0.0 109.47 179.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.575 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -158.76 20.01 0.21 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.518 -0.739 . . . . 0.0 109.979 -179.179 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.65 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 2.8 p 27.12 93.56 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.577 -0.702 . . . . 0.0 111.541 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 4.4 tt0 -160.73 -35.65 0.05 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.549 -0.719 . . . . 0.0 110.323 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.739 ' CE1' HG23 ' A' ' 37' ' ' THR . 7.4 p80 -124.15 112.55 17.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.111 -0.993 . . . . 0.0 110.652 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.433 ' HD1' ' CZ ' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -79.89 134.25 36.28 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.297 -0.877 . . . . 0.0 109.508 179.309 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.55 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -91.14 -24.05 20.08 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.362 -0.836 . . . . 0.0 110.212 -179.303 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.547 ' HG ' ' CD2' ' A' ' 45' ' ' PHE . 1.9 mt . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.277 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.845 ' HB2' HG11 ' A' ' 23' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.189 0.518 . . . . 0.0 110.255 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 1.089 HD11 HD12 ' A' ' 20' ' ' ILE . 6.4 tt -79.93 157.29 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.529 HG23 ' N ' ' A' ' 5' ' ' LYS . 6.4 t -142.58 -153.85 0.49 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.296 -0.877 . . . . 0.0 110.006 179.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.529 ' N ' HG23 ' A' ' 4' ' ' THR . 11.7 mtpt -102.73 178.61 4.52 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.394 -0.816 . . . . 0.0 110.258 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 59.6 m -105.69 -150.87 0.44 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.175 -0.953 . . . . 0.0 110.247 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.5 m -111.2 -170.03 1.57 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.209 -0.932 . . . . 0.0 110.203 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.68 13.34 8.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -0.888 . . . . 0.0 110.185 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.63 21.78 5.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.293 -0.88 . . . . 0.0 110.214 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -127.04 3.53 6.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.255 -0.903 . . . . 0.0 110.136 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 11' ' ' ASN . 21.5 p30 -86.07 48.65 1.64 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.287 -0.883 . . . . 0.0 110.103 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -126.06 3.55 7.88 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -101.22 -48.49 4.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.15 -1.206 . . . . 0.0 110.27 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 22.1 p -105.16 116.18 31.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.291 -0.881 . . . . 0.0 110.63 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.596 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.6 mt -90.43 -39.05 12.87 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.301 -0.875 . . . . 0.0 110.506 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.596 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 21.3 m80 -110.73 63.11 0.61 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.109 -0.995 . . . . 0.0 110.555 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.481 ' HA3' ' SG ' ' A' ' 32' ' ' CYS . . . -173.51 -160.32 21.69 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -122.66 136.25 54.82 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.292 -1.122 . . . . 0.0 110.177 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t -84.64 146.73 27.33 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.326 -0.859 . . . . 0.0 110.449 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.089 HD12 HD11 ' A' ' 3' ' ' ILE . 5.0 pt -157.78 -170.61 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.379 -0.826 . . . . 0.0 110.104 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.474 ' O ' HG13 ' A' ' 3' ' ' ILE . 4.6 t80 -140.9 133.7 28.94 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.112 -0.993 . . . . 0.0 110.097 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.733 HD12 ' OD2' ' A' ' 24' ' ' ASP . 1.2 mm? -86.7 133.74 33.65 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.122 -0.986 . . . . 0.0 111.113 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.845 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.2 p -90.83 -25.23 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.412 -0.805 . . . . 0.0 110.67 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.733 ' OD2' HD12 ' A' ' 22' ' ' LEU . 2.9 p30 -78.64 -15.52 58.41 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.047 -1.033 . . . . 0.0 108.9 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.6 mtt -147.43 67.0 1.13 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.1 p -29.11 88.76 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.693 0.758 . . . . 0.0 111.661 -178.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.3 OUTLIER -160.28 173.44 15.7 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.673 -0.642 . . . . 0.0 109.561 179.643 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -77.18 136.89 38.6 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.368 -0.832 . . . . 0.0 110.522 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.877 ' CD1' HD11 ' A' ' 20' ' ' ILE . 8.6 t80 -135.82 154.42 51.19 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.461 -0.774 . . . . 0.0 109.653 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.617 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 3.0 m -153.64 123.51 6.83 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.926 -1.109 . . . . 0.0 110.94 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.412 ' HA ' ' HD3' ' A' ' 31' ' ' ARG . 15.3 tpp85 -103.04 106.72 17.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.175 -0.953 . . . . 0.0 109.093 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 27.0 m -111.27 -164.82 0.94 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.293 -0.88 . . . . 0.0 110.592 -178.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.418 ' CG ' ' H ' ' A' ' 35' ' ' GLY . 21.2 tt0 -78.24 123.05 26.49 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.244 -0.91 . . . . 0.0 109.615 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.4 t -64.5 -10.59 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.447 -0.783 . . . . 0.0 109.707 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.418 ' H ' ' CG ' ' A' ' 33' ' ' GLU . . . -68.72 -7.09 53.86 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.595 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.6 m-85 -79.46 165.13 23.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.18 -1.188 . . . . 0.0 109.407 179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.905 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.61 34.0 4.22 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.878 -1.139 . . . . 0.0 111.478 -178.823 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.7 159.5 31.02 Favored Glycine 0 N--CA 1.491 2.336 0 C-N-CA 119.351 -1.404 . . . . 0.0 110.075 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -84.33 13.04 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -1.119 . . . . 0.0 109.362 178.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 28.0 ttp180 -109.08 -17.62 13.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.569 -0.707 . . . . 0.0 110.116 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 21.9 m 61.11 58.65 2.18 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.315 -0.866 . . . . 0.0 110.607 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER -136.35 -19.53 1.44 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.482 -0.761 . . . . 0.0 111.278 179.93 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.905 ' CE1' HG23 ' A' ' 37' ' ' THR . 4.9 p80 -127.52 119.93 27.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.736 -1.227 . . . . 0.0 110.7 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.628 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 21.1 t80 -81.75 108.22 15.12 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.327 0.584 . . . . 0.0 109.964 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.564 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -64.61 -15.9 61.87 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.222 -0.924 . . . . 0.0 109.912 -179.773 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.628 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.0 mt . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.27 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 1.028 ' CB ' HG11 ' A' ' 23' ' ' VAL . 48.3 m . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.433 0.635 . . . . 0.0 110.147 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.826 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.8 OUTLIER -139.18 153.0 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.297 -0.877 . . . . 0.0 110.043 -179.954 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -132.83 162.23 32.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.261 -0.899 . . . . 0.0 110.425 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -101.93 168.16 9.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.335 -0.853 . . . . 0.0 110.129 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.723 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 58.4 m -108.83 -145.66 0.4 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.227 -0.92 . . . . 0.0 110.253 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.495 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.3 OUTLIER -153.79 -158.27 0.85 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.311 -0.868 . . . . 0.0 110.062 179.877 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.495 ' N ' ' OG ' ' A' ' 7' ' ' SER . 3.0 t -80.5 168.62 18.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.154 -0.966 . . . . 0.0 110.231 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.6 t0 47.88 22.86 0.4 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.097 -1.002 . . . . 0.0 110.286 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.19 8.17 8.53 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.326 -0.859 . . . . 0.0 110.176 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -114.75 -142.72 0.38 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.285 -0.885 . . . . 0.0 110.04 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 116.94 -0.17 19.62 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.426 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 65.2 t80 -110.48 -51.35 2.88 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.222 -1.163 . . . . 0.0 110.132 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.2 p -96.67 120.74 37.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.307 -0.871 . . . . 0.0 110.163 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.596 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 10.8 mt -88.17 -40.96 13.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.201 -0.937 . . . . 0.0 110.377 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.596 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.1 m80 -114.2 80.3 1.37 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.216 -0.928 . . . . 0.0 110.037 -179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.507 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -179.74 -168.25 38.25 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -115.04 167.55 10.71 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.298 -1.119 . . . . 0.0 110.283 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.723 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 1.3 t -103.68 126.36 50.77 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.394 -0.816 . . . . 0.0 110.378 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.885 HD13 ' HD2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -130.25 -172.9 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.322 -0.861 . . . . 0.0 109.555 -179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.507 ' O ' HD12 ' A' ' 3' ' ' ILE . 14.5 t80 -145.82 142.85 29.23 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.894 -1.129 . . . . 0.0 110.19 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.622 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.2 mm? -104.14 136.64 43.38 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.108 -0.995 . . . . 0.0 111.37 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 1.028 HG11 ' CB ' ' A' ' 2' ' ' SER . 14.7 p -90.78 -27.69 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.352 -0.842 . . . . 0.0 110.556 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -78.77 -19.04 53.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.035 -1.041 . . . . 0.0 108.839 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.551 ' HB3' ' NE2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -138.84 63.6 1.51 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.735 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.486 ' C ' ' O ' ' A' ' 25' ' ' MET . 11.5 p -28.75 89.03 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.679 0.752 . . . . 0.0 111.543 -178.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.551 ' NE2' ' HB3' ' A' ' 25' ' ' MET . 0.6 OUTLIER -159.73 176.74 11.61 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.609 -0.682 . . . . 0.0 109.73 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -88.09 115.94 25.92 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.495 -0.753 . . . . 0.0 110.352 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.885 ' HD2' HD13 ' A' ' 20' ' ' ILE . 28.7 t80 -91.08 157.03 17.47 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.493 -0.755 . . . . 0.0 109.73 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -141.15 112.85 7.64 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.067 -1.02 . . . . 0.0 110.403 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.772 ' H ' HD11 ' A' ' 20' ' ' ILE . 11.1 tpp180 -88.66 115.77 26.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.262 -0.898 . . . . 0.0 109.479 179.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.504 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 91.4 m -79.05 170.12 17.15 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.281 -0.887 . . . . 0.0 110.391 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -79.44 113.97 18.0 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.316 -0.865 . . . . 0.0 110.143 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.411 HG23 ' H ' ' A' ' 34' ' ' VAL . 47.4 t -48.12 104.62 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.362 -0.836 . . . . 0.0 109.786 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.92 -9.18 2.27 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.525 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.41 175.58 10.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.13 -1.217 . . . . 0.0 109.832 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -116.95 13.14 14.85 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.025 -1.047 . . . . 0.0 110.818 -179.583 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -128.74 161.73 22.36 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.641 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.3 p -87.67 31.55 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.298 -1.119 . . . . 0.0 109.743 179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.37 29.62 0.16 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.332 -0.855 . . . . 0.0 109.962 -179.655 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.504 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 8.1 p 31.76 90.8 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.616 -0.677 . . . . 0.0 111.13 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 4.0 tm-20 -154.02 -39.88 0.09 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.295 -0.878 . . . . 0.0 110.098 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.2 p-80 -117.21 128.49 55.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.093 -1.004 . . . . 0.0 110.202 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.588 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 34.9 t80 -88.62 130.49 35.27 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.436 0.636 . . . . 0.0 110.528 -178.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -93.48 -36.8 12.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.409 -0.807 . . . . 0.0 110.001 -179.741 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.588 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.379 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.687 ' HB3' HG11 ' A' ' 23' ' ' VAL . 3.7 t . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.335 0.588 . . . . 0.0 110.376 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.884 HG12 HG22 ' A' ' 20' ' ' ILE . 5.5 tt -80.03 -178.25 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.209 -0.932 . . . . 0.0 110.003 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -155.19 160.74 41.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.238 -0.914 . . . . 0.0 110.246 -179.896 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.5 mtmm -110.36 161.93 15.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.297 -0.877 . . . . 0.0 110.218 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.1 m -103.73 -144.64 0.37 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.269 -0.895 . . . . 0.0 110.101 179.991 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB3' ' HB2' ' A' ' 10' ' ' MET . 0.5 OUTLIER -127.61 -154.43 0.63 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.183 -0.948 . . . . 0.0 110.214 179.943 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.3 m -82.35 -61.1 1.99 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.245 -0.909 . . . . 0.0 110.18 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -91.51 27.65 1.93 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.227 -0.92 . . . . 0.0 110.182 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.42 ' HB2' ' HB3' ' A' ' 7' ' ' SER . 0.0 OUTLIER -108.97 -11.83 14.93 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.274 -0.891 . . . . 0.0 110.217 -180.0 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 11' ' ' ASN . 7.7 p-10 -132.77 96.85 3.9 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.307 -0.87 . . . . 0.0 110.202 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.17 52.73 0.67 Allowed Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -121.79 -59.36 1.68 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -1.151 . . . . 0.0 110.184 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -87.75 118.75 27.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 110.296 -179.877 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.591 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.2 mt -78.72 -43.01 26.81 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.303 -0.873 . . . . 0.0 110.288 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.591 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 9.1 m80 -116.99 77.54 1.13 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.329 -0.857 . . . . 0.0 110.496 -178.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.441 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -175.85 167.71 39.64 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.832 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -89.96 145.55 25.03 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -1.209 . . . . 0.0 110.27 179.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 15.9 t -88.9 142.6 27.51 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.331 -0.856 . . . . 0.0 110.349 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.884 HG22 HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -158.74 -175.44 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.314 -0.866 . . . . 0.0 109.697 179.979 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.51 ' O ' HG13 ' A' ' 3' ' ' ILE . 9.4 t80 -152.68 123.27 7.29 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.037 -1.039 . . . . 0.0 109.963 -179.852 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.667 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.9 mm? -82.16 130.98 35.23 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.214 -0.929 . . . . 0.0 111.048 -179.366 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.687 HG11 ' HB3' ' A' ' 2' ' ' SER . 7.7 p -90.39 -23.81 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.298 -0.876 . . . . 0.0 110.42 179.518 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.39 -10.23 59.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.067 -1.021 . . . . 0.0 108.771 178.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.547 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.5 mpp? -150.86 69.0 0.96 Allowed 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.466 ' C ' ' O ' ' A' ' 25' ' ' MET . 6.9 p -29.49 87.64 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 121.575 0.702 . . . . 0.0 111.91 -178.183 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 tt0 -158.67 154.1 25.86 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.703 -0.623 . . . . 0.0 109.85 179.595 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.97 127.35 32.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.468 -0.77 . . . . 0.0 110.232 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.799 ' CD1' HD12 ' A' ' 20' ' ' ILE . 15.5 t80 -116.57 123.6 47.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.313 -0.867 . . . . 0.0 109.965 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 5.8 m -125.67 118.58 25.93 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.154 -0.966 . . . . 0.0 110.38 -179.78 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.464 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 5.1 tpp85 -79.43 124.85 28.84 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.218 -0.926 . . . . 0.0 109.421 179.551 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.8 m -79.4 160.4 26.68 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.214 -0.929 . . . . 0.0 109.528 -179.782 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' GLY . 16.2 tt0 -78.79 110.34 13.87 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.072 -1.017 . . . . 0.0 109.411 179.764 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.433 ' C ' ' O ' ' A' ' 33' ' ' GLU . 40.3 t -41.61 94.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.541 -0.724 . . . . 0.0 110.244 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.825 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 152.9 -17.67 0.73 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.868 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.589 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.1 m-85 -79.92 165.97 22.11 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.192 -1.181 . . . . 0.0 110.216 -179.937 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 1.114 HG23 ' CE1' ' A' ' 43' ' ' HIS . 6.1 t -120.28 35.21 4.94 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 119.103 -1.039 . . . . 0.0 110.902 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -140.6 153.87 23.87 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 179.721 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.692 HG12 ' O ' ' A' ' 39' ' ' VAL . 43.1 t -85.2 14.05 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.356 -1.085 . . . . 0.0 109.782 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.576 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 2.1 tmm_? -127.9 -15.14 4.91 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.455 -0.778 . . . . 0.0 110.399 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.1 m 71.75 85.59 0.12 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.389 -0.819 . . . . 0.0 109.719 -179.679 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.576 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -152.42 -31.33 0.14 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.638 -0.664 . . . . 0.0 110.715 -179.805 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 1.114 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.2 p80 -123.64 118.79 28.09 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.891 -1.131 . . . . 0.0 110.729 179.522 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.612 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 24.6 t80 -80.62 104.06 10.89 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.307 0.575 . . . . 0.0 109.9 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.562 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -64.85 -22.21 66.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.206 -0.934 . . . . 0.0 109.95 -179.774 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.825 HD12 ' O ' ' A' ' 35' ' ' GLY . 4.4 mt . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.139 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.571 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.343 0.592 . . . . 0.0 110.116 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.793 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -143.97 153.62 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.325 -0.86 . . . . 0.0 110.342 -179.769 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.485 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -131.15 173.97 10.5 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.238 -0.914 . . . . 0.0 110.251 179.906 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -106.75 165.14 11.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.234 -0.916 . . . . 0.0 110.149 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.629 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 60.7 m -102.11 -141.17 0.35 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.254 -0.904 . . . . 0.0 110.216 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.5 t -141.25 -160.91 1.13 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.28 -0.888 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.2 28.5 1.41 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.26 -0.9 . . . . 0.0 110.241 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.34 30.85 1.54 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.228 -0.92 . . . . 0.0 110.177 179.962 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -145.44 14.56 1.43 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.97 . . . . 0.0 110.245 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -109.83 75.28 0.93 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.177 -0.952 . . . . 0.0 110.234 -179.967 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.32 -7.47 6.38 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -95.57 -60.28 1.69 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.281 -1.129 . . . . 0.0 110.076 -179.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.555 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.1 p -83.89 126.66 33.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.334 -0.854 . . . . 0.0 110.136 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.56 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.5 mt -90.58 -45.72 8.74 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.138 -0.976 . . . . 0.0 110.333 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.56 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.1 m80 -109.33 77.49 1.07 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.257 -0.902 . . . . 0.0 110.233 -179.573 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.484 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -174.5 -163.49 27.86 Favored Glycine 0 N--CA 1.488 2.16 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -128.73 153.15 47.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.328 -1.101 . . . . 0.0 110.285 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.629 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -83.07 152.45 25.35 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.305 -0.872 . . . . 0.0 110.124 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.845 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -153.62 -173.99 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.144 -0.973 . . . . 0.0 109.603 -179.894 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.485 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 23.0 t80 -147.41 133.0 18.76 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.038 -1.039 . . . . 0.0 110.162 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.626 HD22 HD12 ' A' ' 3' ' ' ILE . 1.4 mm? -94.7 134.64 37.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.254 -0.904 . . . . 0.0 110.468 -179.882 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.571 HG11 ' CB ' ' A' ' 2' ' ' SER . 8.1 p -90.38 -27.16 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.344 -0.848 . . . . 0.0 110.599 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' A' ' 25' ' ' MET . 11.2 p30 -78.16 -15.13 59.12 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.106 -0.996 . . . . 0.0 108.757 179.362 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.3 ttm -144.74 65.56 1.27 Allowed 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.852 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 19.8 p -29.05 88.7 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 121.629 0.728 . . . . 0.0 111.751 -178.321 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 7.1 pt20 -160.38 176.15 12.0 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.627 -0.671 . . . . 0.0 109.601 179.488 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -81.68 138.82 35.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.452 -179.836 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.845 ' CD1' HD12 ' A' ' 20' ' ' ILE . 17.7 t80 -128.15 117.32 21.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.372 -0.83 . . . . 0.0 109.838 179.861 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.555 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -114.06 117.39 31.14 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.08 -1.013 . . . . 0.0 110.621 -179.671 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.484 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.0 ttm180 -91.78 129.8 37.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.945 . . . . 0.0 109.749 179.433 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.502 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 71.9 m -79.4 175.12 10.89 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.279 -0.888 . . . . 0.0 110.241 -179.869 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -79.81 112.85 17.49 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -0.891 . . . . 0.0 109.854 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.423 HG23 ' H ' ' A' ' 34' ' ' VAL . 43.4 t -47.27 105.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.361 -0.837 . . . . 0.0 109.887 -179.94 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.47 -8.89 2.37 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.743 -1.343 . . . . 0.0 109.743 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.477 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.33 176.07 10.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.116 -1.226 . . . . 0.0 110.056 179.963 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.608 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -115.12 31.31 6.78 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.119 -0.988 . . . . 0.0 110.378 -179.49 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.06 155.31 26.43 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.519 ' O ' HG22 ' A' ' 39' ' ' VAL . 12.5 p -84.76 43.07 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.275 -1.133 . . . . 0.0 109.789 179.61 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.568 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.27 22.21 0.16 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.412 -0.805 . . . . 0.0 109.918 -179.537 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.502 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 6.6 p 28.95 92.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.697 -0.627 . . . . 0.0 111.472 179.767 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.4 OUTLIER -154.2 -42.85 0.09 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.378 -0.826 . . . . 0.0 110.139 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.608 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.4 p-80 -118.24 127.75 54.03 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.09 -1.006 . . . . 0.0 110.364 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.604 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 37.6 t80 -86.86 128.07 35.04 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.387 0.613 . . . . 0.0 110.508 -178.65 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -92.59 -35.2 13.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.385 -0.822 . . . . 0.0 109.964 -179.758 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.604 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.22 -179.713 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.534 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.38 0.61 . . . . 0.0 110.173 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.705 HD11 ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -147.8 156.73 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.28 -0.887 . . . . 0.0 110.161 -179.948 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.496 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.8 m -133.43 164.32 27.4 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.294 -0.879 . . . . 0.0 110.158 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 19' ' ' CYS . 10.6 tttt -126.41 155.05 42.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.205 -0.935 . . . . 0.0 110.181 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.2 m -99.91 -146.14 0.34 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.255 -0.903 . . . . 0.0 110.227 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.5 t -122.23 -164.42 1.16 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.294 -0.879 . . . . 0.0 110.221 179.912 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -87.13 11.52 13.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.227 -0.92 . . . . 0.0 110.321 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -121.98 26.35 8.63 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.24 -0.913 . . . . 0.0 110.188 179.938 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.4 14.16 4.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.297 -0.877 . . . . 0.0 110.138 179.935 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -102.47 66.5 0.98 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.931 . . . . 0.0 110.269 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.26 26.26 10.62 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -145.86 -55.8 0.29 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -1.133 . . . . 0.0 110.249 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.553 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.4 p -90.51 127.34 36.21 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.26 -0.9 . . . . 0.0 110.354 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.67 ' N ' HD23 ' A' ' 15' ' ' LEU . 3.5 mt -90.52 -44.88 9.29 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.231 -0.918 . . . . 0.0 110.344 179.885 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 18.0 m80 -110.51 89.38 3.01 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.318 -0.864 . . . . 0.0 110.487 -179.168 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.474 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.23 -161.46 31.55 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 179.931 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -134.14 149.3 51.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.292 -1.122 . . . . 0.0 110.229 179.881 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.3 t -79.9 120.29 23.93 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.216 -0.928 . . . . 0.0 110.027 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.705 ' CG2' HD11 ' A' ' 3' ' ' ILE . 21.2 mm -122.32 168.64 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 110.224 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.496 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 18.3 t80 -139.47 129.94 25.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 109.994 -179.988 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.608 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 3.6 mm? -90.06 134.42 34.26 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.214 -0.929 . . . . 0.0 110.638 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.534 HG11 ' HB3' ' A' ' 2' ' ' SER . 11.3 p -90.48 -25.58 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.269 -0.894 . . . . 0.0 110.541 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -78.34 -14.45 59.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.086 -1.009 . . . . 0.0 108.82 179.323 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.3 ttm -147.47 66.66 1.13 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.992 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 58.8 p -29.21 88.57 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.675 0.75 . . . . 0.0 111.467 -178.437 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.39 146.38 15.26 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.493 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -55.81 161.55 2.15 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.132 -0.98 . . . . 0.0 110.388 -179.711 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.608 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 5.9 t80 -154.59 86.31 1.14 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.402 -0.811 . . . . 0.0 109.906 -179.908 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.553 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.2 m -82.8 104.71 13.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.188 -0.945 . . . . 0.0 110.53 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.494 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 11.5 tpp85 -81.7 123.17 28.5 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.212 -0.93 . . . . 0.0 110.118 179.698 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.494 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 97.7 m -79.79 172.78 13.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.328 -0.858 . . . . 0.0 110.145 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -79.81 128.81 33.88 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.891 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.3 t -58.54 105.84 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.249 -0.907 . . . . 0.0 110.084 -179.937 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 1.019 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 145.17 -14.16 1.88 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.716 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.589 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.2 m-85 -79.75 154.24 28.67 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.344 -1.092 . . . . 0.0 109.903 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 1.152 HG23 ' CE1' ' A' ' 43' ' ' HIS . 5.1 t -109.42 46.58 0.99 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.954 -1.092 . . . . 0.0 110.782 -179.762 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.2 156.18 27.4 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.693 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.651 ' O ' HG22 ' A' ' 39' ' ' VAL . 10.6 p -87.11 37.2 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.261 -1.141 . . . . 0.0 109.753 179.609 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.593 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.09 22.36 0.16 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.418 -0.801 . . . . 0.0 109.839 -179.483 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.486 ' C ' ' O ' ' A' ' 40' ' ' ARG . 4.2 p 29.74 91.5 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.609 -0.682 . . . . 0.0 111.645 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.593 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 0.7 OUTLIER -144.92 -36.91 0.3 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.552 -0.717 . . . . 0.0 109.906 179.382 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 1.152 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.0 p80 -124.21 117.78 25.35 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.164 -0.96 . . . . 0.0 109.9 178.798 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.615 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 46.2 t80 -79.58 103.09 9.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.73 -0.606 . . . . 0.0 110.218 -179.365 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.584 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -65.85 -28.47 69.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.43 -0.794 . . . . 0.0 110.15 -179.763 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 1.019 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.6 mt . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.342 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.191 0.519 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.548 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.7 tt -122.95 155.52 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.34 -0.85 . . . . 0.0 110.167 -179.997 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.537 ' CB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -119.77 -167.8 1.49 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.128 -0.983 . . . . 0.0 110.32 -179.959 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.4 mttp -126.36 -179.89 4.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.214 -0.929 . . . . 0.0 110.468 -179.825 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.71 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 1.9 m -114.95 -161.25 0.77 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.288 -0.882 . . . . 0.0 110.18 179.972 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.7 t -132.29 -144.84 0.25 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.121 -0.987 . . . . 0.0 110.442 -179.826 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 79.4 p -79.61 2.74 21.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.308 -0.87 . . . . 0.0 110.392 -179.821 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -96.93 28.41 3.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 109.868 179.849 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.494 ' HG3' ' HB2' ' A' ' 19' ' ' CYS . 8.9 tmm? -116.75 5.4 13.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.395 -0.816 . . . . 0.0 110.323 -179.676 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -90.02 60.74 4.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.207 -0.933 . . . . 0.0 109.923 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -157.17 -36.06 0.02 OUTLIER Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.576 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 43.4 t80 -93.86 -54.99 3.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.149 -1.206 . . . . 0.0 110.698 -179.692 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.577 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 19.2 p -117.83 117.07 28.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.081 -1.012 . . . . 0.0 110.607 -179.641 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.591 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 17.5 mt -91.33 -50.28 5.9 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.391 -0.818 . . . . 0.0 110.449 179.725 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 6.8 m80 -98.45 79.03 2.46 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.498 -0.751 . . . . 0.0 110.342 -178.813 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.46 163.85 26.98 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -94.33 143.87 26.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.282 -1.128 . . . . 0.0 109.916 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.772 ' C ' HD13 ' A' ' 20' ' ' ILE . 8.1 t -98.68 153.01 19.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.2 -0.938 . . . . 0.0 110.571 -179.747 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.805 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -159.88 -174.51 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.491 -0.755 . . . . 0.0 109.9 -179.932 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.537 ' HB3' ' CB ' ' A' ' 4' ' ' THR . 15.1 t80 -133.21 129.46 37.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.198 -0.938 . . . . 0.0 110.1 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.662 HD23 ' CB ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -87.52 131.38 34.39 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.153 -0.967 . . . . 0.0 110.782 -179.714 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.9 p -90.7 -26.74 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.24 -0.913 . . . . 0.0 110.602 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -78.12 -14.52 59.45 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.111 -0.993 . . . . 0.0 108.927 179.264 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.537 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.3 mtt -148.19 67.32 1.09 Allowed 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.862 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.456 ' C ' ' O ' ' A' ' 25' ' ' MET . 64.1 p -29.87 87.83 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.59 0.71 . . . . 0.0 111.968 -178.446 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -158.18 165.43 34.93 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.583 -0.698 . . . . 0.0 109.843 179.497 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.43 113.48 14.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.485 -0.76 . . . . 0.0 110.441 -179.738 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.662 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.0 t80 -101.53 117.34 34.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.397 -0.815 . . . . 0.0 109.53 179.642 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.577 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.1 m -117.47 112.76 21.08 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.122 -0.986 . . . . 0.0 110.852 -179.181 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.494 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.4 tpp85 -86.97 110.17 19.86 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.309 -0.87 . . . . 0.0 109.629 179.267 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 84.9 m -79.53 -179.84 7.07 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.171 -0.956 . . . . 0.0 110.382 -179.602 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -82.72 115.85 21.83 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.28 -0.888 . . . . 0.0 110.291 -179.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.7 t -52.21 105.9 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.299 -0.876 . . . . 0.0 109.611 179.701 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 139.42 -4.7 2.84 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.782 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.605 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.27 163.92 24.54 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.019 -1.283 . . . . 0.0 109.567 179.756 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.868 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -97.71 27.22 4.51 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.832 -1.167 . . . . 0.0 110.077 -179.834 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.09 152.94 23.85 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 179.545 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.592 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.9 p -84.15 44.0 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.198 -1.178 . . . . 0.0 109.952 -179.969 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.587 ' NH1' ' CG ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -160.14 20.29 0.16 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.307 -0.871 . . . . 0.0 110.531 -179.537 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.8 p 33.54 93.66 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.576 -0.702 . . . . 0.0 111.792 179.926 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.587 ' CG ' ' NH1' ' A' ' 40' ' ' ARG . 1.7 tm-20 -151.13 -40.32 0.12 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.531 -0.73 . . . . 0.0 109.655 179.127 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.868 ' CE1' HG23 ' A' ' 37' ' ' THR . 3.8 p80 -122.82 112.43 17.88 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.911 0.862 . . . . 0.0 108.714 178.622 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 20.4 t80 -78.54 108.7 12.11 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.674 0.75 . . . . 0.0 110.126 -178.441 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.556 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -66.15 -9.75 34.52 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.431 0.634 . . . . 0.0 109.982 -179.492 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.618 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.9 mt . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.203 -179.718 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.447 ' HB3' ' CG1' ' A' ' 23' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.3 0.572 . . . . 0.0 110.172 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.558 HD11 ' HB ' ' A' ' 20' ' ' ILE . 1.1 tt -138.8 154.69 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.277 -0.89 . . . . 0.0 110.146 -179.95 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.2 m -127.73 161.52 28.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 -179.991 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.03 178.79 7.71 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.272 -0.892 . . . . 0.0 110.31 -179.903 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.846 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 68.7 m -109.66 -147.53 0.42 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.253 -0.905 . . . . 0.0 110.075 179.936 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 t -133.99 -167.64 1.99 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.255 -0.903 . . . . 0.0 110.119 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.6 t -83.96 12.69 5.84 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.267 -0.896 . . . . 0.0 110.274 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -132.25 23.98 4.49 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.299 -0.876 . . . . 0.0 110.253 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -121.82 -5.27 9.11 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.246 -0.909 . . . . 0.0 110.213 -179.976 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -90.88 54.16 2.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.277 -0.89 . . . . 0.0 110.272 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -119.43 0.44 14.16 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -106.92 -64.92 1.13 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.197 -1.178 . . . . 0.0 110.26 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.2 p -84.53 124.54 31.51 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.209 -0.932 . . . . 0.0 110.351 -179.926 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.598 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.5 mt -90.07 -44.36 9.87 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.269 -0.895 . . . . 0.0 110.273 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.598 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 3.6 m80 -114.62 92.04 3.82 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.29 -0.881 . . . . 0.0 110.159 -179.719 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.467 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.53 -169.43 42.4 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.997 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -110.49 143.91 40.11 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.28 -1.129 . . . . 0.0 110.165 179.853 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.846 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 1.0 OUTLIER -95.92 128.69 43.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.316 -0.865 . . . . 0.0 110.419 -179.903 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.8 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -146.46 -171.82 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.305 -0.872 . . . . 0.0 110.008 179.878 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.439 ' O ' HG13 ' A' ' 3' ' ' ILE . 17.5 t80 -142.83 135.13 27.46 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.334 -0.854 . . . . 0.0 109.811 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.629 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.4 mm? -87.62 129.61 35.06 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.046 -1.034 . . . . 0.0 110.839 -179.589 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.447 ' CG1' ' HB3' ' A' ' 2' ' ' SER . 8.9 p -90.71 -24.98 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.247 -0.908 . . . . 0.0 110.454 179.746 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -78.31 -12.13 59.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.994 -1.066 . . . . 0.0 108.802 179.206 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.0 OUTLIER -151.78 68.83 0.9 Allowed 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 178.915 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 56.0 p -29.19 89.78 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.791 0.805 . . . . 0.0 111.412 -178.545 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.531 ' HG3' ' N ' ' A' ' 28' ' ' ASN . 1.5 tt0 -159.88 148.13 17.16 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.621 -0.674 . . . . 0.0 109.562 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.531 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 15.9 p30 -61.46 126.46 27.43 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.253 -0.904 . . . . 0.0 110.42 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.629 ' CB ' HD23 ' A' ' 22' ' ' LEU . 9.8 t80 -118.85 133.82 55.58 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.35 -0.844 . . . . 0.0 109.705 179.696 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -135.95 113.92 11.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.096 -1.002 . . . . 0.0 110.594 -179.561 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.467 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.2 tpp180 -81.78 106.07 13.42 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.215 -0.928 . . . . 0.0 109.587 179.373 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 94.1 m -79.49 171.34 15.29 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.255 -0.903 . . . . 0.0 110.186 -179.763 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.423 ' CG ' ' H ' ' A' ' 35' ' ' GLY . 15.4 tt0 -78.91 129.45 34.53 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.222 -0.924 . . . . 0.0 109.662 179.873 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.407 HG23 ' H ' ' A' ' 34' ' ' VAL . 11.8 t -66.12 -14.72 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.332 -0.855 . . . . 0.0 110.287 -179.542 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.423 ' H ' ' CG ' ' A' ' 33' ' ' GLU . . . -69.17 -17.42 72.01 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.836 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.491 ' CE1' ' N ' ' A' ' 43' ' ' HIS . 1.5 m-85 -79.92 166.39 21.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.326 -1.102 . . . . 0.0 110.065 179.828 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.95 HG23 ' CE1' ' A' ' 43' ' ' HIS . 14.2 t -102.39 29.22 5.33 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.979 -1.076 . . . . 0.0 110.516 -179.788 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.42 160.28 31.63 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 179.778 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.545 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.8 p -84.7 43.73 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.121 -1.223 . . . . 0.0 109.897 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.567 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -148.99 12.18 0.85 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.381 -0.825 . . . . 0.0 110.279 -179.384 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 6.9 p 32.05 87.85 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.608 -0.683 . . . . 0.0 110.493 -179.67 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.567 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 2.1 tt0 -160.32 -33.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.214 -0.929 . . . . 0.0 111.023 -179.515 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.95 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.4 p80 -126.72 119.25 26.49 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.708 -1.245 . . . . 0.0 111.937 -179.677 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.546 ' CE2' ' C ' ' A' ' 46' ' ' LEU . 44.4 t80 -87.24 92.15 8.96 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.091 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.869 ' CE2' HD11 ' A' ' 46' ' ' LEU . 0.4 OUTLIER -66.85 -5.39 12.17 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.443 -0.786 . . . . 0.0 110.72 -179.012 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.869 HD11 ' CE2' ' A' ' 45' ' ' PHE . 2.2 mm? . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.072 -1.018 . . . . 0.0 110.192 -179.865 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.53 ' HA ' ' CB ' ' A' ' 23' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.192 0.52 . . . . 0.0 110.145 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.475 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 2.2 tt -79.56 148.6 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.266 -0.896 . . . . 0.0 110.341 179.975 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -160.98 -178.32 6.72 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.297 -0.877 . . . . 0.0 110.636 179.68 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -97.8 -178.71 4.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.465 -0.772 . . . . 0.0 110.27 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 49.0 m -98.13 -93.98 0.23 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.274 -0.891 . . . . 0.0 110.287 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.45 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 172.45 -167.2 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.097 -1.002 . . . . 0.0 110.122 -179.927 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.426 ' O ' ' N ' ' A' ' 10' ' ' MET . 6.6 t -80.1 169.63 17.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -0.904 . . . . 0.0 110.096 179.927 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 8' ' ' SER . 25.7 t70 43.13 26.25 0.08 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.146 -0.971 . . . . 0.0 110.214 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.426 ' N ' ' O ' ' A' ' 8' ' ' SER . 1.3 ttt -123.6 3.03 8.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.247 -0.908 . . . . 0.0 110.226 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.449 ' OD1' ' SG ' ' A' ' 14' ' ' CYS . 8.7 m-80 -101.97 70.42 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.896 . . . . 0.0 110.035 179.883 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.61 -24.29 14.08 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.871 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -86.7 -64.32 1.17 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.171 -1.194 . . . . 0.0 110.112 -179.989 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -81.34 119.45 23.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.287 -0.883 . . . . 0.0 110.382 -179.677 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.578 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 5.5 mt -90.62 -46.15 8.46 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.196 -0.94 . . . . 0.0 110.676 -179.882 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.598 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 12.3 m80 -111.72 78.63 1.14 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.168 -0.957 . . . . 0.0 110.353 -178.932 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.428 ' HA3' ' HA ' ' A' ' 32' ' ' CYS . . . 178.72 -160.9 26.99 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.963 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -127.56 138.7 52.96 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.401 -1.058 . . . . 0.0 110.221 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.864 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -81.5 134.88 35.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.246 -0.909 . . . . 0.0 110.199 179.969 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.864 HD13 ' O ' ' A' ' 19' ' ' CYS . 24.3 mm -142.59 172.81 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.262 -0.899 . . . . 0.0 110.262 -179.908 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.477 ' CD1' ' C ' ' A' ' 21' ' ' TYR . 8.8 t80 -137.03 138.25 40.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.242 -0.911 . . . . 0.0 109.58 179.866 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.594 HD23 ' HB2' ' A' ' 29' ' ' TYR . 3.3 mm? -100.51 136.42 40.42 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.973 -1.079 . . . . 0.0 111.28 -179.26 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.53 ' CB ' ' HA ' ' A' ' 2' ' ' SER . 10.7 p -90.72 -27.18 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.509 -0.744 . . . . 0.0 110.497 179.847 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.24 -17.21 56.99 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.122 -0.986 . . . . 0.0 108.886 179.426 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.532 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.9 mtm -143.38 64.86 1.33 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.726 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.465 ' C ' ' O ' ' A' ' 25' ' ' MET . 66.1 p -29.12 88.4 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.699 0.761 . . . . 0.0 111.733 -178.32 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.532 ' N ' ' O ' ' A' ' 25' ' ' MET . 4.4 pt20 -160.39 177.79 10.24 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.659 -0.651 . . . . 0.0 109.444 179.557 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -81.1 156.08 25.96 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.233 -0.917 . . . . 0.0 110.235 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.594 ' HB2' HD23 ' A' ' 22' ' ' LEU . 2.8 t80 -150.22 95.34 2.26 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.307 -0.871 . . . . 0.0 110.132 -179.959 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 4.0 m -102.36 106.9 17.75 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.195 -0.941 . . . . 0.0 110.105 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.3 tpp85 -79.52 97.93 6.64 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.177 -0.952 . . . . 0.0 109.504 179.602 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 77.9 m -79.73 175.91 10.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.445 -0.785 . . . . 0.0 110.525 -179.39 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 35' ' ' GLY . 10.6 tt0 -79.85 124.76 28.93 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.395 -0.815 . . . . 0.0 109.618 179.864 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.413 ' H ' HG23 ' A' ' 34' ' ' VAL . 14.1 t -65.16 -9.0 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.388 -0.82 . . . . 0.0 110.335 -179.423 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.719 ' O ' HD12 ' A' ' 46' ' ' LEU . . . -78.48 -3.22 86.13 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 179.863 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.598 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.9 OUTLIER -79.9 168.22 19.53 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.036 -1.273 . . . . 0.0 109.684 179.75 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.934 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -108.22 32.09 5.06 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.929 -1.107 . . . . 0.0 110.784 -179.595 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -147.93 171.38 28.45 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.269 -1.532 . . . . 0.0 109.269 179.437 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.407 ' O ' HG22 ' A' ' 39' ' ' VAL . 9.0 p -86.18 21.13 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.17 -1.194 . . . . 0.0 109.946 179.828 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.544 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 41.0 ttp180 -137.48 -95.62 0.21 Allowed 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.285 -0.885 . . . . 0.0 110.03 -179.674 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.9 p 163.62 73.04 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.78 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.544 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 2.0 tt0 -133.71 -28.93 1.37 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.418 -0.801 . . . . 0.0 110.673 -179.48 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.934 ' CE1' HG23 ' A' ' 37' ' ' THR . 3.5 p80 -128.34 113.46 15.64 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.907 -1.121 . . . . 0.0 109.922 179.236 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.62 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 37.2 t80 -79.41 106.43 11.44 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.463 0.649 . . . . 0.0 110.041 -179.253 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.86 -29.46 70.41 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.286 -0.884 . . . . 0.0 109.936 -179.679 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.719 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.4 mt . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.244 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.404 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.298 0.57 . . . . 0.0 110.114 . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.571 HD11 ' HB ' ' A' ' 20' ' ' ILE . 2.8 tt -144.74 156.1 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.211 -0.931 . . . . 0.0 110.308 -179.816 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.26 157.16 25.36 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.902 . . . . 0.0 110.244 179.919 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -96.19 165.46 12.21 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.231 -0.918 . . . . 0.0 110.219 -179.987 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.512 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 84.3 m -109.26 -152.86 0.5 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 110.342 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.94 -170.45 2.24 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.268 -0.895 . . . . 0.0 110.294 -179.916 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 m -85.24 11.55 9.8 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.904 . . . . 0.0 110.097 179.864 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.36 16.23 11.37 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.9 . . . . 0.0 110.114 -179.903 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.67 20.86 9.36 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.254 -0.904 . . . . 0.0 110.286 -179.87 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.09 72.47 1.09 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.171 -0.956 . . . . 0.0 110.236 -179.988 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -120.51 2.04 12.45 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.466 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 24.7 t80 -119.65 -57.4 1.98 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.184 -1.186 . . . . 0.0 110.246 179.964 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.4 p -90.33 121.65 32.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.237 -0.914 . . . . 0.0 110.366 -179.951 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.621 ' N ' HD23 ' A' ' 15' ' ' LEU . 3.9 mt -90.72 -56.98 2.98 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.152 -0.968 . . . . 0.0 110.714 -179.853 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.593 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 13.2 m80 -100.21 83.74 2.72 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.259 -0.901 . . . . 0.0 110.395 -178.885 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.516 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 176.53 -160.4 27.9 Favored Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.846 -1.301 . . . . 0.0 109.846 -179.8 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.404 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 2.2 mm100 -124.7 147.43 48.6 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.356 -1.085 . . . . 0.0 110.192 -179.968 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.512 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.7 t -93.73 130.12 39.81 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.382 -0.824 . . . . 0.0 110.318 -179.961 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.824 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -142.66 -176.95 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.42 -0.8 . . . . 0.0 109.978 179.867 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.471 ' O ' HG13 ' A' ' 3' ' ' ILE . 9.7 t80 -143.47 124.81 14.66 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.152 -0.968 . . . . 0.0 109.957 -179.92 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.529 HD22 ' HD2' ' A' ' 29' ' ' TYR . 1.9 mp -79.49 128.36 33.26 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.003 -1.061 . . . . 0.0 111.317 -179.269 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.404 HG11 ' HB3' ' A' ' 2' ' ' SER . 5.5 p -90.38 -26.16 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.688 -0.633 . . . . 0.0 110.417 179.788 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -78.17 -11.89 59.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.099 -1.001 . . . . 0.0 108.659 178.951 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 10.0 ttm -150.55 68.24 0.96 Allowed 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.929 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 13.7 p -29.19 89.86 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 121.745 0.783 . . . . 0.0 111.344 -178.471 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.1 147.65 18.14 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.738 -0.602 . . . . 0.0 109.725 -179.965 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.528 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.0 m-20 -64.87 124.49 22.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.442 -0.786 . . . . 0.0 110.133 -179.953 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.529 ' HD2' HD22 ' A' ' 22' ' ' LEU . 4.8 t80 -116.54 132.43 56.68 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.413 -0.805 . . . . 0.0 109.931 -179.866 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -129.64 112.63 13.87 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.092 -1.005 . . . . 0.0 110.374 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.516 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.7 OUTLIER -86.0 115.04 23.36 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.255 -0.903 . . . . 0.0 109.451 179.389 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.639 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 91.9 m -78.89 179.41 7.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.15 -0.969 . . . . 0.0 110.61 -179.408 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.463 ' OE2' ' CE1' ' A' ' 44' ' ' PHE . 22.3 tt0 -83.89 116.51 22.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.392 -0.818 . . . . 0.0 110.404 -179.543 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.1 t -52.43 101.67 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.192 -0.943 . . . . 0.0 109.555 179.523 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.905 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 147.9 -10.61 1.22 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.61 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.593 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.4 m-85 -78.78 160.21 27.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.897 -1.354 . . . . 0.0 109.465 179.769 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 1.109 HG23 ' CE1' ' A' ' 43' ' ' HIS . 1.0 OUTLIER -105.72 -4.62 20.74 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.841 -1.162 . . . . 0.0 111.125 -179.084 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.527 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -98.34 140.89 15.28 Favored Glycine 0 N--CA 1.488 2.11 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.778 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.425 ' C ' ' O ' ' A' ' 38' ' ' GLY . 8.5 p -44.85 -25.73 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.133 -1.216 . . . . 0.0 108.807 179.072 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.546 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 7.4 ttp180 -102.15 -130.67 0.25 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.218 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.639 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -151.72 75.64 1.16 Allowed 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 179.011 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.546 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 0.9 OUTLIER -123.82 -29.9 3.62 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.394 -0.816 . . . . 0.0 110.336 -179.264 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 1.109 ' CE1' HG23 ' A' ' 37' ' ' THR . 3.0 p80 -130.45 117.09 19.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.961 -1.087 . . . . 0.0 110.05 179.443 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 44.6 t80 -79.28 104.38 9.86 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 121.494 0.664 . . . . 0.0 110.002 -179.351 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.585 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.67 -32.87 74.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.466 -0.771 . . . . 0.0 110.172 -179.515 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.905 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.9 mt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.248 179.963 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.47 ' N ' HG11 ' A' ' 23' ' ' VAL . 16.5 t . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 121.32 0.581 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.797 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.81 149.58 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.328 -0.858 . . . . 0.0 110.124 179.964 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -119.0 161.3 20.45 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 110.241 -179.949 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -110.38 165.9 11.41 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.333 -0.854 . . . . 0.0 110.206 179.957 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 72.5 m -112.96 -155.59 0.57 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.229 -0.919 . . . . 0.0 110.206 -179.991 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 m -135.61 -164.13 1.49 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.256 -0.903 . . . . 0.0 110.318 179.961 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.53 10.3 13.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 0.0 110.216 -179.983 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -123.13 19.23 9.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 0.0 110.181 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.79 23.06 2.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.893 . . . . 0.0 110.175 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -106.25 68.3 0.76 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.221 -0.924 . . . . 0.0 110.206 -179.978 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -109.22 43.65 1.67 Allowed Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 179.948 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -156.93 -58.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.297 -1.119 . . . . 0.0 110.204 -179.914 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.6 p -91.15 118.87 30.79 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.265 -0.897 . . . . 0.0 110.295 -179.912 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.59 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.8 mt -90.43 -43.13 10.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.117 -0.99 . . . . 0.0 110.325 179.8 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.9 m80 -111.65 78.02 1.09 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.251 -0.905 . . . . 0.0 110.163 -179.486 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 176.07 -171.02 44.06 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -114.44 146.41 40.67 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.2 -1.176 . . . . 0.0 110.326 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.4 t -84.47 147.47 27.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.322 -0.861 . . . . 0.0 110.037 179.805 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.809 HD12 ' CD1' ' A' ' 29' ' ' TYR . 0.7 OUTLIER -155.35 -177.59 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.147 -0.971 . . . . 0.0 110.107 -179.805 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.502 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 14.8 t80 -142.36 132.66 24.88 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.282 -0.886 . . . . 0.0 109.98 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.633 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.5 mm? -94.47 134.5 36.94 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.126 -0.984 . . . . 0.0 111.016 -179.339 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.47 HG11 ' N ' ' A' ' 2' ' ' SER . 10.7 p -90.92 -24.94 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.297 -0.877 . . . . 0.0 110.524 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.547 ' OD2' HD12 ' A' ' 22' ' ' LEU . 3.3 p30 -78.56 -15.68 58.29 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.044 -1.035 . . . . 0.0 108.956 179.314 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.544 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.5 ttp -146.01 66.48 1.2 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 178.899 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.91 88.56 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 122.001 0.905 . . . . 0.0 111.877 -178.223 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 tt0 -160.86 173.79 14.82 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 121.318 0.58 . . . . 0.0 109.935 179.401 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -77.19 140.99 40.3 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.462 -0.774 . . . . 0.0 110.23 -179.962 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.809 ' CD1' HD12 ' A' ' 20' ' ' ILE . 9.8 t80 -135.64 113.94 11.51 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.356 -0.84 . . . . 0.0 110.031 179.894 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 15.4 m -117.85 116.97 28.03 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.045 -1.034 . . . . 0.0 110.41 -179.809 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.432 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.2 tpp85 -79.49 118.34 21.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.155 -0.966 . . . . 0.0 109.447 179.431 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.513 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 95.7 m -79.52 170.76 16.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.392 -0.818 . . . . 0.0 110.573 -179.329 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -79.48 117.14 20.16 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.358 -0.839 . . . . 0.0 109.968 179.974 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.415 HG23 ' H ' ' A' ' 34' ' ' VAL . 36.4 t -50.13 103.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.296 -0.877 . . . . 0.0 109.686 179.966 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.74 -12.75 1.32 Allowed Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.67 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.32 172.14 14.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.203 -1.175 . . . . 0.0 109.648 179.85 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.935 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.72 29.78 6.91 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.906 -1.121 . . . . 0.0 110.524 179.974 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.55 160.08 31.5 Favored Glycine 0 N--CA 1.489 2.186 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.547 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.617 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.7 p -88.88 27.09 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.177 -1.19 . . . . 0.0 109.536 179.321 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.559 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -132.95 14.31 4.29 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.48 -0.762 . . . . 0.0 109.738 -179.667 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.513 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 4.9 p 32.62 87.63 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 121.467 0.651 . . . . 0.0 110.601 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.559 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 1.1 tp10 -156.09 -34.81 0.09 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.405 -0.809 . . . . 0.0 110.644 -179.61 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.935 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.4 p80 -120.46 119.21 32.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.882 -1.136 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.632 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 17.3 t80 -84.21 111.74 19.64 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-O 121.247 0.546 . . . . 0.0 109.859 -179.728 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.574 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -68.43 -23.71 64.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.285 -0.884 . . . . 0.0 109.655 -179.78 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.632 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.8 mt . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.269 -179.819 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.759 ' HB2' HG11 ' A' ' 23' ' ' VAL . 2.6 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.353 0.597 . . . . 0.0 110.403 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 1.084 HD11 HD12 ' A' ' 20' ' ' ILE . 1.7 tt -129.51 157.37 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.294 -0.879 . . . . 0.0 109.991 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -121.57 168.06 12.17 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.212 -0.93 . . . . 0.0 110.262 -179.913 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.29 159.51 14.9 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.206 -0.934 . . . . 0.0 110.234 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 65.1 m -104.59 -147.99 0.4 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.242 -0.911 . . . . 0.0 110.147 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -127.48 -171.4 2.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.247 -0.908 . . . . 0.0 110.212 -179.934 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.8 t -79.81 -55.42 5.0 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.253 -0.904 . . . . 0.0 110.167 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -63.07 -11.3 18.67 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.242 -0.911 . . . . 0.0 110.149 179.906 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.7 ttm -88.14 27.37 1.22 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.253 -0.905 . . . . 0.0 110.225 -179.986 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -121.85 69.89 0.94 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.219 -0.926 . . . . 0.0 110.232 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -119.7 3.29 13.44 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -108.77 -50.53 3.0 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.159 -1.201 . . . . 0.0 110.182 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 22.3 p -104.07 120.09 40.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.216 -0.928 . . . . 0.0 110.271 179.932 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.589 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 10.1 mt -90.17 -43.22 10.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.298 -0.876 . . . . 0.0 110.519 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.6 m80 -110.53 86.88 2.4 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.134 -0.979 . . . . 0.0 110.258 -179.503 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.464 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.68 -131.39 2.11 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.968 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 2.9 pt20 -160.35 149.71 17.47 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.233 -1.157 . . . . 0.0 110.236 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.607 ' O ' HG23 ' A' ' 20' ' ' ILE . 1.2 t -94.54 147.54 23.17 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.195 -0.941 . . . . 0.0 110.194 179.948 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.102 HD11 ' CD1' ' A' ' 29' ' ' TYR . 19.0 pt -157.7 167.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.302 -0.874 . . . . 0.0 110.063 179.96 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.508 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 12.4 t80 -120.36 118.84 31.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.205 -0.934 . . . . 0.0 110.065 -179.983 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.786 HD11 ' CD2' ' A' ' 29' ' ' TYR . 11.3 mt -83.45 135.89 34.51 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.242 -0.912 . . . . 0.0 110.766 -179.751 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.759 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.2 p -88.32 -29.0 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.398 -0.814 . . . . 0.0 110.078 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -78.41 -22.8 47.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.208 -0.933 . . . . 0.0 108.716 179.191 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.1 mmt -134.23 61.14 1.68 Allowed 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 178.526 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.466 ' C ' ' O ' ' A' ' 25' ' ' MET . 3.2 p -28.74 86.2 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 121.576 0.703 . . . . 0.0 111.883 -178.46 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 pt20 -161.21 167.56 25.83 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.576 -0.702 . . . . 0.0 109.556 179.526 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.455 ' OD1' ' O ' ' A' ' 28' ' ' ASN . 7.0 p30 -82.51 90.58 6.77 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.327 -0.858 . . . . 0.0 109.787 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 1.102 ' CD1' HD11 ' A' ' 20' ' ' ILE . 5.4 t80 -79.7 131.92 36.07 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.405 -0.809 . . . . 0.0 110.283 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -120.58 113.21 19.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.169 -0.957 . . . . 0.0 110.368 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.536 ' NE ' ' HA ' ' A' ' 31' ' ' ARG . 3.0 tpm_? -81.73 116.95 21.67 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.193 -0.942 . . . . 0.0 109.461 179.452 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.506 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 66.9 m -79.06 173.63 12.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.279 -0.888 . . . . 0.0 110.136 -179.793 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -79.42 111.65 15.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.284 -0.885 . . . . 0.0 109.909 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.3 t -49.15 103.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.446 -0.784 . . . . 0.0 109.727 -179.959 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 141.71 -7.28 2.46 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -179.741 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.558 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.25 179.97 7.09 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.175 -1.191 . . . . 0.0 109.796 179.853 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -116.5 23.91 11.71 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.915 -1.116 . . . . 0.0 110.731 -179.629 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -149.65 157.78 27.38 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.545 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.528 ' O ' HG13 ' A' ' 39' ' ' VAL . 8.6 p -85.78 40.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.248 -1.149 . . . . 0.0 109.797 179.557 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.56 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.03 21.07 0.16 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.452 -0.78 . . . . 0.0 109.973 -179.522 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.506 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 8.8 p 32.32 84.85 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.665 -0.647 . . . . 0.0 110.745 -179.702 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.56 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 23.8 tt0 -146.01 -41.53 0.21 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.405 -0.809 . . . . 0.0 109.967 -179.878 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.8 p-80 -119.43 128.69 54.26 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.11 -0.994 . . . . 0.0 110.372 179.598 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.617 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 34.4 t80 -86.68 130.32 34.53 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 121.383 0.611 . . . . 0.0 110.434 -178.504 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.557 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -91.64 -37.29 13.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 109.849 -179.878 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.617 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.3 mt . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.201 -179.663 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.415 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.273 0.559 . . . . 0.0 110.336 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.68 HD11 ' HB ' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -128.19 150.25 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.259 -0.901 . . . . 0.0 110.086 179.841 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -118.77 -163.61 0.97 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.206 -0.934 . . . . 0.0 110.173 179.93 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -130.74 154.4 48.0 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.13 -0.981 . . . . 0.0 110.352 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.566 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 94.6 m -83.81 -165.35 1.1 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.408 -0.807 . . . . 0.0 110.239 179.926 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.48 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.4 OUTLIER -125.69 -158.41 0.84 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.301 -0.874 . . . . 0.0 110.114 179.812 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.48 ' N ' ' OG ' ' A' ' 7' ' ' SER . 2.8 m -79.93 168.97 18.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.154 -0.967 . . . . 0.0 110.126 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 50.48 20.94 0.76 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.206 -0.934 . . . . 0.0 110.235 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tpp -122.85 -15.52 7.38 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.201 -0.937 . . . . 0.0 110.181 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -89.16 52.48 2.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.315 -0.866 . . . . 0.0 110.354 -179.941 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -109.63 1.94 30.63 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.447 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 45.9 t80 -93.4 -57.3 2.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.203 -1.175 . . . . 0.0 110.128 179.999 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.3 p -97.54 119.74 36.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.271 -0.893 . . . . 0.0 110.111 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.3 mt -90.24 -45.18 9.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.221 -0.924 . . . . 0.0 110.303 -179.999 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.569 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.5 m80 -108.59 85.71 2.16 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.297 -0.877 . . . . 0.0 110.224 -179.591 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.489 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 169.82 -174.75 44.05 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.03 145.76 30.97 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.268 -1.136 . . . . 0.0 110.311 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.566 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 5.6 t -96.08 130.07 43.19 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.365 -0.834 . . . . 0.0 110.385 -179.932 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.804 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.7 177.53 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.372 -0.83 . . . . 0.0 110.102 179.994 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.501 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 13.8 t80 -128.0 135.14 49.49 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.289 -0.882 . . . . 0.0 109.703 179.707 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.675 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.2 mm? -92.86 132.86 36.64 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.979 -1.076 . . . . 0.0 111.149 -179.309 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.415 HG11 ' CB ' ' A' ' 2' ' ' SER . 9.1 p -90.87 -31.7 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.461 -0.775 . . . . 0.0 110.586 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -78.06 -19.67 53.82 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.124 -0.985 . . . . 0.0 108.78 179.403 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 27' ' ' GLN . 35.8 mtt -137.19 61.56 1.62 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.608 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 89.5 p -29.21 87.79 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 121.614 0.721 . . . . 0.0 111.584 -178.499 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.557 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.4 pt20 -160.73 171.46 18.81 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.66 -0.65 . . . . 0.0 109.648 179.689 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -79.72 115.86 19.56 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.447 -0.783 . . . . 0.0 110.292 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.675 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.7 t80 -105.67 141.47 37.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.349 -0.844 . . . . 0.0 109.717 179.804 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 14.3 m -141.58 112.05 7.02 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.017 -1.052 . . . . 0.0 110.694 -179.562 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.489 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.5 OUTLIER -81.04 112.84 18.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.207 -0.933 . . . . 0.0 109.427 179.291 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.529 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 95.8 m -79.36 172.4 13.85 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.307 -0.871 . . . . 0.0 110.519 -179.507 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -79.39 114.03 18.0 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.441 -0.787 . . . . 0.0 109.965 -179.849 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.422 HG23 ' H ' ' A' ' 34' ' ' VAL . 41.1 t -46.08 102.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.27 -0.894 . . . . 0.0 109.709 179.961 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.36 -13.1 1.4 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -179.666 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.568 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -79.28 176.03 10.05 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.162 -1.199 . . . . 0.0 109.852 179.892 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.604 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -117.29 26.33 9.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.906 -1.121 . . . . 0.0 110.784 -179.78 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -147.66 160.5 28.32 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.819 -1.313 . . . . 0.0 109.819 179.607 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.717 HG12 ' O ' ' A' ' 39' ' ' VAL . 69.9 t -86.8 19.14 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.325 -1.103 . . . . 0.0 109.818 179.59 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.549 ' NH2' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -140.23 21.72 2.41 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.522 -0.736 . . . . 0.0 109.672 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.529 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 5.9 p 32.31 93.04 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 CA-C-O 121.493 0.663 . . . . 0.0 111.118 179.711 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.549 ' HB3' ' NH2' ' A' ' 40' ' ' ARG . 30.1 tt0 -156.61 -38.04 0.08 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.358 -0.839 . . . . 0.0 110.232 179.714 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.604 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.2 p-80 -117.36 129.59 55.96 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.029 -1.044 . . . . 0.0 110.611 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.624 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.5 t80 -88.13 130.28 35.08 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.433 0.635 . . . . 0.0 110.376 -178.737 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -94.39 -33.45 13.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.454 -0.779 . . . . 0.0 110.277 -179.65 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.624 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.2 mt . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.291 -179.745 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.286 0.565 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.698 HG12 HG22 ' A' ' 20' ' ' ILE . 9.5 tt -83.37 166.48 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.315 -0.866 . . . . 0.0 110.185 -179.987 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 4.2 m -137.98 165.47 26.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.197 -0.939 . . . . 0.0 110.547 -179.631 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -91.83 154.39 18.93 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.241 -0.912 . . . . 0.0 110.223 179.892 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.72 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 60.7 m -91.71 -141.15 0.18 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.32 -0.863 . . . . 0.0 110.259 -179.984 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.519 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.5 OUTLIER -159.47 -155.2 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.286 -0.884 . . . . 0.0 109.962 -179.931 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.519 ' N ' ' OG ' ' A' ' 7' ' ' SER . 0.1 OUTLIER -79.67 166.47 21.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.063 -1.023 . . . . 0.0 109.871 179.936 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 50.84 20.86 0.83 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.083 -1.01 . . . . 0.0 110.19 -179.822 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.99 14.23 5.76 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.175 -0.953 . . . . 0.0 110.202 -179.866 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.4 ' OD1' ' N ' ' A' ' 11' ' ' ASN . 10.3 m-20 -118.35 -141.11 0.36 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.236 -0.915 . . . . 0.0 110.389 -179.878 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.14 49.57 3.03 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.286 -1.526 . . . . 0.0 109.286 -179.817 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.682 ' OH ' HG23 ' A' ' 39' ' ' VAL . 8.6 t80 -155.0 -70.27 0.12 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.314 -1.109 . . . . 0.0 109.938 -179.819 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.486 ' C ' HD23 ' A' ' 15' ' ' LEU . 25.3 p -87.87 125.99 34.78 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.072 -1.017 . . . . 0.0 110.33 179.74 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.62 ' N ' HD23 ' A' ' 15' ' ' LEU . 3.9 mt -90.19 -49.04 6.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.19 -0.943 . . . . 0.0 110.142 179.765 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.54 ' ND1' ' HB2' ' A' ' 15' ' ' LEU . 10.4 m80 -104.83 77.21 1.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.219 -0.926 . . . . 0.0 110.112 -179.838 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.504 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -176.98 -178.97 47.14 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.868 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.53 140.46 41.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.255 -1.144 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.72 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 8.4 t -79.76 147.66 31.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.197 -0.939 . . . . 0.0 109.828 179.854 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.698 HG22 HG12 ' A' ' 3' ' ' ILE . 0.3 OUTLIER -154.22 -170.0 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.152 -0.968 . . . . 0.0 110.001 -179.693 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.5 ' O ' HG13 ' A' ' 3' ' ' ILE . 8.6 t80 -147.88 128.39 14.07 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.077 -1.014 . . . . 0.0 109.857 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.651 HD23 ' CD2' ' A' ' 29' ' ' TYR . 0.8 OUTLIER -84.19 131.78 34.73 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.196 -0.94 . . . . 0.0 111.103 -179.31 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.6 p -90.54 -28.31 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.343 -0.848 . . . . 0.0 110.587 179.732 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.52 ' OD2' ' CD1' ' A' ' 22' ' ' LEU . 1.9 p30 -78.43 -15.25 58.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.019 -1.05 . . . . 0.0 108.789 179.229 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -144.45 65.55 1.28 Allowed 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 178.733 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.487 ' C ' ' O ' ' A' ' 25' ' ' MET . 40.3 p -29.15 89.38 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.702 0.763 . . . . 0.0 111.542 -178.355 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 pt20 -157.81 168.89 25.9 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.737 -0.602 . . . . 0.0 109.419 179.51 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -77.22 124.96 28.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.283 -0.886 . . . . 0.0 110.594 -179.615 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.651 ' CD2' HD23 ' A' ' 22' ' ' LEU . 35.5 t80 -110.83 158.39 18.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.402 -0.811 . . . . 0.0 109.77 179.73 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.407 ' SG ' ' O ' ' A' ' 29' ' ' TYR . 1.9 m -158.1 108.38 2.13 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.058 -1.026 . . . . 0.0 110.503 -179.95 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.504 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.8 tpp180 -81.29 115.04 20.48 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.88 . . . . 0.0 109.666 179.681 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 97.5 m -79.4 175.06 10.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.167 -0.958 . . . . 0.0 110.521 -179.56 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -79.46 117.94 20.88 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.367 -0.833 . . . . 0.0 110.383 -179.792 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -49.94 99.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.283 -0.886 . . . . 0.0 109.914 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 152.35 -16.84 0.77 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.847 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.472 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.0 OUTLIER -79.55 172.92 13.14 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.147 -1.207 . . . . 0.0 110.023 179.947 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.598 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -113.29 31.47 6.44 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.017 -1.052 . . . . 0.0 110.518 -179.636 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.32 162.9 33.62 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.448 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.682 HG23 ' OH ' ' A' ' 13' ' ' TYR . 2.4 m -84.34 14.73 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.345 -1.091 . . . . 0.0 109.733 179.546 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.584 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -128.26 18.18 6.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.386 -0.821 . . . . 0.0 109.852 -179.444 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.6 p 27.33 91.06 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 CA-C-O 121.402 0.62 . . . . 0.0 111.369 179.493 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.584 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 10.8 tm-20 -156.6 -37.79 0.08 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.398 -0.814 . . . . 0.0 110.284 179.752 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.598 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 3.1 p-80 -114.86 128.44 56.29 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.008 -1.058 . . . . 0.0 110.523 179.887 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.654 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 15.7 t80 -86.63 126.33 34.44 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.459 0.647 . . . . 0.0 109.842 -179.009 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.584 ' O ' ' CG ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -85.27 12.47 8.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.447 -0.783 . . . . 0.0 109.955 -179.329 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.654 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.5 mt . . . . . 0 C--N 1.302 -1.479 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.395 -179.748 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 1.032 ' HB2' HG11 ' A' ' 23' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.301 0.572 . . . . 0.0 109.959 . . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.588 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -153.68 164.94 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.238 -0.914 . . . . 0.0 110.267 -179.802 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 3.7 m -148.52 167.16 26.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 0.0 110.219 179.984 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.457 ' HD2' HD13 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -110.41 168.99 9.04 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 110.027 179.908 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 57.0 m -86.49 -166.3 1.51 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.177 -0.952 . . . . 0.0 110.169 -179.937 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.84 -64.85 0.69 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.313 -0.867 . . . . 0.0 110.314 -179.963 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.44 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 0.5 OUTLIER -153.69 -71.17 0.14 Allowed 'General case' 0 C--N 1.291 -1.946 0 O-C-N 121.78 -0.575 . . . . 0.0 110.377 -179.961 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -62.72 -11.18 15.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.205 -0.934 . . . . 0.0 110.218 -179.972 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.438 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -104.27 39.5 1.64 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.258 -0.901 . . . . 0.0 110.159 179.898 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.44 ' OD1' ' O ' ' A' ' 8' ' ' SER . 41.4 p-10 -137.74 21.44 2.88 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.284 -0.885 . . . . 0.0 110.337 -179.885 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -100.18 75.14 0.44 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.971 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -160.28 -58.43 0.06 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.264 -1.139 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -97.25 118.2 33.15 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.342 -0.849 . . . . 0.0 110.605 -179.718 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.608 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.7 mt -75.77 -40.69 54.84 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 109.887 179.706 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.608 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.4 m80 -119.85 89.36 3.11 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.414 -0.804 . . . . 0.0 110.584 -179.096 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.469 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 171.08 -177.81 43.83 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 179.791 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -108.06 153.46 23.09 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.294 -1.121 . . . . 0.0 110.306 179.86 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.909 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -92.05 133.66 35.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.377 -0.827 . . . . 0.0 110.539 -179.809 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.909 HD13 ' O ' ' A' ' 19' ' ' CYS . 9.4 mm -142.71 178.67 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.35 -0.844 . . . . 0.0 109.883 179.968 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.556 ' H ' HG22 ' A' ' 20' ' ' ILE . 20.6 t80 -147.68 129.45 15.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.986 -1.071 . . . . 0.0 110.252 179.952 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.613 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 2.9 mm? -88.65 131.78 34.84 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.267 -0.896 . . . . 0.0 110.749 -179.662 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 1.032 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.4 p -90.57 -23.19 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.341 -0.849 . . . . 0.0 110.612 179.88 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -78.59 -12.43 60.02 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.003 -1.061 . . . . 0.0 108.806 179.28 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -151.01 68.9 0.95 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.957 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.489 ' C ' ' O ' ' A' ' 25' ' ' MET . 40.1 p -29.02 89.52 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.791 0.805 . . . . 0.0 111.308 -178.419 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.55 148.09 17.69 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.726 -0.609 . . . . 0.0 109.367 -179.883 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.53 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.2 m-80 -60.68 146.21 46.46 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.197 -0.94 . . . . 0.0 110.399 -179.635 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.613 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 3.5 t80 -142.73 102.85 4.12 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.441 -0.787 . . . . 0.0 109.991 179.984 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.9 m -108.62 119.03 38.33 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.108 -0.995 . . . . 0.0 110.278 -179.951 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.469 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -78.98 137.33 37.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.107 -0.996 . . . . 0.0 109.216 179.476 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.8 m -79.54 169.3 18.23 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.281 -0.887 . . . . 0.0 110.025 -179.528 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.529 ' O ' ' N ' ' A' ' 35' ' ' GLY . 9.6 tt0 -78.59 112.26 15.49 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.309 -0.869 . . . . 0.0 108.709 179.21 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.465 ' C ' ' O ' ' A' ' 33' ' ' GLU . 38.3 t -36.12 93.17 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 121.479 0.657 . . . . 0.0 110.475 -179.071 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.999 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 149.72 -15.77 1.07 Allowed Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.649 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.4 m-85 -81.12 169.24 17.66 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.137 -1.213 . . . . 0.0 109.922 179.939 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 1.104 HG23 ' CE1' ' A' ' 43' ' ' HIS . 5.2 t -122.55 45.55 2.35 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.968 -1.082 . . . . 0.0 111.171 -179.77 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.53 156.08 27.32 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.963 -1.255 . . . . 0.0 109.963 179.568 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.7 HG12 ' O ' ' A' ' 39' ' ' VAL . 79.2 t -89.07 21.27 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.327 -1.102 . . . . 0.0 109.487 179.288 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.578 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 6.5 ttp180 -122.78 -19.23 6.28 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.568 -0.708 . . . . 0.0 109.978 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.7 m 69.51 70.26 0.25 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.172 -0.955 . . . . 0.0 110.234 179.281 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.578 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -141.03 -29.25 0.66 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.19 -0.944 . . . . 0.0 111.255 -179.838 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 1.104 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.0 p80 -125.63 120.46 30.84 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.623 -1.298 . . . . 0.0 111.214 179.963 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.612 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 51.6 t80 -82.57 103.14 11.88 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.295 0.569 . . . . 0.0 109.678 179.773 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.578 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.59 -30.34 71.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.239 -0.913 . . . . 0.0 110.237 -179.29 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.999 HD12 ' O ' ' A' ' 35' ' ' GLY . 3.2 mt . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.13 -0.981 . . . . 0.0 110.147 -179.986 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.533 ' HB3' HG11 ' A' ' 23' ' ' VAL . 6.3 t . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.328 0.585 . . . . 0.0 110.205 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.799 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -80.63 141.18 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.29 -0.881 . . . . 0.0 110.216 -179.933 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.424 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -101.33 158.53 15.98 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.306 -179.97 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -108.17 151.49 25.85 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.302 -0.874 . . . . 0.0 110.019 179.864 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.4 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 61.3 m -97.81 -159.86 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.269 -0.895 . . . . 0.0 110.365 -179.94 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.7 t -145.12 -146.47 0.19 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.204 -0.935 . . . . 0.0 110.198 179.996 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.435 ' O ' ' N ' ' A' ' 10' ' ' MET . 23.7 t -79.87 168.02 19.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.224 -0.922 . . . . 0.0 110.134 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' A' ' 8' ' ' SER . 20.0 t0 42.08 26.93 0.06 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.262 -0.899 . . . . 0.0 110.288 179.954 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.435 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -125.78 -0.86 7.33 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.261 -0.9 . . . . 0.0 110.321 -179.892 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.422 ' O ' ' CG ' ' A' ' 11' ' ' ASN . 24.4 p-10 -140.03 105.53 5.09 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.169 -0.957 . . . . 0.0 110.194 -179.976 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.45 20.79 6.9 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.902 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.455 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 71.0 t80 -110.62 -55.57 2.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.189 -1.183 . . . . 0.0 110.273 -179.899 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.2 p -93.52 123.27 36.72 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.274 -0.891 . . . . 0.0 110.268 -179.818 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.563 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -90.18 -43.65 10.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.111 -0.993 . . . . 0.0 110.416 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.563 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 9.2 m80 -107.87 85.89 2.2 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.265 -0.897 . . . . 0.0 110.233 -179.513 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.93 -165.1 36.1 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.983 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -121.28 134.79 55.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.38 -1.07 . . . . 0.0 110.31 -179.955 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.576 ' O ' HG23 ' A' ' 20' ' ' ILE . 10.7 t -84.47 141.76 30.55 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 110.125 179.903 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.887 HD11 ' CD1' ' A' ' 29' ' ' TYR . 9.5 pt -157.7 -167.38 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.183 -0.948 . . . . 0.0 110.059 -179.778 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.499 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 12.1 t80 -144.18 133.54 23.23 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.269 -0.895 . . . . 0.0 110.086 179.984 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.68 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.6 mm? -87.66 132.62 34.03 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.138 -0.976 . . . . 0.0 110.671 -179.642 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.533 HG11 ' HB3' ' A' ' 2' ' ' SER . 4.8 p -90.71 -22.31 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.256 -0.903 . . . . 0.0 110.674 179.797 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.555 ' OD2' HD12 ' A' ' 22' ' ' LEU . 12.5 p30 -78.46 -9.63 59.38 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.014 -1.054 . . . . 0.0 108.913 179.26 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -157.35 70.85 0.62 Allowed 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.146 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.499 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 12.5 p -29.32 89.43 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 121.768 0.794 . . . . 0.0 111.307 -178.587 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.18 149.61 17.7 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.704 -0.623 . . . . 0.0 109.478 -179.7 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.519 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 3.3 t-20 -61.09 135.13 57.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.215 -0.928 . . . . 0.0 110.227 -179.857 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.887 ' CD1' HD11 ' A' ' 20' ' ' ILE . 7.2 t80 -129.07 126.24 38.99 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.445 -0.785 . . . . 0.0 109.74 -179.936 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 8.2 m -123.47 112.78 17.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.98 . . . . 0.0 110.718 -179.554 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.481 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 8.9 tpp85 -79.51 111.35 15.7 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.272 -0.893 . . . . 0.0 109.686 179.568 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.467 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 68.5 m -79.32 167.74 20.49 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.222 -0.924 . . . . 0.0 110.027 -179.871 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -79.82 106.36 11.78 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.295 -0.878 . . . . 0.0 110.225 -179.727 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.435 ' H ' HG22 ' A' ' 34' ' ' VAL . 5.6 m -47.25 107.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 O-C-N 121.399 -0.813 . . . . 0.0 109.674 179.583 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.13 -10.77 2.04 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.305 -1.518 . . . . 0.0 109.305 -179.369 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.562 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -78.66 178.97 7.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.197 -1.178 . . . . 0.0 109.692 179.862 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.645 HG21 ' NE2' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -106.7 -43.92 4.58 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 118.538 -1.265 . . . . 0.0 110.584 -179.989 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.73 158.03 42.5 Favored Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.635 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.638 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.8 p -84.99 44.88 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.12 -1.224 . . . . 0.0 109.696 179.756 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.26 27.21 0.17 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.407 -0.808 . . . . 0.0 109.746 -179.438 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.49 ' C ' ' O ' ' A' ' 40' ' ' ARG . 15.2 p 31.33 93.47 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.63 -0.669 . . . . 0.0 111.026 179.778 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 9.9 tm-20 -159.24 -41.77 0.06 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.481 -0.762 . . . . 0.0 110.035 179.938 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.645 ' NE2' HG21 ' A' ' 37' ' ' THR . 0.6 OUTLIER -120.14 129.47 54.17 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.06 -1.025 . . . . 0.0 110.669 179.83 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.591 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 35.6 t80 -88.76 125.15 34.75 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.404 -178.758 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.56 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.2 OUTLIER -98.05 -11.83 22.53 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.362 -0.836 . . . . 0.0 110.45 -179.534 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.591 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 6.3 mt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.052 -1.03 . . . . 0.0 110.241 -179.711 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.52 ' HA ' ' HB ' ' A' ' 23' ' ' VAL . 3.1 m . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.238 0.542 . . . . 0.0 109.898 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.479 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 2.7 tt -79.6 148.67 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.233 -0.917 . . . . 0.0 109.803 179.595 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.672 HG23 ' N ' ' A' ' 5' ' ' LYS . 4.9 t -160.25 -150.12 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.144 -0.972 . . . . 0.0 110.759 -179.928 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.672 ' N ' HG23 ' A' ' 4' ' ' THR . 35.6 mtpt -117.28 174.96 5.83 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.417 -0.802 . . . . 0.0 110.28 -179.806 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.558 ' O ' ' CB ' ' A' ' 7' ' ' SER . 14.3 m -113.37 -11.16 13.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.276 -0.89 . . . . 0.0 110.257 -179.802 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.558 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 1.1 m 79.69 -175.26 0.07 Allowed 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.662 -0.649 . . . . 0.0 110.654 179.99 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.472 ' O ' ' ND2' ' A' ' 11' ' ' ASN . 0.2 OUTLIER -78.97 -39.2 34.99 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.299 -0.876 . . . . 0.0 111.363 -179.108 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -84.36 46.13 1.19 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.941 -1.099 . . . . 0.0 109.68 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.53 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -155.17 24.2 0.42 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.429 -0.794 . . . . 0.0 109.815 -179.226 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.472 ' ND2' ' O ' ' A' ' 8' ' ' SER . 15.5 p30 -118.78 -158.24 0.72 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.108 -0.995 . . . . 0.0 109.922 -179.905 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.38 44.6 0.43 Allowed Glycine 0 N--CA 1.488 2.155 0 N-CA-C 109.267 -1.533 . . . . 0.0 109.267 -179.903 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.417 ' HD2' ' HG ' ' A' ' 14' ' ' CYS . 25.5 t80 -159.7 -44.38 0.05 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.392 -1.064 . . . . 0.0 110.002 -179.676 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -106.37 131.45 53.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.569 -0.707 . . . . 0.0 109.934 -179.588 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.666 HD11 ' OE2' ' A' ' 42' ' ' GLU . 13.1 mt -90.78 -42.58 10.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.346 -0.846 . . . . 0.0 110.438 179.667 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.608 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.8 m80 -113.52 79.24 1.22 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.2 -0.938 . . . . 0.0 110.235 -179.567 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 178.53 -166.83 36.94 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.951 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -131.33 149.18 52.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.282 -1.129 . . . . 0.0 110.239 -179.995 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.563 ' C ' HG23 ' A' ' 20' ' ' ILE . 4.7 t -95.87 146.08 24.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.23 -0.919 . . . . 0.0 110.073 179.993 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.097 HD11 ' CD1' ' A' ' 29' ' ' TYR . 15.1 pt -156.11 -173.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.253 -0.904 . . . . 0.0 110.234 -179.795 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 12.7 t80 -131.67 145.79 51.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.306 -0.871 . . . . 0.0 109.859 179.782 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.744 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.4 mm? -103.64 137.75 41.26 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.054 -1.029 . . . . 0.0 111.366 -179.33 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.52 ' HB ' ' HA ' ' A' ' 2' ' ' SER . 9.3 p -91.16 -27.66 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 110.855 179.865 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.429 ' O ' ' HG3' ' A' ' 25' ' ' MET . 10.7 m-20 -77.79 -17.68 57.23 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.071 -1.018 . . . . 0.0 108.831 179.666 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 27' ' ' GLN . 7.0 mtt -144.48 64.38 1.3 Allowed 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 178.698 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 25' ' ' MET . 58.9 p -29.31 86.24 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.711 0.767 . . . . 0.0 111.814 -178.461 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.6 pt20 -161.29 -175.8 5.04 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.605 -0.684 . . . . 0.0 109.467 179.677 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -81.86 145.35 30.42 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.263 -0.898 . . . . 0.0 109.97 179.645 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 1.097 ' CD1' HD11 ' A' ' 20' ' ' ILE . 12.3 t80 -141.02 108.67 5.62 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.357 -0.839 . . . . 0.0 109.82 -179.682 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 25.4 m -103.33 112.88 25.96 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.254 -0.904 . . . . 0.0 110.797 -179.499 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -90.33 95.46 10.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.157 -0.964 . . . . 0.0 109.736 179.492 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.507 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 92.8 m -79.71 178.91 7.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.224 -0.922 . . . . 0.0 110.057 -179.91 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.51 131.32 36.01 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.237 -0.914 . . . . 0.0 109.803 179.864 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.4 t -66.64 -18.33 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.333 -0.854 . . . . 0.0 110.353 -179.494 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.13 -7.13 49.76 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 179.93 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -90.43 168.32 11.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.219 -1.165 . . . . 0.0 110.233 -179.913 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.924 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -110.86 34.03 4.24 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.119 -0.988 . . . . 0.0 110.497 179.797 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.43 156.93 28.29 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.643 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.775 HG12 ' O ' ' A' ' 39' ' ' VAL . 77.0 t -85.07 44.96 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.288 -1.125 . . . . 0.0 109.568 179.54 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.58 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.83 20.92 0.17 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.347 -0.845 . . . . 0.0 109.97 -179.375 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.521 ' C ' ' O ' ' A' ' 40' ' ' ARG . 3.3 p 26.71 90.94 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 121.485 0.66 . . . . 0.0 111.574 179.631 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.666 ' OE2' HD11 ' A' ' 15' ' ' LEU . 1.6 tt0 -155.57 -34.62 0.09 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.835 . . . . 0.0 110.597 179.749 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.924 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.3 p80 -121.89 119.9 32.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.977 -1.077 . . . . 0.0 110.683 179.725 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.577 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 35.4 t80 -83.02 119.34 24.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.718 -0.614 . . . . 0.0 109.743 179.938 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.737 ' HB2' HG21 ' A' ' 37' ' ' THR . 0.4 OUTLIER -89.14 -21.19 23.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.393 -0.817 . . . . 0.0 110.343 -179.435 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.577 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.4 mt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.349 -179.636 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.546 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.352 0.596 . . . . 0.0 110.102 . . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.882 HD12 HD22 ' A' ' 22' ' ' LEU . 5.0 tt -81.69 156.41 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.304 -0.873 . . . . 0.0 110.344 179.939 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.623 HG23 ' N ' ' A' ' 5' ' ' LYS . 5.6 t -136.94 -150.67 0.37 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.311 -0.868 . . . . 0.0 110.063 179.87 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.623 ' N ' HG23 ' A' ' 4' ' ' THR . 11.1 ttpt -107.67 -178.64 3.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.476 -0.765 . . . . 0.0 110.266 179.986 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.727 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 79.5 m -111.95 -154.32 0.54 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.3 -0.875 . . . . 0.0 110.171 -179.947 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.506 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.4 OUTLIER -137.49 -156.57 0.7 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.243 -0.911 . . . . 0.0 110.095 -179.91 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.506 ' N ' ' OG ' ' A' ' 7' ' ' SER . 21.9 t -79.81 167.66 20.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.181 -0.949 . . . . 0.0 110.04 179.93 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 53.11 19.18 1.35 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.176 -0.953 . . . . 0.0 110.173 -179.86 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -119.67 4.51 11.07 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.345 -0.847 . . . . 0.0 110.199 -179.986 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -111.3 90.53 3.36 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.241 -0.912 . . . . 0.0 110.236 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -144.76 40.56 1.14 Allowed Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.983 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.418 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 57.5 t80 -148.13 -57.43 0.23 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.201 -1.176 . . . . 0.0 110.271 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.569 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 28.4 p -97.13 118.86 34.51 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.174 -0.954 . . . . 0.0 110.128 -179.958 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.613 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 12.1 mt -89.27 -40.3 12.92 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.246 -0.909 . . . . 0.0 110.307 -179.974 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.613 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -114.35 81.98 1.64 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.046 -1.034 . . . . 0.0 110.193 -179.651 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.404 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -178.28 -173.77 43.97 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.968 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -101.43 144.41 30.26 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.286 -1.126 . . . . 0.0 110.413 -179.985 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.727 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 14.8 t -98.35 125.53 43.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.287 -0.883 . . . . 0.0 110.262 -179.959 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.805 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.0 -175.74 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.453 -0.779 . . . . 0.0 110.139 -179.954 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.472 ' O ' HG13 ' A' ' 3' ' ' ILE . 11.8 t80 -138.27 125.96 22.25 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.165 -0.959 . . . . 0.0 110.107 179.975 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.882 HD22 HD12 ' A' ' 3' ' ' ILE . 1.0 OUTLIER -80.3 129.8 34.75 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.174 -0.954 . . . . 0.0 110.838 -179.584 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.546 HG11 ' CB ' ' A' ' 2' ' ' SER . 5.0 p -90.59 -28.07 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.391 -0.818 . . . . 0.0 110.438 179.731 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -78.27 -13.52 59.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.069 -1.019 . . . . 0.0 108.719 179.097 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.531 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -147.45 66.31 1.13 Allowed 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.902 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.492 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.9 p -29.29 89.8 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.757 0.789 . . . . 0.0 111.436 -178.604 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -159.08 147.63 18.17 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.693 -0.629 . . . . 0.0 109.481 -179.998 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.519 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.3 m-20 -63.77 109.9 1.88 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.304 -0.872 . . . . 0.0 110.084 -179.987 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.616 ' CB ' HD23 ' A' ' 22' ' ' LEU . 6.2 t80 -98.01 141.25 31.2 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.238 -0.914 . . . . 0.0 109.684 179.871 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.569 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 19.5 m -141.95 113.25 7.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.089 -1.007 . . . . 0.0 110.586 -179.497 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.404 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 12.2 tpp180 -81.5 104.46 11.95 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.197 -0.94 . . . . 0.0 109.625 179.511 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.634 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 94.8 m -79.5 168.29 19.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.331 -0.856 . . . . 0.0 110.186 -179.65 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.41 ' CG ' ' H ' ' A' ' 35' ' ' GLY . 7.9 tt0 -78.8 127.44 32.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.188 -0.945 . . . . 0.0 109.504 179.783 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.4 t -66.93 -10.3 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.346 -0.846 . . . . 0.0 110.613 -179.19 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.41 ' H ' ' CG ' ' A' ' 33' ' ' GLU . . . -79.44 -5.94 89.09 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 179.835 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.58 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -83.14 178.65 8.01 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.195 -1.18 . . . . 0.0 110.194 -179.95 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.629 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -111.85 28.5 8.69 Favored 'General case' 0 N--CA 1.498 1.974 0 C-N-CA 119.046 -1.062 . . . . 0.0 110.16 179.663 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.22 157.75 29.1 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 179.527 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.564 ' O ' HG13 ' A' ' 39' ' ' VAL . 8.8 p -84.68 43.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -1.162 . . . . 0.0 109.723 179.522 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.571 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -157.03 18.71 0.3 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.463 -0.773 . . . . 0.0 110.135 -179.405 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.634 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 13.7 p 29.76 91.4 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.432 -0.793 . . . . 0.0 111.566 179.393 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.571 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.7 tt0 -158.62 -37.74 0.06 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -0.925 . . . . 0.0 110.42 179.507 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.629 ' CE1' HG23 ' A' ' 37' ' ' THR . 0.6 OUTLIER -119.0 125.13 48.67 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.049 -1.032 . . . . 0.0 110.523 179.83 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.603 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.6 t80 -88.2 126.56 35.21 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.467 0.651 . . . . 0.0 109.865 -179.173 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.578 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.2 OUTLIER -92.71 -28.39 16.67 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.471 -0.768 . . . . 0.0 110.164 -179.394 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.603 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.4 mt . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.45 -179.689 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.511 ' HB2' HG11 ' A' ' 23' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.248 0.546 . . . . 0.0 110.148 . . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.537 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 2.4 tt -107.95 177.69 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.302 -0.874 . . . . 0.0 110.234 -179.941 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -153.46 169.65 22.64 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.243 -0.911 . . . . 0.0 110.139 -179.936 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.71 167.51 9.85 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 110.196 -179.988 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.567 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 39.9 m -102.14 -149.45 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 110.217 179.994 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -139.8 -169.65 2.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.227 -0.921 . . . . 0.0 110.064 -179.979 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 78.4 p -82.46 9.82 8.43 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.938 . . . . 0.0 110.221 179.999 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -123.34 20.29 9.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.19 -0.944 . . . . 0.0 110.209 -179.953 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 9.8 ttt -146.05 22.31 1.39 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.227 -0.92 . . . . 0.0 110.301 -179.971 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -118.19 94.97 4.69 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.305 -0.872 . . . . 0.0 110.203 179.942 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -155.12 28.64 0.64 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.933 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -122.98 -61.74 1.41 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.21 -1.17 . . . . 0.0 110.261 179.94 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.515 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.6 p -90.8 119.26 30.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.204 -0.935 . . . . 0.0 110.351 -179.816 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.608 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.4 mt -80.89 -42.9 20.7 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.326 -0.859 . . . . 0.0 109.999 179.794 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.608 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.2 m80 -118.36 80.98 1.61 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.355 -0.841 . . . . 0.0 110.36 -179.421 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.402 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -170.31 165.94 39.19 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.943 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.476 ' HB2' ' HB3' ' A' ' 31' ' ' ARG . 1.4 mt-30 -80.89 148.92 29.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.212 -1.17 . . . . 0.0 110.149 179.946 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.567 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 15.3 t -103.38 119.64 39.27 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.34 -0.85 . . . . 0.0 110.255 179.911 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.804 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -142.35 -175.69 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.205 -0.934 . . . . 0.0 110.372 179.959 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.475 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 6.3 t80 -143.51 126.68 16.54 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.241 -0.912 . . . . 0.0 109.696 179.89 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.537 HD13 ' CB ' ' A' ' 29' ' ' TYR . 1.6 mp -79.46 132.11 36.26 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.191 -0.943 . . . . 0.0 111.011 -179.529 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.511 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.6 p -90.31 -29.37 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.487 -0.758 . . . . 0.0 110.241 179.942 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -78.31 -15.69 58.48 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.129 -0.982 . . . . 0.0 108.735 179.042 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.524 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -142.57 64.43 1.37 Allowed 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.037 -1.098 . . . . 0.0 108.037 178.642 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.475 ' C ' ' O ' ' A' ' 25' ' ' MET . 44.8 p -29.14 89.64 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.725 0.774 . . . . 0.0 111.476 -178.52 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.524 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.03 146.7 16.03 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.713 -0.617 . . . . 0.0 109.484 179.93 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.503 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 7.6 p30 -63.6 110.1 1.89 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 110.189 -179.953 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.537 ' CB ' HD13 ' A' ' 22' ' ' LEU . 5.4 t80 -99.39 134.6 42.03 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.367 -0.833 . . . . 0.0 109.729 179.889 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.2 m -130.22 114.48 15.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.082 -1.011 . . . . 0.0 110.566 -179.682 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.476 ' HB3' ' HB2' ' A' ' 18' ' ' GLN . 3.6 tpp180 -79.81 130.98 35.78 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.162 -0.961 . . . . 0.0 109.531 179.525 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 12.2 m -79.78 159.53 26.52 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.222 -0.924 . . . . 0.0 110.121 -179.689 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 35' ' ' GLY . 9.9 tt0 -79.17 107.28 11.82 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.24 -0.912 . . . . 0.0 109.481 179.694 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.442 HG23 ' H ' ' A' ' 34' ' ' VAL . 37.3 t -42.87 97.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.638 -0.664 . . . . 0.0 110.02 -179.558 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 152.78 -16.07 0.72 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.958 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.572 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.5 m-85 -79.67 169.23 18.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.077 -1.249 . . . . 0.0 110.11 179.964 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.929 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -113.44 31.86 6.19 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.997 -1.064 . . . . 0.0 110.711 -179.764 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -152.46 157.22 27.15 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.671 -1.371 . . . . 0.0 109.671 179.676 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.445 ' O ' HG22 ' A' ' 39' ' ' VAL . 9.4 p -87.86 20.63 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.271 -1.135 . . . . 0.0 109.965 179.814 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.589 ' CZ ' ' CB ' ' A' ' 42' ' ' GLU . 4.3 tmm_? -124.05 -20.36 5.36 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.191 179.851 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.2 m 72.79 82.53 0.13 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.326 -0.859 . . . . 0.0 109.945 179.75 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.589 ' CB ' ' CZ ' ' A' ' 40' ' ' ARG . 0.9 OUTLIER -155.54 -30.7 0.1 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.453 -0.78 . . . . 0.0 111.047 -179.871 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.929 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.7 p80 -122.15 121.51 37.06 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.69 -1.256 . . . . 0.0 110.881 179.783 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.607 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.6 t80 -83.66 108.65 16.88 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.243 0.544 . . . . 0.0 109.891 -179.884 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.573 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -69.74 -16.84 63.39 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.318 -0.864 . . . . 0.0 109.958 -179.707 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.607 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.307 -179.835 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.572 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.233 0.539 . . . . 0.0 110.216 . . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.563 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -124.93 160.72 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.254 -0.904 . . . . 0.0 110.169 179.823 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.477 ' O ' HG22 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -135.97 -178.39 5.12 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.264 -0.897 . . . . 0.0 110.079 -179.559 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.415 ' H ' HG22 ' A' ' 4' ' ' THR . 22.3 mttt -84.5 -177.72 6.7 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.237 -0.914 . . . . 0.0 110.028 179.9 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.424 ' O ' ' CB ' ' A' ' 7' ' ' SER . 63.1 m -108.85 -104.14 0.36 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.182 -0.949 . . . . 0.0 110.396 -179.923 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.482 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.1 OUTLIER 174.07 -164.35 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.954 -1.091 . . . . 0.0 110.195 -179.886 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.482 ' N ' ' OG ' ' A' ' 7' ' ' SER . 0.7 OUTLIER -82.75 169.68 15.9 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.178 -0.951 . . . . 0.0 110.121 179.895 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.404 ' C ' ' O ' ' A' ' 8' ' ' SER . 12.1 m-20 43.17 26.41 0.09 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.247 -0.908 . . . . 0.0 110.2 -179.917 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.415 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.8 OUTLIER -124.68 4.33 8.2 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.24 -0.913 . . . . 0.0 110.334 -179.88 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -106.69 82.58 1.73 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.215 -0.928 . . . . 0.0 110.218 179.943 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -137.34 25.55 3.0 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.973 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -125.17 -52.74 1.63 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.227 -1.16 . . . . 0.0 110.241 -179.967 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.52 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 20.1 p -106.82 120.47 42.11 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.337 -0.852 . . . . 0.0 110.43 -179.974 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.592 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.7 mt -89.83 -43.39 10.67 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.256 -0.902 . . . . 0.0 110.432 -179.973 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.592 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.0 m80 -110.26 88.5 2.78 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.278 -0.889 . . . . 0.0 110.077 -179.482 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.429 ' C ' ' OE1' ' A' ' 18' ' ' GLN . . . 174.91 -126.61 1.2 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 -179.873 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.579 ' NE2' ' CG ' ' A' ' 31' ' ' ARG . 14.6 pm0 -160.5 134.72 7.26 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.433 -1.04 . . . . 0.0 110.248 179.642 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.486 ' C ' ' CG1' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -81.45 148.9 29.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.262 -0.899 . . . . 0.0 110.374 -179.692 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.002 HD12 ' CD1' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -159.57 -172.22 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.235 -0.915 . . . . 0.0 109.643 179.913 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.45 ' O ' HG13 ' A' ' 3' ' ' ILE . 4.5 t80 -151.81 128.92 11.12 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.076 -1.015 . . . . 0.0 110.271 -179.636 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.57 HD11 ' HD2' ' A' ' 29' ' ' TYR . 36.4 mt -79.34 130.39 35.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.146 -0.971 . . . . 0.0 110.866 -179.696 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.572 HG12 ' O ' ' A' ' 2' ' ' SER . 4.6 p -90.3 -34.05 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.157 -0.964 . . . . 0.0 109.968 179.361 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 25' ' ' MET . 3.0 p30 -78.23 -20.88 50.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.152 -0.967 . . . . 0.0 108.586 179.101 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.506 ' O ' ' C ' ' A' ' 26' ' ' SER . 3.9 ttm -136.78 61.5 1.63 Allowed 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.559 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.506 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -29.52 92.66 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 122.106 0.955 . . . . 0.0 111.206 -178.608 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -158.73 141.25 14.24 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.933 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -55.81 113.88 1.67 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.104 -0.997 . . . . 0.0 110.504 -179.511 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 1.002 ' CD1' HD12 ' A' ' 20' ' ' ILE . 4.4 t80 -105.93 120.98 43.13 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.349 -0.844 . . . . 0.0 109.789 179.73 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.52 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -127.17 111.41 13.95 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.113 -0.992 . . . . 0.0 110.18 179.804 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.579 ' CG ' ' NE2' ' A' ' 18' ' ' GLN . 13.2 tpp180 -84.64 103.88 14.14 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.129 -0.982 . . . . 0.0 110.036 179.777 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.545 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 73.6 m -80.57 173.98 12.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.323 -0.861 . . . . 0.0 110.28 -179.842 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -79.89 133.46 36.23 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.277 -0.889 . . . . 0.0 109.896 179.892 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.8 t -71.35 -26.38 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.282 -0.887 . . . . 0.0 110.469 -179.531 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.45 -12.12 31.19 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.805 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.573 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.0 OUTLIER -79.57 178.4 8.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.182 -1.187 . . . . 0.0 110.279 -179.974 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.856 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -110.39 25.28 11.95 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.128 -0.982 . . . . 0.0 110.267 179.61 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -158.28 157.52 28.39 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.652 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.785 HG12 ' O ' ' A' ' 39' ' ' VAL . 70.7 t -84.67 44.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.219 -1.165 . . . . 0.0 109.823 179.715 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.591 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.4 OUTLIER -157.32 20.04 0.29 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.441 -0.787 . . . . 0.0 109.972 -179.523 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.545 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.1 p 28.24 89.75 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.429 0.633 . . . . 0.0 111.399 179.724 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.591 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.8 tm-20 -153.63 -37.03 0.1 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.432 -0.793 . . . . 0.0 110.143 179.865 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.856 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.3 p80 -119.59 121.52 39.51 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.0 110.221 179.209 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.606 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 24.7 t80 -84.95 120.16 26.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.696 -0.627 . . . . 0.0 110.064 -179.505 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.542 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -87.14 -12.16 47.86 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.479 -0.763 . . . . 0.0 109.916 -179.572 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.606 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.8 mt . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 117.926 -1.035 . . . . 0.0 110.274 -179.882 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.514 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.27 0.557 . . . . 0.0 110.105 . . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.836 HD11 ' HB ' ' A' ' 20' ' ' ILE . 3.0 tt -142.74 161.71 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.313 -0.867 . . . . 0.0 110.179 179.96 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.483 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.3 m -143.57 162.25 36.37 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.223 -0.923 . . . . 0.0 110.221 179.755 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 mtmp? -86.56 167.73 14.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.222 -0.924 . . . . 0.0 110.178 -179.882 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 75.5 m -90.59 -178.39 5.29 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.305 -0.872 . . . . 0.0 110.233 179.983 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.7 t -108.25 -153.17 0.5 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.923 . . . . 0.0 110.265 -179.895 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.5 172.04 11.29 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.341 -0.849 . . . . 0.0 110.304 -179.991 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t0 45.26 25.3 0.19 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.222 -0.924 . . . . 0.0 110.157 -179.953 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.16 2.86 8.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.178 -0.951 . . . . 0.0 110.291 179.992 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -101.55 47.63 0.9 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.273 -0.892 . . . . 0.0 110.261 -179.985 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -120.44 16.0 9.84 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.997 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.0 t80 -105.45 -53.23 2.69 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -1.161 . . . . 0.0 110.276 179.972 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.466 ' HB2' ' SG ' ' A' ' 41' ' ' CYS . 23.4 p -109.89 118.05 35.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.264 -0.897 . . . . 0.0 110.31 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.581 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -90.35 -43.11 10.54 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.233 -0.917 . . . . 0.0 110.338 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.581 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.3 m80 -107.85 83.94 1.88 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.31 -0.869 . . . . 0.0 110.015 -179.538 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.492 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 175.73 -161.22 29.89 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.813 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -121.78 133.98 54.92 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.251 -1.147 . . . . 0.0 110.119 179.827 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.587 ' C ' HG23 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -85.61 140.34 30.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.226 -0.921 . . . . 0.0 110.318 -179.831 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.068 HD11 ' CD1' ' A' ' 29' ' ' TYR . 32.8 pt -157.65 -167.95 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 110.075 -179.949 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.529 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 11.2 t80 -147.08 139.69 24.88 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.907 . . . . 0.0 110.04 -179.919 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.663 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.5 mm? -92.2 134.52 34.8 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.105 -0.997 . . . . 0.0 110.743 -179.725 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.514 HG11 ' CB ' ' A' ' 2' ' ' SER . 7.5 p -90.66 -28.32 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.239 -0.913 . . . . 0.0 110.658 179.997 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.541 ' OD1' HD12 ' A' ' 22' ' ' LEU . 58.0 p30 -78.17 -12.98 60.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.922 -1.111 . . . . 0.0 108.892 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -146.41 65.78 1.19 Allowed 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.777 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.529 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 20.5 p -30.03 87.93 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.64 0.733 . . . . 0.0 111.928 -178.466 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.7 tt0 -158.59 168.05 27.93 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.581 -0.7 . . . . 0.0 109.763 179.531 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.48 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 2.0 p-10 -76.52 127.47 32.89 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.398 -0.814 . . . . 0.0 110.373 -179.86 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 1.068 ' CD1' HD11 ' A' ' 20' ' ' ILE . 6.3 t80 -122.31 119.83 32.29 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.422 -0.798 . . . . 0.0 109.816 179.906 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 22.2 m -123.79 115.15 20.89 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.128 -0.983 . . . . 0.0 110.51 -179.561 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.492 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 8.1 tpp85 -80.97 115.71 20.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.263 -0.898 . . . . 0.0 109.675 179.528 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 87.4 m -79.68 168.84 18.82 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.237 -0.914 . . . . 0.0 110.512 -179.667 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -79.84 115.44 19.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.415 -0.803 . . . . 0.0 110.216 -179.866 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.439 ' H ' HG23 ' A' ' 34' ' ' VAL . 37.2 t -54.83 110.06 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.347 -0.846 . . . . 0.0 109.778 179.748 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 138.9 -8.23 3.3 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.701 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.22 177.09 9.09 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.158 -1.201 . . . . 0.0 109.908 179.943 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.606 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.62 29.88 7.33 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.92 -1.112 . . . . 0.0 110.115 -179.913 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.01 155.77 26.92 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.384 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.57 ' O ' HG22 ' A' ' 39' ' ' VAL . 14.8 p -85.12 44.27 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.24 -1.153 . . . . 0.0 109.628 179.547 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.22 22.26 0.16 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.491 -0.755 . . . . 0.0 109.909 -179.374 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 11.8 p 29.63 90.28 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.612 -0.68 . . . . 0.0 111.351 179.625 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.6 tm-20 -151.85 -45.04 0.11 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.162 -0.961 . . . . 0.0 110.415 179.943 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.606 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 3.0 p-80 -117.85 129.62 55.76 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.074 -1.017 . . . . 0.0 110.817 179.883 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.664 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 14.8 t80 -87.03 126.44 34.75 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.399 0.619 . . . . 0.0 109.978 -178.794 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.576 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -84.92 2.48 42.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.473 -0.767 . . . . 0.0 109.954 -179.598 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.664 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.4 mt . . . . . 0 C--N 1.302 -1.496 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.31 -179.518 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.466 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 40.8 t . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.186 0.517 . . . . 0.0 110.2 . . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.811 HD11 ' CG2' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -100.02 156.66 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.326 -0.859 . . . . 0.0 110.349 179.974 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.513 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 3.2 m -137.25 166.72 23.09 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.141 179.955 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.9 mttt -106.61 156.08 18.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.214 -0.929 . . . . 0.0 110.35 -179.945 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.637 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 90.7 m -81.8 -160.82 0.38 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.276 -0.89 . . . . 0.0 110.149 -179.948 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.0 t -131.81 -159.62 0.98 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.252 -0.905 . . . . 0.0 110.221 179.967 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.0 m -80.33 171.23 15.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.263 -0.898 . . . . 0.0 110.214 179.967 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 46.5 24.02 0.27 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.279 -0.888 . . . . 0.0 110.238 -179.951 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.11 7.73 7.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.218 -0.926 . . . . 0.0 110.28 -179.981 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -115.22 96.79 5.85 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.223 -0.923 . . . . 0.0 110.229 -179.93 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.56 39.19 1.31 Allowed Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.995 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.445 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 82.6 t80 -142.42 -53.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -1.143 . . . . 0.0 110.262 -179.932 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.3 p -100.86 118.34 36.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.458 -179.833 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.568 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.8 mt -90.49 -43.05 10.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.248 -0.907 . . . . 0.0 110.328 179.838 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.568 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.3 m80 -108.24 83.13 1.73 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.269 -0.894 . . . . 0.0 110.289 -179.403 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 179.33 -134.26 2.25 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.999 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -160.28 142.6 13.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -1.136 . . . . 0.0 110.387 179.981 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.837 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -83.37 135.51 34.68 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.192 -0.943 . . . . 0.0 110.036 179.739 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.837 HD13 ' O ' ' A' ' 19' ' ' CYS . 37.9 mm -143.13 169.74 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.155 -0.966 . . . . 0.0 110.257 -179.643 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.513 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 23.6 t80 -131.45 140.2 49.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.021 -1.049 . . . . 0.0 110.052 179.813 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.576 HD23 ' HB2' ' A' ' 29' ' ' TYR . 3.2 mm? -102.63 138.61 39.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.125 -0.985 . . . . 0.0 110.927 -179.57 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.466 ' HB ' ' O ' ' A' ' 2' ' ' SER . 7.5 p -90.4 -28.29 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.279 -0.888 . . . . 0.0 110.479 179.936 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -78.23 -17.81 56.23 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.087 -1.008 . . . . 0.0 108.769 179.351 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.576 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -139.57 62.78 1.51 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.685 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.6 p -29.21 85.54 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 121.565 0.698 . . . . 0.0 112.003 -178.284 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.576 ' N ' ' O ' ' A' ' 25' ' ' MET . 9.9 pt20 -161.39 -177.29 5.89 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.577 -0.702 . . . . 0.0 109.385 179.354 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -82.14 163.94 21.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.27 -0.894 . . . . 0.0 110.254 179.937 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.576 ' HB2' HD23 ' A' ' 22' ' ' LEU . 8.6 t80 -150.91 90.45 1.62 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.282 -0.886 . . . . 0.0 109.97 179.875 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.7 m -91.84 101.67 14.26 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.292 -0.88 . . . . 0.0 110.388 -179.735 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.455 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.9 OUTLIER -79.28 118.39 21.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.194 -0.941 . . . . 0.0 109.654 179.589 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 82.1 m -79.73 170.45 16.5 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.373 -0.83 . . . . 0.0 110.36 -179.738 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -79.78 116.22 19.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.356 -0.84 . . . . 0.0 110.118 -179.931 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 t -53.65 105.48 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.266 -0.896 . . . . 0.0 109.678 179.897 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.94 -10.7 1.85 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.663 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.547 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.15 178.6 7.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.12 -1.223 . . . . 0.0 109.673 179.876 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.601 HG23 ' O ' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -109.65 25.77 11.42 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 118.793 -1.163 . . . . 0.0 110.57 -179.799 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.42 160.28 31.62 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 179.29 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.517 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.5 p -87.09 38.13 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.115 -1.226 . . . . 0.0 109.622 179.382 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.57 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -146.31 14.01 1.26 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.562 -0.711 . . . . 0.0 109.65 -179.684 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 8.0 p 31.07 93.29 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.515 -0.74 . . . . 0.0 111.242 179.757 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.57 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.1 tm-20 -159.5 -38.38 0.06 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.509 -0.745 . . . . 0.0 110.022 179.612 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.601 ' O ' HG23 ' A' ' 37' ' ' THR . 2.1 p-80 -120.28 125.6 48.5 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 122.166 0.984 . . . . 0.0 110.538 179.78 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.616 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.2 t80 -85.59 127.48 34.47 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.338 0.589 . . . . 0.0 109.88 -179.026 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.55 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -86.89 -35.48 18.95 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.359 -0.838 . . . . 0.0 110.023 -179.5 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.616 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.7 mt . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.295 -179.775 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.331 0.586 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.971 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -143.9 154.74 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.281 -0.887 . . . . 0.0 110.186 -179.938 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.02 164.07 18.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.264 -0.898 . . . . 0.0 110.311 179.98 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.4 168.06 9.56 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.295 -0.878 . . . . 0.0 110.204 179.993 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.615 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 71.8 m -107.84 -170.93 1.77 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.213 -0.929 . . . . 0.0 110.223 179.99 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -116.85 -155.17 0.58 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.339 -0.851 . . . . 0.0 110.184 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.81 170.26 16.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.206 -0.933 . . . . 0.0 110.184 179.986 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.3 15.1 3.2 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.226 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.94 15.06 9.99 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.0 110.305 -179.977 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.71 114.17 16.28 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.225 -0.922 . . . . 0.0 110.088 179.985 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.15 27.71 0.19 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 -179.944 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -131.02 -47.59 1.01 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.246 -1.149 . . . . 0.0 110.204 179.914 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.547 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 17.1 p -102.78 123.38 46.34 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.296 -0.877 . . . . 0.0 110.134 179.901 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.6 ' N ' HD23 ' A' ' 15' ' ' LEU . 4.2 mt -90.5 -52.33 4.96 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.276 -0.89 . . . . 0.0 110.406 -179.823 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.502 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 10.5 m80 -99.04 82.81 2.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.37 -0.831 . . . . 0.0 110.358 -179.267 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 178.69 -135.31 2.57 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.93 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.464 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 5.0 pt20 -160.34 145.82 14.99 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -1.102 . . . . 0.0 110.23 179.863 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.615 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 41.9 t -89.43 131.13 35.64 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -0.876 . . . . 0.0 110.051 179.963 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.038 HD11 ' CD1' ' A' ' 29' ' ' TYR . 20.5 pt -143.46 -172.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.374 -0.829 . . . . 0.0 110.085 -179.865 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.53 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 14.9 t80 -142.66 132.53 24.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.242 -0.911 . . . . 0.0 109.868 179.861 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.625 HD23 ' CB ' ' A' ' 29' ' ' TYR . 2.5 mm? -86.49 131.57 34.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.14 -0.975 . . . . 0.0 110.612 -179.726 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.9 p -90.32 -25.04 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.257 -0.902 . . . . 0.0 110.504 179.919 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -78.38 -4.74 49.7 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.024 -1.048 . . . . 0.0 108.858 179.015 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.2 ttt -159.12 68.5 0.44 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 179.183 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 17.9 p -29.51 88.79 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.708 0.766 . . . . 0.0 111.471 -178.484 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.0 OUTLIER -160.49 148.44 16.3 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.629 -0.669 . . . . 0.0 109.462 -179.963 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.6 t-20 -59.08 148.93 29.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.283 -0.886 . . . . 0.0 109.853 179.921 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 1.038 ' CD1' HD11 ' A' ' 20' ' ' ILE . 5.4 t80 -145.82 114.43 6.8 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.161 -0.962 . . . . 0.0 110.328 -179.517 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.547 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.7 m -108.3 111.46 23.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.056 -1.028 . . . . 0.0 110.241 -179.964 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.49 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 1.6 tpp180 -85.61 114.48 22.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.253 -0.904 . . . . 0.0 110.017 179.717 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 96.6 m -79.82 175.99 10.13 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.315 -0.865 . . . . 0.0 110.509 -179.921 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -81.16 115.82 20.76 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.273 -0.892 . . . . 0.0 110.249 -179.944 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 59.7 t -52.16 105.84 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.194 -0.942 . . . . 0.0 109.909 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.547 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 146.62 -13.57 1.56 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 -179.872 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.502 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.54 174.34 11.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.35 -1.088 . . . . 0.0 109.951 179.886 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 1.025 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.4 OUTLIER -106.01 -32.45 8.29 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 118.86 -1.136 . . . . 0.0 111.117 -179.674 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.515 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -92.13 159.51 25.42 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.928 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.601 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.9 p -84.85 44.41 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.247 -1.149 . . . . 0.0 109.531 179.455 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.6 27.11 0.19 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.544 -0.722 . . . . 0.0 109.789 -179.339 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 3.2 p 28.5 91.94 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.606 -0.684 . . . . 0.0 111.472 179.577 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 15.4 tm-20 -157.47 -37.96 0.07 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.36 -0.838 . . . . 0.0 110.199 179.599 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 1.025 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.0 p80 -125.29 128.47 48.29 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.048 -1.032 . . . . 0.0 111.159 179.678 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.59 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 89.4 t80 -93.93 112.81 24.71 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.724 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.592 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -94.94 -10.54 30.76 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.266 -0.896 . . . . 0.0 110.197 -179.102 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.59 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 7.5 mt . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.213 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.775 ' O ' HG13 ' A' ' 1' ' ' VAL . 14.5 p . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 121.303 0.573 . . . . 0.0 110.219 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.57 ' HB2' HG11 ' A' ' 23' ' ' VAL . 94.0 p -139.55 90.06 2.38 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.208 -0.932 . . . . 0.0 110.084 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.821 HG12 HG22 ' A' ' 20' ' ' ILE . 9.4 tt -141.23 169.58 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.349 -0.844 . . . . 0.0 110.066 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.518 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 4.0 m -141.35 167.27 22.56 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.303 -0.873 . . . . 0.0 110.423 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -80.98 -170.43 2.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.2 -0.937 . . . . 0.0 110.151 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 99.5 m -116.08 172.67 7.02 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.206 -0.934 . . . . 0.0 110.255 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 t -110.91 -151.28 0.48 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.339 -0.851 . . . . 0.0 110.32 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.8 m -84.62 172.76 11.32 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.336 -0.853 . . . . 0.0 110.318 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 45.29 24.84 0.17 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.36 -0.838 . . . . 0.0 110.296 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.5 2.17 10.16 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.187 -0.945 . . . . 0.0 110.211 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.67 76.47 1.4 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 110.126 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -135.02 27.83 3.12 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -135.64 -60.49 0.74 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.236 -1.155 . . . . 0.0 110.199 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -91.47 120.28 32.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.323 -0.861 . . . . 0.0 110.145 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.8 mt -90.08 -41.88 11.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.19 -0.944 . . . . 0.0 110.493 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.597 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.8 m80 -114.4 85.09 2.17 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.258 -0.901 . . . . 0.0 110.098 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.505 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.03 178.18 42.11 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -99.75 140.61 33.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.311 -1.111 . . . . 0.0 110.143 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 1.004 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -85.43 134.32 34.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.311 -0.868 . . . . 0.0 110.278 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.004 HD13 ' O ' ' A' ' 19' ' ' CYS . 0.4 OUTLIER -139.4 -174.34 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.825 0 O-C-N 121.204 -0.935 . . . . 0.0 109.58 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.493 ' O ' HG13 ' A' ' 3' ' ' ILE . 11.3 t80 -149.31 123.46 9.5 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.919 -1.113 . . . . 0.0 110.504 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.734 HD12 ' NE2' ' A' ' 27' ' ' GLN . 21.0 mt -79.52 132.11 36.23 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.236 -0.915 . . . . 0.0 110.947 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.57 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.7 p -90.09 -33.36 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.244 -0.91 . . . . 0.0 109.864 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -78.29 -20.92 50.53 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.231 -0.918 . . . . 0.0 108.58 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.523 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.1 tpt -133.06 60.27 1.71 Allowed 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.479 ' C ' ' O ' ' A' ' 25' ' ' MET . 3.6 p -29.21 89.45 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.667 0.746 . . . . 0.0 111.611 -178.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.734 ' NE2' HD12 ' A' ' 22' ' ' LEU . 2.6 pt20 -159.85 170.44 21.43 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.712 -0.617 . . . . 0.0 109.431 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -81.15 116.23 20.96 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.261 -0.899 . . . . 0.0 110.508 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HD2' HD11 ' A' ' 22' ' ' LEU . 4.3 t80 -109.96 103.92 12.76 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.394 -0.816 . . . . 0.0 109.475 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.604 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 65.9 m -108.26 114.67 28.72 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.191 -0.943 . . . . 0.0 110.395 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.505 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.8 tpp85 -79.54 120.73 24.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.896 . . . . 0.0 109.401 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.561 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 95.5 m -78.98 171.84 14.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.138 -0.976 . . . . 0.0 110.471 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -79.38 121.24 24.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.391 -0.818 . . . . 0.0 110.037 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 32.6 t -52.51 104.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.222 -0.924 . . . . 0.0 109.73 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.612 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 144.56 -10.77 1.94 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.34 172.02 14.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.214 -1.168 . . . . 0.0 109.843 179.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.909 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -113.39 31.67 6.31 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.891 -1.13 . . . . 0.0 111.066 -179.253 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.43 155.44 26.59 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.56 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.5 p -85.69 43.5 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.308 -1.113 . . . . 0.0 109.475 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.574 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -156.64 20.14 0.33 Allowed 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.565 -0.709 . . . . 0.0 109.787 -179.353 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.561 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 5.2 p 27.57 90.73 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.685 -0.634 . . . . 0.0 111.614 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.574 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 10.4 tm-20 -154.89 -36.51 0.09 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.469 -0.769 . . . . 0.0 110.197 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.909 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.9 p80 -120.42 119.51 33.26 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.016 -1.053 . . . . 0.0 110.626 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.597 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 41.3 t80 -82.78 114.79 21.35 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.332 0.587 . . . . 0.0 110.045 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.532 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -77.98 -35.07 50.59 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.315 -0.866 . . . . 0.0 110.105 -179.69 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.612 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.6 mt . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.338 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 78.8 t . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.297 0.57 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.546 ' HB2' ' CG1' ' A' ' 23' ' ' VAL . 1.4 p -155.14 41.53 0.44 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.223 -0.923 . . . . 0.0 110.121 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.685 ' CG1' HG22 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -155.93 166.58 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.363 -0.836 . . . . 0.0 110.464 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.4 m -149.11 172.22 15.15 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.365 -0.835 . . . . 0.0 110.142 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.67 175.54 5.41 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.229 -0.92 . . . . 0.0 110.227 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 93.7 m -117.09 176.63 5.04 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.291 -0.881 . . . . 0.0 110.26 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -155.96 17.22 0.36 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 0.0 110.672 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.0 m -151.79 -70.39 0.16 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.187 -0.946 . . . . 0.0 110.246 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -80.25 12.9 2.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.161 -0.962 . . . . 0.0 110.552 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.544 ' HB3' ' CB ' ' A' ' 6' ' ' CYS . 22.2 ptm -78.89 -27.69 43.98 Favored 'General case' 0 C--N 1.308 -1.232 0 O-C-N 121.106 -0.996 . . . . 0.0 110.186 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.5 p30 -100.69 44.89 0.99 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.213 -0.929 . . . . 0.0 110.184 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -129.16 -39.11 0.31 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.8 t80 -94.08 -65.04 1.01 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.194 -1.18 . . . . 0.0 110.403 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.583 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 25.2 p -91.24 119.73 31.56 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.162 -0.961 . . . . 0.0 110.269 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.6 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.8 mt -87.59 -40.96 13.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.195 -0.94 . . . . 0.0 110.254 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.6 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.8 m80 -113.53 88.03 2.75 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.16 -0.963 . . . . 0.0 110.091 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.83 -168.43 41.27 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -117.24 134.62 54.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -1.117 . . . . 0.0 110.052 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 3.8 t -79.84 146.8 32.04 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.228 -0.92 . . . . 0.0 109.94 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.809 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.2 mt -152.35 -176.83 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.152 -0.967 . . . . 0.0 109.841 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.508 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 20.6 t80 -147.99 117.88 7.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.111 -0.993 . . . . 0.0 109.971 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.593 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.2 mm? -79.93 130.15 35.06 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.098 -1.001 . . . . 0.0 110.195 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.546 ' CG1' ' HB2' ' A' ' 2' ' ' SER . 7.2 p -89.34 -26.05 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.245 -0.909 . . . . 0.0 110.153 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -78.39 -13.77 59.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.163 -0.96 . . . . 0.0 108.683 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.534 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -148.1 66.91 1.09 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 178.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.489 ' C ' ' O ' ' A' ' 25' ' ' MET . 80.7 p -29.15 89.14 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 121.761 0.791 . . . . 0.0 111.743 -178.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.534 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -156.8 144.36 19.08 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.607 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.452 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 9.1 t30 -62.85 108.04 1.11 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.194 -0.941 . . . . 0.0 110.455 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.809 ' CD1' HD12 ' A' ' 20' ' ' ILE . 5.7 t80 -94.31 106.06 18.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.327 -0.858 . . . . 0.0 110.017 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.583 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 1.8 m -111.74 110.07 20.24 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 110.344 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.2 tpp180 -80.05 103.62 10.06 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.169 -0.957 . . . . 0.0 109.668 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 79.3 m -79.54 171.69 14.81 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.305 -0.872 . . . . 0.0 110.247 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -79.33 126.66 31.09 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.234 -0.916 . . . . 0.0 109.836 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 12.7 t -65.99 -15.15 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 110.114 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.27 -15.62 68.05 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.529 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.5 m-85 -79.75 169.86 17.34 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.219 -1.165 . . . . 0.0 109.955 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.891 HG23 ' CE1' ' A' ' 43' ' ' HIS . 15.2 t -101.43 26.48 7.19 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 118.874 -1.131 . . . . 0.0 110.655 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.08 160.64 31.81 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 39' ' ' VAL . 10.7 p -85.04 43.76 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.1 -1.235 . . . . 0.0 109.716 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.635 ' NH2' ' CD2' ' A' ' 43' ' ' HIS . 1.1 ttp180 -150.29 13.8 0.77 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.464 -0.772 . . . . 0.0 110.224 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.3 p 29.56 88.52 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.494 -0.754 . . . . 0.0 110.886 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.561 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 3.4 tt0 -154.85 -36.9 0.09 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.267 -0.895 . . . . 0.0 110.385 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.891 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.6 p80 -127.88 124.05 36.53 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.025 -1.047 . . . . 0.0 111.327 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.543 ' CE2' ' C ' ' A' ' 46' ' ' LEU . 87.3 t80 -90.63 89.78 7.68 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.598 ' HB3' ' CB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -64.51 -21.67 66.75 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.365 -0.834 . . . . 0.0 110.322 -179.094 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.543 ' C ' ' CE2' ' A' ' 44' ' ' PHE . 7.2 mt . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.211 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.608 ' O ' HG13 ' A' ' 1' ' ' VAL . 7.5 p . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.22 0.534 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.649 ' HB2' HG11 ' A' ' 23' ' ' VAL . 6.6 m -154.58 120.48 5.22 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.253 -0.905 . . . . 0.0 110.261 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.635 HD11 ' HB ' ' A' ' 20' ' ' ILE . 1.3 tt -112.21 150.79 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.487 ' HG1' ' HD1' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -116.23 161.53 18.85 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.272 -0.893 . . . . 0.0 110.204 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.0 tptt -85.09 158.62 20.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.172 -0.955 . . . . 0.0 110.186 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 75.6 m -90.13 -173.46 3.85 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.326 -0.859 . . . . 0.0 110.252 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.7 t -124.96 -152.2 0.51 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.869 . . . . 0.0 110.203 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.34 170.73 10.31 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.297 -0.877 . . . . 0.0 110.1 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.2 t70 52.68 19.57 1.29 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.244 -0.91 . . . . 0.0 110.232 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -118.15 5.33 11.98 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.333 -0.855 . . . . 0.0 110.276 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -105.84 76.21 1.17 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.203 -0.935 . . . . 0.0 110.215 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -125.87 -27.19 1.17 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.834 -1.307 . . . . 0.0 109.834 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.41 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 72.4 t80 -81.43 -52.77 6.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -1.179 . . . . 0.0 110.469 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 28.0 p -99.61 119.77 38.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.259 -0.901 . . . . 0.0 110.511 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.573 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.8 mt -90.49 -43.49 10.21 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.191 -0.943 . . . . 0.0 110.367 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 7.1 m80 -110.98 86.28 2.28 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.223 -0.923 . . . . 0.0 110.219 -179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.503 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 173.83 177.41 43.01 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -97.6 148.27 23.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.24 -1.153 . . . . 0.0 110.059 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -97.75 134.65 40.63 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.25 -0.906 . . . . 0.0 110.231 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.764 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -148.85 -172.36 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 110.048 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.487 ' HD1' ' HG1' ' A' ' 4' ' ' THR . 17.7 t80 -142.19 133.38 26.18 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.174 -0.954 . . . . 0.0 110.067 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.632 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.1 mm? -86.26 130.88 34.37 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.08 -1.012 . . . . 0.0 110.604 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.649 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.5 p -90.51 -25.7 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.265 -0.897 . . . . 0.0 110.47 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.602 ' OD1' HG13 ' A' ' 23' ' ' VAL . 22.1 m-20 -78.37 -11.69 59.96 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.106 -0.996 . . . . 0.0 108.792 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -151.18 67.9 0.92 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.017 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 25' ' ' MET . 67.2 p -29.3 90.1 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.673 0.749 . . . . 0.0 111.282 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -159.42 148.6 18.23 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.521 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 2.8 p-10 -64.04 116.71 6.15 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.247 -0.908 . . . . 0.0 110.284 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.632 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.8 t80 -105.86 138.45 42.03 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.26 -0.9 . . . . 0.0 109.775 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 6.8 m -135.55 120.64 18.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.022 -1.049 . . . . 0.0 110.702 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.503 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -94.28 119.21 32.72 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.213 -0.929 . . . . 0.0 109.524 179.303 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.531 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 91.7 m -79.45 173.82 12.2 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.304 -0.873 . . . . 0.0 110.514 -179.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.54 117.57 20.6 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.354 -0.841 . . . . 0.0 109.927 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.1 t -49.09 102.07 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.242 -0.911 . . . . 0.0 109.761 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.539 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 147.16 -12.24 1.41 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.3 167.18 21.27 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.176 -1.191 . . . . 0.0 109.698 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.932 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.95 35.0 3.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.959 -1.088 . . . . 0.0 110.91 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.25 158.99 30.39 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 39' ' ' VAL . 6.5 p -88.04 29.43 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.224 -1.162 . . . . 0.0 109.866 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -145.91 20.31 1.45 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.444 -0.785 . . . . 0.0 109.749 -179.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.531 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 6.4 p 30.55 94.56 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 CA-C-O 121.529 0.681 . . . . 0.0 111.308 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -155.07 -37.0 0.09 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.514 -0.741 . . . . 0.0 110.097 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.932 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.6 p80 -121.72 117.63 27.11 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.14 -0.975 . . . . 0.0 110.295 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 39.9 t80 -80.32 111.46 16.72 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.36 0.6 . . . . 0.0 109.991 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.532 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -74.05 -31.94 63.1 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.435 -0.791 . . . . 0.0 110.133 -179.659 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.247 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.204 0.526 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.755 ' HB3' HG11 ' A' ' 23' ' ' VAL . 29.2 t -156.32 60.39 0.56 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.283 -0.886 . . . . 0.0 110.219 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.675 HD11 ' HB ' ' A' ' 20' ' ' ILE . 5.7 tt -79.56 156.04 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.232 -0.917 . . . . 0.0 110.386 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.484 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.2 OUTLIER -124.29 -171.45 2.34 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.356 -0.84 . . . . 0.0 110.162 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 20' ' ' ILE . 14.1 mtpt -125.94 158.42 35.24 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.296 -0.877 . . . . 0.0 110.231 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.495 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 23.2 m -86.7 -150.62 0.16 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.878 . . . . 0.0 110.146 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -149.96 -155.35 0.62 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.218 -0.926 . . . . 0.0 110.125 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.9 m -90.32 27.92 1.56 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.245 -0.91 . . . . 0.0 110.124 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.444 ' OD1' ' O ' ' A' ' 9' ' ' ASP . 56.2 t0 -144.87 31.42 1.15 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.28 -0.888 . . . . 0.0 110.201 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.2 tpp -152.39 17.51 0.63 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.331 -0.856 . . . . 0.0 110.208 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -106.54 81.92 1.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -133.69 4.4 4.72 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -115.22 -56.63 2.34 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.254 -1.145 . . . . 0.0 110.113 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.581 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -96.55 116.48 29.16 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.167 -0.958 . . . . 0.0 110.516 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.621 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.3 mt -87.37 -40.36 14.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.389 -0.819 . . . . 0.0 110.129 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.9 m80 -118.0 87.22 2.67 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.317 -0.864 . . . . 0.0 110.325 -179.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.468 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -178.31 -169.28 38.92 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.445 ' O ' ' CD1' ' A' ' 20' ' ' ILE . 8.6 mm-40 -106.85 134.82 49.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.304 -1.115 . . . . 0.0 110.306 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.495 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -92.14 126.82 37.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.28 -0.887 . . . . 0.0 110.116 179.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.761 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -147.67 -169.64 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.233 -0.917 . . . . 0.0 110.511 -179.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.5 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 10.2 t80 -145.7 133.13 20.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.38 -0.825 . . . . 0.0 109.705 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.622 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.5 mm? -86.75 131.85 34.02 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.737 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.755 HG11 ' HB3' ' A' ' 2' ' ' SER . 4.5 p -90.7 -22.76 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.235 -0.915 . . . . 0.0 110.741 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -78.14 -9.51 59.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.069 -1.019 . . . . 0.0 108.893 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -157.11 71.02 0.64 Allowed 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.061 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.5 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 40.6 p -29.26 89.89 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.689 0.757 . . . . 0.0 111.227 -178.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -157.37 147.78 21.03 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.769 -0.582 . . . . 0.0 109.517 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.529 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.0 m120 -64.01 122.98 17.83 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.325 -0.86 . . . . 0.0 110.433 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.622 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.8 t80 -112.52 131.24 55.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.359 -0.838 . . . . 0.0 109.762 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.581 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.4 m -131.64 112.14 12.31 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.159 -0.963 . . . . 0.0 110.624 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.468 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 16.7 tpp85 -84.86 134.58 34.28 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.265 -0.897 . . . . 0.0 110.03 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.631 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 6.1 t -79.71 164.07 24.02 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.252 -0.905 . . . . 0.0 110.066 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 14.9 tt0 -79.58 110.69 15.14 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.285 -0.884 . . . . 0.0 109.495 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.427 ' C ' ' O ' ' A' ' 33' ' ' GLU . 37.6 t -43.36 96.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.503 -0.748 . . . . 0.0 109.719 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.842 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 151.52 -14.73 0.82 Allowed Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.581 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.4 m-85 -79.04 -178.33 6.06 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.109 -1.23 . . . . 0.0 109.826 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.672 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.3 OUTLIER -106.03 -57.37 2.05 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.036 -1.04 . . . . 0.0 110.662 -179.683 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.452 ' H ' ' CE1' ' A' ' 43' ' ' HIS . . . -85.41 152.86 26.99 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 39' ' ' VAL . 44.1 t -76.23 2.17 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.237 -1.155 . . . . 0.0 109.96 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.593 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 4.5 tmm_? -80.28 -10.0 59.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.336 -0.852 . . . . 0.0 109.878 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.631 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 11.2 m 59.95 66.9 0.92 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.392 -0.817 . . . . 0.0 110.476 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.593 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER -152.59 -28.25 0.16 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.067 -1.021 . . . . 0.0 111.965 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.672 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.1 p80 -122.78 121.21 35.74 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.56 -1.338 . . . . 0.0 111.659 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.638 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.8 t80 -80.14 110.46 15.57 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.869 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.564 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -74.93 -14.66 60.67 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.104 -0.998 . . . . 0.0 109.958 -179.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.842 HD12 ' O ' ' A' ' 35' ' ' GLY . 6.0 mt . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.275 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.439 HG12 ' OG ' ' A' ' 2' ' ' SER . 48.4 t . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.186 0.517 . . . . 0.0 110.106 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.716 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -140.46 103.77 4.62 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.343 -0.848 . . . . 0.0 110.076 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.548 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -160.19 167.88 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.291 -0.881 . . . . 0.0 110.403 -179.656 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.517 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.2 m -144.98 162.4 37.01 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.427 -0.796 . . . . 0.0 110.039 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -119.08 157.73 27.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.252 -0.905 . . . . 0.0 110.133 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 86.3 m -91.91 -124.55 0.08 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.294 -0.879 . . . . 0.0 109.976 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.2 t -146.77 -154.38 0.55 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.972 -1.08 . . . . 0.0 110.122 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -85.04 -59.04 2.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.233 -0.917 . . . . 0.0 110.338 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -83.44 11.89 6.31 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.269 -0.895 . . . . 0.0 110.356 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 8.5 tpt -100.0 -4.42 30.07 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.264 -0.898 . . . . 0.0 110.202 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.441 ' OD1' ' O ' ' A' ' 11' ' ' ASN . 39.4 t-20 -120.89 67.87 0.87 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.232 -0.918 . . . . 0.0 110.144 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.67 24.72 16.03 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.469 ' O ' ' NH1' ' A' ' 40' ' ' ARG . 7.5 t80 -110.19 -50.04 3.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.239 -1.154 . . . . 0.0 110.231 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 1.9 m -89.04 138.16 31.66 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.428 -0.795 . . . . 0.0 110.392 -179.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.578 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.6 mt -91.44 -46.96 7.71 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.564 -0.71 . . . . 0.0 110.2 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.578 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.4 m80 -119.44 91.66 3.6 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.332 -0.855 . . . . 0.0 110.217 -179.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.13 -167.13 39.64 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -127.19 164.02 22.58 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.283 -1.127 . . . . 0.0 110.272 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.84 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.4 OUTLIER -96.23 135.2 38.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.282 -0.886 . . . . 0.0 110.315 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.84 HD13 ' O ' ' A' ' 19' ' ' CYS . 17.2 mm -134.58 173.35 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.351 -0.843 . . . . 0.0 109.825 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.517 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 19.7 t80 -144.51 127.84 16.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.923 -1.111 . . . . 0.0 110.399 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.582 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.5 mm? -89.78 133.76 34.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.258 -0.901 . . . . 0.0 110.485 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.716 HG11 ' CB ' ' A' ' 2' ' ' SER . 12.6 p -90.42 -30.55 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.171 -0.955 . . . . 0.0 110.462 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.426 ' OD1' HD12 ' A' ' 22' ' ' LEU . 3.4 p30 -78.3 -18.18 55.58 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.115 -0.991 . . . . 0.0 108.814 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.503 ' O ' ' N ' ' A' ' 27' ' ' GLN . 18.0 ttt -138.13 62.27 1.57 Allowed 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.493 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.56 92.0 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 122.119 0.961 . . . . 0.0 111.148 -178.532 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.512 ' HG3' ' N ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER -159.95 147.63 16.73 Favored 'General case' 0 C--N 1.299 -1.617 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.366 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 6.5 m120 -67.52 105.85 1.97 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.263 -0.898 . . . . 0.0 110.121 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.582 ' HB2' HD23 ' A' ' 22' ' ' LEU . 5.7 t80 -87.61 90.62 8.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.424 -0.797 . . . . 0.0 110.233 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 7.5 m -82.05 115.25 21.11 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 110.553 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -94.75 111.2 22.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.205 -0.934 . . . . 0.0 110.108 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.504 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 79.4 m -79.93 178.07 8.47 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.243 -0.911 . . . . 0.0 110.376 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -80.15 146.27 31.9 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.324 -0.86 . . . . 0.0 109.854 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.414 HG12 ' O ' ' A' ' 34' ' ' VAL . 5.1 t -76.28 29.59 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.143 -0.973 . . . . 0.0 111.818 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.689 ' O ' HD12 ' A' ' 46' ' ' LEU . . . -126.52 -5.06 6.12 Favored Glycine 0 N--CA 1.487 2.044 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.577 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 15.9 m-85 -95.4 157.51 15.86 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.354 -1.086 . . . . 0.0 109.57 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.85 HG23 ' CE1' ' A' ' 43' ' ' HIS . 10.2 t -108.85 43.47 1.25 Allowed 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 118.468 -1.293 . . . . 0.0 110.633 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.84 161.5 32.84 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.515 ' O ' HG13 ' A' ' 39' ' ' VAL . 8.8 p -87.55 35.64 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.081 -1.247 . . . . 0.0 109.568 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 0.5 OUTLIER -143.1 8.11 1.63 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.472 -0.767 . . . . 0.0 110.279 -179.428 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.504 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 2.5 p 34.02 78.8 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.379 -0.826 . . . . 0.0 111.012 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 33.5 tt0 -142.24 -33.65 0.47 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.406 -0.809 . . . . 0.0 110.159 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.85 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.5 p80 -118.76 114.61 22.95 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.995 -1.065 . . . . 0.0 109.485 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.593 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 27.0 t80 -78.68 98.07 6.08 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 121.776 0.798 . . . . 0.0 109.323 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.575 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.2 OUTLIER -64.57 -9.15 17.19 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 121.751 -0.593 . . . . 0.0 110.537 -179.015 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.689 HD12 ' O ' ' A' ' 35' ' ' GLY . 8.1 mt . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 118.024 -0.989 . . . . 0.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.465 HG22 ' N ' ' A' ' 2' ' ' SER . 10.0 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.203 0.525 . . . . 0.0 110.178 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.724 ' HB3' HG11 ' A' ' 23' ' ' VAL . 3.0 t -114.09 56.43 0.71 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.266 -0.896 . . . . 0.0 110.148 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.623 HD11 ' HB ' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.79 152.22 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.278 -0.889 . . . . 0.0 110.146 179.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.47 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -124.03 -165.14 1.31 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.245 -0.909 . . . . 0.0 110.187 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -106.58 -175.33 2.76 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.232 -0.917 . . . . 0.0 110.207 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 80.5 m -105.23 -155.83 0.55 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 110.356 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -147.42 -138.31 0.09 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.278 -0.889 . . . . 0.0 110.006 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.3 4.82 14.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.054 -1.028 . . . . 0.0 110.059 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -107.19 17.55 22.79 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.324 -0.86 . . . . 0.0 109.823 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.478 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 7.0 ptm -79.49 -26.61 41.58 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.359 -0.838 . . . . 0.0 110.639 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.16 58.19 1.81 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.144 -0.972 . . . . 0.0 110.307 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -146.89 13.17 1.49 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.559 ' CE1' ' HA ' ' A' ' 40' ' ' ARG . 8.4 t80 -157.28 -57.8 0.08 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.168 -1.196 . . . . 0.0 110.312 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.3 p -107.97 114.75 28.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.192 -0.943 . . . . 0.0 110.933 -179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.614 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.2 mt -90.13 -42.48 11.05 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.435 -0.791 . . . . 0.0 109.886 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.614 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -111.26 76.91 1.0 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.231 -0.918 . . . . 0.0 110.134 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -172.46 179.5 43.97 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.476 ' HB2' ' HB3' ' A' ' 31' ' ' ARG . 1.0 OUTLIER -93.39 148.07 22.39 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.3 -1.118 . . . . 0.0 110.186 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -109.07 121.02 44.26 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.271 -0.893 . . . . 0.0 110.371 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.769 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -144.3 179.52 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.385 -0.822 . . . . 0.0 110.087 -179.819 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 20.9 t80 -127.48 133.68 49.87 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.146 -0.971 . . . . 0.0 110.124 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.719 HD23 ' CB ' ' A' ' 29' ' ' TYR . 0.6 OUTLIER -89.17 133.58 34.35 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.243 -0.911 . . . . 0.0 110.545 -179.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.724 HG11 ' HB3' ' A' ' 2' ' ' SER . 8.8 p -90.24 -26.34 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.238 -0.914 . . . . 0.0 110.44 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -78.56 -15.72 58.24 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.056 -1.028 . . . . 0.0 108.821 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -145.47 65.93 1.23 Allowed 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.829 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.494 ' C ' ' O ' ' A' ' 25' ' ' MET . 32.5 p -29.02 89.21 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 CA-C-O 121.648 0.737 . . . . 0.0 111.464 -178.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.3 OUTLIER -159.8 170.14 22.11 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.671 -0.643 . . . . 0.0 109.552 179.731 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.52 100.85 8.78 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.306 -0.871 . . . . 0.0 110.351 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.719 ' CB ' HD23 ' A' ' 22' ' ' LEU . 12.2 t80 -86.99 130.14 34.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.327 -0.858 . . . . 0.0 109.453 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.579 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 7.6 m -130.55 116.75 18.58 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.875 -1.14 . . . . 0.0 110.855 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.476 ' HB3' ' HB2' ' A' ' 18' ' ' GLN . 8.0 tpp85 -79.23 128.68 33.61 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.132 -0.98 . . . . 0.0 109.113 179.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.623 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 5.7 m -79.67 159.0 26.87 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.15 -0.969 . . . . 0.0 110.133 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 34' ' ' VAL . 31.3 tt0 -78.36 107.85 11.29 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.258 -0.901 . . . . 0.0 109.166 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.442 ' H ' HG23 ' A' ' 34' ' ' VAL . 39.6 t -40.99 101.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 121.697 -0.627 . . . . 0.0 110.436 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.84 ' O ' HD23 ' A' ' 46' ' ' LEU . . . 140.76 -8.42 2.79 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.565 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -84.79 173.01 11.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.029 -1.277 . . . . 0.0 110.486 -179.798 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.916 HG23 ' CE1' ' A' ' 43' ' ' HIS . 3.9 t -127.57 38.37 4.06 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 118.895 -1.122 . . . . 0.0 111.155 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.534 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -151.35 155.16 25.99 Favored Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.417 -1.373 . . . . 0.0 109.976 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.64 HG12 ' O ' ' A' ' 39' ' ' VAL . 79.6 t -83.55 12.68 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.379 -1.071 . . . . 0.0 109.844 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.574 ' N ' ' CD ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -123.26 -7.74 8.19 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.412 -0.805 . . . . 0.0 109.431 179.638 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.623 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 26.8 m 58.77 65.73 1.18 Allowed 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -178.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -135.32 -30.83 1.01 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.561 -0.712 . . . . 0.0 110.868 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.916 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.1 p80 -120.2 123.75 44.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.756 -1.215 . . . . 0.0 111.349 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.619 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 43.9 t80 -86.7 104.25 15.92 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.382 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.93 ' CE2' HD11 ' A' ' 46' ' ' LEU . 0.2 OUTLIER -71.82 -3.19 20.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.396 -0.815 . . . . 0.0 110.163 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.93 HD11 ' CE2' ' A' ' 45' ' ' PHE . 2.1 mm? . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.344 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.42 HG13 ' OG ' ' A' ' 2' ' ' SER . 9.8 p . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.174 0.511 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.469 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 3.2 m -148.52 43.27 1.01 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.171 -0.955 . . . . 0.0 110.356 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.821 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -141.56 122.66 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.138 -0.976 . . . . 0.0 110.659 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.533 ' HB ' ' CB ' ' A' ' 21' ' ' TYR . 4.2 m -90.96 167.28 12.52 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.387 -0.821 . . . . 0.0 109.765 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -122.34 169.29 11.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.274 -0.891 . . . . 0.0 110.13 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 62.8 m -110.61 -144.33 0.39 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.31 -0.869 . . . . 0.0 110.18 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 t -139.84 -166.27 2.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.229 -0.919 . . . . 0.0 110.111 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.18 7.48 13.53 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.208 -0.933 . . . . 0.0 110.283 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.12 25.81 10.07 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.213 -0.929 . . . . 0.0 110.224 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.436 ' SD ' ' SG ' ' A' ' 6' ' ' CYS . 31.8 ttm -144.67 28.11 1.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.225 -0.922 . . . . 0.0 110.196 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -110.42 27.6 9.47 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.243 -0.91 . . . . 0.0 110.167 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.15 -17.28 79.53 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -83.63 -50.08 8.55 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.251 -1.146 . . . . 0.0 110.327 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -105.79 120.9 42.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.254 -0.904 . . . . 0.0 110.408 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.59 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.6 mt -90.31 -42.29 11.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.336 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.1 m80 -111.17 86.45 2.32 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.173 -0.955 . . . . 0.0 110.1 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.456 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 168.93 -163.0 36.8 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -123.62 152.87 41.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.306 -1.114 . . . . 0.0 110.06 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 6.8 t -92.16 146.88 23.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.0 110.282 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.822 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -153.43 -174.08 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.278 -0.889 . . . . 0.0 109.803 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.533 ' CB ' ' HB ' ' A' ' 4' ' ' THR . 27.0 t80 -148.7 130.49 15.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.077 -1.015 . . . . 0.0 109.835 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.696 HD22 HD12 ' A' ' 3' ' ' ILE . 1.6 mm? -92.14 132.52 36.55 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.036 -1.04 . . . . 0.0 111.041 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.469 ' HB ' ' O ' ' A' ' 2' ' ' SER . 6.1 t -90.74 -27.22 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.33 -0.856 . . . . 0.0 110.382 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -77.52 -19.9 55.06 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.986 -1.072 . . . . 0.0 108.393 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.529 ' O ' ' N ' ' A' ' 27' ' ' GLN . 19.9 mtm -141.99 62.04 1.44 Allowed 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.487 ' C ' ' O ' ' A' ' 25' ' ' MET . 2.6 p -29.18 89.76 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.803 0.811 . . . . 0.0 111.494 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.529 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.32 147.85 17.91 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.734 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 5.9 m-80 -57.13 129.55 42.25 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.152 -0.967 . . . . 0.0 110.379 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.822 ' CD1' HD12 ' A' ' 20' ' ' ILE . 6.6 t80 -120.75 107.97 13.4 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.523 -0.736 . . . . 0.0 109.831 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 4.5 m -113.03 112.71 24.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.118 -0.988 . . . . 0.0 110.409 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.456 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 7.2 tpm_? -79.66 116.78 20.05 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.216 -0.928 . . . . 0.0 109.69 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.485 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 96.8 m -79.26 175.61 10.43 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.226 -0.921 . . . . 0.0 110.021 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -79.25 110.93 14.98 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.229 -0.919 . . . . 0.0 109.724 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.422 ' H ' HG23 ' A' ' 34' ' ' VAL . 39.1 t -44.77 101.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.396 -0.815 . . . . 0.0 109.672 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 146.2 -8.66 1.46 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.478 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.02 176.67 9.44 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.915 -1.344 . . . . 0.0 109.895 -179.967 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.606 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -113.99 28.69 8.56 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.897 -1.127 . . . . 0.0 110.472 -179.724 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -158.15 156.27 27.22 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.578 ' O ' HG13 ' A' ' 39' ' ' VAL . 10.0 p -84.63 42.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.326 -1.102 . . . . 0.0 109.839 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.581 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.27 22.93 0.16 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.341 -0.849 . . . . 0.0 109.849 -179.476 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.501 ' C ' ' O ' ' A' ' 40' ' ' ARG . 5.4 p 28.33 93.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.664 -0.647 . . . . 0.0 111.676 179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.581 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 13.4 tm-20 -154.81 -42.1 0.09 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.39 -0.819 . . . . 0.0 110.067 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.606 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.9 p-80 -118.53 128.35 54.49 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.099 -1.001 . . . . 0.0 110.419 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.611 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 36.8 t80 -87.78 128.08 35.32 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.422 0.63 . . . . 0.0 110.16 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.582 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -89.43 -37.33 14.89 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.387 -0.82 . . . . 0.0 110.087 -179.477 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.611 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.001 -0.999 . . . . 0.0 110.151 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 46.2 t . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.183 0.516 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.481 ' HB2' HG11 ' A' ' 23' ' ' VAL . 6.5 m -103.31 90.49 3.72 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.348 -0.845 . . . . 0.0 110.192 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 1.121 ' CD1' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -107.67 140.85 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 110.098 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.482 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -107.35 170.64 7.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 110.151 179.892 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -104.99 171.82 7.11 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.186 -0.947 . . . . 0.0 110.232 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.468 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 62.5 m -90.6 -143.62 0.17 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.287 -0.883 . . . . 0.0 110.106 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.5 p -158.17 -72.72 0.09 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.235 -0.916 . . . . 0.0 110.328 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.0 m -154.39 -75.14 0.11 Allowed 'General case' 0 C--N 1.292 -1.9 0 O-C-N 121.666 -0.646 . . . . 0.0 110.162 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -62.26 -12.1 18.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.881 . . . . 0.0 110.231 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.1 tpt -91.38 19.41 6.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.202 -0.936 . . . . 0.0 110.185 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.426 ' OD1' ' HB3' ' A' ' 6' ' ' CYS . 4.4 m-20 -126.39 81.09 1.97 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.285 -0.884 . . . . 0.0 110.221 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.09 59.92 0.43 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.535 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 63.8 t80 -160.11 -55.43 0.06 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.283 -1.128 . . . . 0.0 110.253 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.4 p -96.46 118.92 33.98 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.3 -0.875 . . . . 0.0 110.567 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.541 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.1 mt -90.66 -47.37 7.7 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.259 -0.901 . . . . 0.0 110.215 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.576 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 10.1 m80 -106.78 82.28 1.68 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.37 -0.831 . . . . 0.0 110.201 -179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.488 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 178.08 -171.02 43.44 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.4 mm-40 -109.36 133.48 53.01 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.198 -1.177 . . . . 0.0 110.168 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.587 ' C ' HG23 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -87.61 135.18 33.46 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.315 -0.865 . . . . 0.0 110.184 179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.121 HD12 ' CD1' ' A' ' 3' ' ' ILE . 26.9 pt -157.46 -168.07 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.214 -0.929 . . . . 0.0 110.235 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.56 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 8.4 t80 -141.3 139.44 33.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.209 -0.932 . . . . 0.0 110.004 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.747 HD23 ' CB ' ' A' ' 29' ' ' TYR . 0.7 OUTLIER -94.92 137.39 34.05 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.229 -0.919 . . . . 0.0 110.979 -179.525 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.481 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.3 p -90.14 -27.23 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.346 -0.846 . . . . 0.0 110.371 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.409 ' O ' ' SD ' ' A' ' 25' ' ' MET . 42.1 t0 -78.36 -15.42 58.72 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.165 -0.959 . . . . 0.0 108.814 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.2 OUTLIER -145.08 65.03 1.27 Allowed 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 179.01 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.56 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 49.7 p -29.41 87.72 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 121.623 0.725 . . . . 0.0 111.753 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 25' ' ' MET . 4.1 pt20 -160.89 175.79 12.14 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.584 -0.698 . . . . 0.0 109.544 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -82.18 111.24 18.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 110.339 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 1.094 ' CD1' HD11 ' A' ' 20' ' ' ILE . 10.0 t80 -100.11 118.75 37.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.343 -0.848 . . . . 0.0 109.706 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 20.7 m -119.66 111.51 18.13 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.06 -1.025 . . . . 0.0 110.641 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.488 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 13.5 tpp180 -81.03 117.88 22.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.195 -0.94 . . . . 0.0 109.485 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.48 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 98.0 m -79.37 170.47 16.55 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 110.349 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -79.61 114.0 18.2 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.322 -0.861 . . . . 0.0 110.183 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.401 HG23 ' H ' ' A' ' 34' ' ' VAL . 44.2 t -47.21 100.86 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.328 -0.858 . . . . 0.0 109.802 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 149.47 -13.37 1.05 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.711 -1.356 . . . . 0.0 109.711 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.2 m-85 -79.19 170.43 16.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.2 -1.177 . . . . 0.0 109.631 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.901 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -109.98 32.79 4.83 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.829 -1.169 . . . . 0.0 110.886 -179.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.65 159.9 31.37 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 39' ' ' VAL . 10.0 p -88.8 33.59 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.234 -1.156 . . . . 0.0 109.482 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.6 OUTLIER -142.91 17.89 1.96 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.461 -0.774 . . . . 0.0 109.595 -179.602 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.515 ' C ' ' O ' ' A' ' 40' ' ' ARG . 2.2 p 27.83 86.81 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.123 0 CA-C-O 121.442 0.639 . . . . 0.0 111.131 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 12.4 tm-20 -151.81 -34.79 0.13 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.451 -0.781 . . . . 0.0 110.4 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.901 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.2 p80 -120.91 117.64 27.85 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.034 -1.041 . . . . 0.0 110.364 179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.617 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 28.0 t80 -80.23 109.38 14.65 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.313 0.578 . . . . 0.0 109.991 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.567 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -70.45 -16.69 62.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.91 . . . . 0.0 109.682 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.617 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.7 mt . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.279 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.755 ' O ' HG13 ' A' ' 1' ' ' VAL . 9.5 p . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.212 0.529 . . . . 0.0 110.235 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.532 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER -139.01 177.69 7.71 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.335 -0.853 . . . . 0.0 109.91 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 1.097 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -155.78 165.13 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.347 -0.846 . . . . 0.0 110.209 -179.887 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.485 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 2.8 m -142.13 166.02 25.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.938 . . . . 0.0 110.027 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -85.72 163.21 18.37 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -0.875 . . . . 0.0 110.265 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.789 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 21.3 m -93.92 -145.17 0.24 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.231 -0.918 . . . . 0.0 110.209 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.0 t -151.94 -150.2 0.33 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 110.092 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.436 ' O ' ' N ' ' A' ' 10' ' ' MET . 0.3 OUTLIER -84.37 168.71 15.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.291 -0.88 . . . . 0.0 110.209 179.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 8' ' ' SER . 0.4 OUTLIER 42.12 27.15 0.07 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.267 -0.896 . . . . 0.0 110.231 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.452 ' SD ' ' HB3' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -122.68 -4.15 8.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.176 -0.953 . . . . 0.0 110.229 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -116.84 69.73 0.76 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.276 -0.89 . . . . 0.0 110.209 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -129.82 29.56 3.73 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.533 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 47.0 t80 -124.47 -57.25 1.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.333 -1.098 . . . . 0.0 110.295 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 26.7 p -91.45 122.75 34.32 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.283 -0.885 . . . . 0.0 110.34 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.553 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 5.6 mt -90.44 -45.46 8.97 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.259 -0.901 . . . . 0.0 110.238 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.553 ' ND1' ' HB2' ' A' ' 15' ' ' LEU . 7.1 m80 -109.07 87.44 2.49 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.309 -0.869 . . . . 0.0 110.159 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.488 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 177.98 -175.58 47.57 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -107.99 137.83 45.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.204 -1.174 . . . . 0.0 110.253 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.789 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 1.5 t -86.72 139.6 30.59 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.259 -0.901 . . . . 0.0 110.225 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.097 HD12 HD11 ' A' ' 3' ' ' ILE . 24.2 pt -157.33 -173.19 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.249 -0.907 . . . . 0.0 109.96 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.485 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 5.7 t80 -144.64 128.54 17.41 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.141 -0.975 . . . . 0.0 110.306 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.659 HD11 ' HD2' ' A' ' 29' ' ' TYR . 15.9 mt -79.54 133.55 36.47 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.339 -0.851 . . . . 0.0 110.779 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.532 HG11 ' HB3' ' A' ' 2' ' ' SER . 12.4 p -89.5 -30.91 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.889 . . . . 0.0 109.916 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -78.49 -20.07 51.65 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.136 -0.978 . . . . 0.0 108.684 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.558 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.0 mtm -136.78 61.72 1.62 Allowed 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 25' ' ' MET . 35.0 p -29.37 87.68 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 CA-C-O 121.7 0.762 . . . . 0.0 111.508 -178.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -160.64 148.17 15.89 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.48 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.7 t30 -62.62 114.97 3.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.196 -0.94 . . . . 0.0 110.304 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 1.07 ' CD1' HD11 ' A' ' 20' ' ' ILE . 4.1 t80 -106.54 121.78 44.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.408 -0.808 . . . . 0.0 109.687 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.609 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 19.9 m -117.52 112.12 20.17 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.078 -1.014 . . . . 0.0 110.478 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.488 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 1.9 tpp180 -81.89 117.52 22.21 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.207 -0.933 . . . . 0.0 109.635 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.463 ' HB3' ' HB3' ' A' ' 41' ' ' CYS . 65.8 m -79.36 170.85 15.99 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.229 -0.919 . . . . 0.0 110.488 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -79.46 113.16 17.38 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.335 -0.853 . . . . 0.0 110.194 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.5 t -48.67 106.71 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.44 -0.787 . . . . 0.0 109.955 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.26 -10.92 2.26 Favored Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -79.53 177.14 9.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.177 -1.19 . . . . 0.0 109.975 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.691 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -110.12 -43.26 3.99 Favored 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 118.732 -1.187 . . . . 0.0 111.21 -179.524 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.59 158.79 43.68 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.269 -1.532 . . . . 0.0 109.269 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.761 HG12 ' O ' ' A' ' 39' ' ' VAL . 80.9 t -84.7 44.45 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.247 -1.149 . . . . 0.0 109.513 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.575 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.28 26.65 0.17 Allowed 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.481 -0.762 . . . . 0.0 109.61 -179.372 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 10.9 p 30.78 93.12 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.512 -0.743 . . . . 0.0 111.335 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 6.6 tm-20 -160.17 -42.7 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 110.388 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.691 ' CE1' HG23 ' A' ' 37' ' ' THR . 0.2 OUTLIER -120.1 136.73 54.49 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 122.177 0.989 . . . . 0.0 110.8 -179.76 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 69.4 t80 -97.32 137.09 36.85 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.142 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.592 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -121.77 13.11 10.69 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 110.605 -179.431 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.6 mt . . . . . 0 N--CA 1.492 1.639 0 O-C-N 120.938 -1.101 . . . . 0.0 110.303 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 34.2 m . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 121.325 0.584 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.508 ' HB3' HG21 ' A' ' 23' ' ' VAL . 4.9 t -157.05 71.08 0.65 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.264 -0.897 . . . . 0.0 110.11 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.789 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.73 150.8 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.91 . . . . 0.0 110.34 -179.78 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.493 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.3 m -131.41 170.74 14.25 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.388 -0.82 . . . . 0.0 110.205 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -109.26 179.6 4.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.214 -0.929 . . . . 0.0 110.185 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.3 m -106.92 -154.58 0.52 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 110.355 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.0 t -136.23 -145.72 0.22 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.095 -1.003 . . . . 0.0 110.647 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 41.2 t -79.79 -70.67 0.5 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.31 -0.869 . . . . 0.0 110.421 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -76.33 2.96 11.96 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.264 -0.897 . . . . 0.0 110.366 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.18 14.95 25.88 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.13 -0.981 . . . . 0.0 110.191 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -140.95 120.08 12.87 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.31 -0.869 . . . . 0.0 110.245 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.48 62.57 0.19 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.593 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 52.1 t80 -151.45 -57.11 0.15 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.273 -1.134 . . . . 0.0 110.145 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.542 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 23.5 p -85.66 124.85 32.66 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.263 -0.898 . . . . 0.0 110.319 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.6 mt -89.99 -42.53 11.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.273 -0.892 . . . . 0.0 110.256 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.597 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.7 m80 -113.91 92.85 4.12 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.281 -0.887 . . . . 0.0 110.147 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.48 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 167.53 -132.6 2.64 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.439 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 0.8 OUTLIER -158.81 149.49 19.98 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -1.103 . . . . 0.0 110.285 -179.945 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -89.68 146.2 24.69 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.297 -0.877 . . . . 0.0 110.364 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.789 HG22 ' CG1' ' A' ' 3' ' ' ILE . 1.1 mt -153.03 -166.54 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.296 -0.877 . . . . 0.0 109.579 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.493 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 16.7 t80 -152.65 125.7 8.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.088 -1.007 . . . . 0.0 110.135 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.692 HD22 HD12 ' A' ' 3' ' ' ILE . 1.3 mm? -88.44 132.22 34.56 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.2 -0.937 . . . . 0.0 110.611 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.508 HG21 ' HB3' ' A' ' 2' ' ' SER . 9.4 p -90.38 -24.11 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.243 -0.911 . . . . 0.0 110.462 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.51 -13.69 59.71 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.107 -0.996 . . . . 0.0 108.703 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.537 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.0 tpp -150.0 67.88 0.99 Allowed 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 25' ' ' MET . 12.5 p -29.28 89.44 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.715 0.769 . . . . 0.0 111.536 -178.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.11 147.85 16.58 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.725 -0.609 . . . . 0.0 109.377 179.9 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.515 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 10.8 m-20 -59.79 127.92 34.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.157 -0.964 . . . . 0.0 110.248 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.782 ' CD1' HD12 ' A' ' 20' ' ' ILE . 8.7 t80 -117.82 109.94 17.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.269 -0.894 . . . . 0.0 110.207 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.542 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -112.76 110.23 20.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.23 -0.919 . . . . 0.0 110.163 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.48 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -81.4 123.76 28.84 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.23 -0.919 . . . . 0.0 109.817 179.585 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.525 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 78.7 m -79.73 178.58 8.06 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.324 -0.86 . . . . 0.0 110.251 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -80.69 114.74 19.79 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.25 -0.906 . . . . 0.0 110.176 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.419 HG23 ' H ' ' A' ' 34' ' ' VAL . 42.4 t -47.33 103.0 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.334 -0.854 . . . . 0.0 109.796 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.752 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 145.4 -11.46 1.77 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.579 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.9 OUTLIER -79.54 167.38 20.84 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.127 -1.219 . . . . 0.0 109.923 179.994 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.931 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -108.21 33.96 3.86 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.048 -1.032 . . . . 0.0 110.555 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.5 156.32 27.6 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.48 ' O ' HG22 ' A' ' 39' ' ' VAL . 7.6 p -87.51 33.27 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.2 -1.176 . . . . 0.0 109.834 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.593 ' HG3' ' CE1' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -148.68 20.02 1.03 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.349 -0.845 . . . . 0.0 109.677 -179.65 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.525 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 7.1 p 30.77 94.42 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.65 0.738 . . . . 0.0 111.603 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 6.2 tm-20 -153.8 -36.69 0.1 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.551 -0.718 . . . . 0.0 109.96 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.931 ' CE1' HG23 ' A' ' 37' ' ' THR . 4.8 p80 -122.82 116.28 23.41 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.233 -0.917 . . . . 0.0 109.624 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.626 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 23.9 t80 -79.62 107.94 12.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.763 -0.586 . . . . 0.0 110.486 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.559 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -67.43 -30.55 70.32 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.397 -0.814 . . . . 0.0 109.428 179.663 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.752 HD12 ' O ' ' A' ' 35' ' ' GLY . 4.5 mt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.188 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.525 ' O ' HG13 ' A' ' 1' ' ' VAL . 2.6 p . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.229 0.537 . . . . 0.0 110.234 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.875 ' HB2' HG11 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -136.23 137.77 41.15 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.204 -0.935 . . . . 0.0 110.225 179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.794 ' CG1' HG22 ' A' ' 20' ' ' ILE . 1.1 tp -144.18 154.47 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.305 -0.872 . . . . 0.0 110.16 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.506 ' O ' ' N ' ' A' ' 21' ' ' TYR . 3.1 m -140.47 168.19 20.37 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.262 -0.898 . . . . 0.0 110.119 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.44 179.55 6.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.176 -0.953 . . . . 0.0 110.302 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 86.4 m -105.22 164.76 11.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.262 -0.898 . . . . 0.0 110.276 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.8 t -102.34 -152.38 0.44 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.326 -0.859 . . . . 0.0 110.141 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.414 ' O ' ' N ' ' A' ' 10' ' ' MET . 0.8 OUTLIER -83.81 171.55 13.02 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.34 -0.85 . . . . 0.0 110.076 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 8' ' ' SER . 3.0 t0 42.42 27.87 0.1 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.185 -0.947 . . . . 0.0 110.191 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.414 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -126.21 3.99 7.1 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.276 -0.89 . . . . 0.0 110.15 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -110.35 86.73 2.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.263 -0.898 . . . . 0.0 110.265 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.01 64.64 0.39 Allowed Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -154.19 -60.62 0.13 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.263 -1.139 . . . . 0.0 110.165 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 40' ' ' ARG . 25.4 p -96.28 117.18 30.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.278 -0.889 . . . . 0.0 110.43 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.589 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 13.3 mt -69.22 -42.66 75.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.49 -0.756 . . . . 0.0 109.784 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.3 m80 -117.25 80.63 1.52 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.439 -0.788 . . . . 0.0 110.388 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.416 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -177.33 152.76 12.39 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.211 -1.556 . . . . 0.0 109.211 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.545 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -80.85 169.81 17.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.125 -1.22 . . . . 0.0 110.563 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.602 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -107.22 130.12 54.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.241 -0.912 . . . . 0.0 110.798 -179.579 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.894 HD13 ' HD2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -132.79 -165.89 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.363 -0.836 . . . . 0.0 109.494 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.506 ' N ' ' O ' ' A' ' 4' ' ' THR . 12.5 t80 -149.57 135.16 18.49 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.054 -1.029 . . . . 0.0 109.871 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.59 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.2 mm? -95.77 134.05 39.16 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.15 -0.969 . . . . 0.0 111.234 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.875 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.0 p -90.73 -25.16 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.434 -0.791 . . . . 0.0 110.385 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.88 -14.53 59.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.096 -1.003 . . . . 0.0 108.82 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.548 ' O ' ' N ' ' A' ' 27' ' ' GLN . 5.5 ttm -147.31 67.38 1.14 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 25' ' ' MET . 17.2 p -29.81 87.68 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.599 0.714 . . . . 0.0 111.922 -178.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.0 OUTLIER -157.83 170.67 21.81 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.67 -0.644 . . . . 0.0 109.782 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -79.4 125.18 29.2 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.413 -0.804 . . . . 0.0 110.582 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.894 ' HD2' HD13 ' A' ' 20' ' ' ILE . 30.1 t80 -105.7 167.49 9.73 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.392 -0.817 . . . . 0.0 109.46 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.493 ' HA ' ' CD1' ' A' ' 20' ' ' ILE . 2.4 m -152.13 117.66 5.35 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.028 -1.045 . . . . 0.0 110.683 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.883 ' H ' HD11 ' A' ' 20' ' ' ILE . 4.8 tpp85 -84.89 125.79 32.93 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.104 -0.998 . . . . 0.0 108.896 179.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.3 m -79.69 163.62 24.39 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.129 -0.982 . . . . 0.0 110.334 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.508 ' O ' ' N ' ' A' ' 35' ' ' GLY . 10.2 tt0 -78.19 111.91 14.62 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.754 -0.779 . . . . 0.0 109.287 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.434 ' C ' ' O ' ' A' ' 33' ' ' GLU . 35.3 t -41.86 94.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.578 -0.701 . . . . 0.0 109.985 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.642 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 153.73 -17.2 0.65 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 -179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.565 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.6 m-85 -79.37 167.92 20.2 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.081 -1.247 . . . . 0.0 109.92 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.918 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -113.86 37.01 3.41 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.139 -1.025 . . . . 0.0 110.924 -179.491 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.91 157.38 28.87 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.7 p -88.99 27.56 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.277 -1.131 . . . . 0.0 109.551 179.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.566 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 12.1 ttp180 -127.16 -18.87 4.46 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.539 -0.726 . . . . 0.0 110.276 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.7 m 68.45 78.83 0.22 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.156 -0.965 . . . . 0.0 109.829 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.566 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -152.18 -32.56 0.14 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.473 -0.767 . . . . 0.0 110.984 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.918 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.6 p80 -123.17 118.95 28.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.894 -1.129 . . . . 0.0 110.922 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 40.6 t80 -81.64 105.18 12.58 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.322 0.582 . . . . 0.0 109.798 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.522 ' CD1' ' C ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -64.78 -27.37 68.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.288 -0.883 . . . . 0.0 110.095 -179.567 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.642 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.7 mt . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.348 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.467 ' O ' HG12 ' A' ' 1' ' ' VAL . 59.2 t . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.195 0.521 . . . . 0.0 110.218 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.9 t -154.89 138.91 16.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.246 -0.909 . . . . 0.0 110.41 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.547 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.9 tt -121.19 152.79 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.315 -0.865 . . . . 0.0 110.063 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.482 ' CB ' ' HB3' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -110.01 169.69 8.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.902 . . . . 0.0 110.271 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -117.87 159.69 22.67 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.285 -0.884 . . . . 0.0 110.103 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.51 ' CB ' ' HG ' ' A' ' 19' ' ' CYS . 61.4 m -110.65 -151.26 0.47 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.113 -0.992 . . . . 0.0 110.34 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.7 t -152.99 -151.07 0.36 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.291 -0.88 . . . . 0.0 110.086 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.42 ' O ' ' C ' ' A' ' 9' ' ' ASP . 79.2 p -86.99 165.38 15.89 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.182 -0.949 . . . . 0.0 110.119 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.42 ' C ' ' O ' ' A' ' 8' ' ' SER . 2.2 m-20 41.48 31.01 0.16 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.214 -0.929 . . . . 0.0 110.301 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.78 -14.38 9.01 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.344 -0.847 . . . . 0.0 110.362 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -148.65 107.4 3.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.0 110.428 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -104.44 52.82 0.72 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.336 -1.506 . . . . 0.0 109.336 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -126.58 -55.37 1.42 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -1.106 . . . . 0.0 110.447 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.3 p -96.59 117.23 30.52 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.132 -0.98 . . . . 0.0 110.619 -179.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.621 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 14.4 mt -82.26 -39.52 22.89 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.365 -0.835 . . . . 0.0 109.839 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.6 m80 -121.41 84.35 2.23 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.443 -0.786 . . . . 0.0 110.243 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -177.02 175.8 47.82 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -93.22 141.49 28.37 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.269 -1.136 . . . . 0.0 110.276 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.518 ' C ' HD13 ' A' ' 20' ' ' ILE . 7.9 t -98.79 124.12 43.46 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.353 -0.842 . . . . 0.0 110.144 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.826 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.55 -173.7 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.389 -0.82 . . . . 0.0 110.141 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.482 ' HB3' ' CB ' ' A' ' 4' ' ' THR . 10.8 t80 -138.99 136.53 35.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.832 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.651 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.3 mm? -92.41 133.94 35.41 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.02 -1.05 . . . . 0.0 111.009 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.1 p -90.46 -27.7 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.356 -0.84 . . . . 0.0 110.563 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -78.36 -17.79 56.0 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.082 -1.011 . . . . 0.0 108.964 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.548 ' O ' ' N ' ' A' ' 27' ' ' GLN . 14.8 mtt -142.62 64.9 1.36 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.48 ' C ' ' O ' ' A' ' 25' ' ' MET . 11.8 p -29.18 88.69 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.716 0.769 . . . . 0.0 111.553 -178.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.7 pt20 -160.32 171.8 18.48 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.655 -0.653 . . . . 0.0 109.636 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -80.08 122.7 27.1 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.385 -0.822 . . . . 0.0 110.478 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.651 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.3 t80 -113.07 129.75 56.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.507 -0.746 . . . . 0.0 109.429 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.7 m -129.84 113.32 14.52 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.99 -1.069 . . . . 0.0 110.874 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -79.57 133.38 36.45 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.282 -0.886 . . . . 0.0 109.097 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 10.8 m -78.99 160.26 27.27 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.235 -0.916 . . . . 0.0 109.985 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.516 ' O ' ' N ' ' A' ' 35' ' ' GLY . 12.1 tt0 -78.54 112.99 16.17 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.294 -0.879 . . . . 0.0 109.023 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.436 ' C ' ' O ' ' A' ' 33' ' ' GLU . 24.0 t -40.76 94.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.586 -0.696 . . . . 0.0 110.3 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.901 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 153.41 -18.89 0.7 Allowed Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 3.6 m-85 -82.2 166.19 19.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -1.162 . . . . 0.0 109.902 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.972 HG23 ' CE1' ' A' ' 43' ' ' HIS . 9.1 t -121.38 47.81 1.78 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.973 -1.079 . . . . 0.0 111.158 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.63 157.62 29.07 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.7 p -88.59 23.83 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.345 -1.091 . . . . 0.0 109.421 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.588 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 11.2 ttp180 -126.51 -19.66 4.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.578 -0.701 . . . . 0.0 110.291 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.8 m 68.18 68.54 0.33 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.12 -0.987 . . . . 0.0 110.263 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.588 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 5.3 tm-20 -137.99 -27.87 0.89 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.367 -0.833 . . . . 0.0 110.992 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.972 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.4 p80 -126.95 121.82 32.81 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.762 -1.211 . . . . 0.0 111.111 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.627 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.3 t80 -83.16 101.18 11.03 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.54 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.1 OUTLIER -64.31 -14.33 55.4 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.208 -0.933 . . . . 0.0 110.149 -179.362 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.901 HD12 ' O ' ' A' ' 35' ' ' GLY . 6.9 mt . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.228 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.64 ' O ' HG13 ' A' ' 1' ' ' VAL . 11.3 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.258 0.551 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.851 ' N ' HG11 ' A' ' 23' ' ' VAL . 2.8 m -92.16 105.11 17.41 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.224 -0.923 . . . . 0.0 110.646 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.828 HD11 ' CG2' ' A' ' 20' ' ' ILE . 0.9 OUTLIER -80.11 164.6 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.245 -0.91 . . . . 0.0 109.873 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.544 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 2.3 m -148.7 166.34 28.67 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.11 -0.994 . . . . 0.0 110.259 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.65 162.02 13.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.234 -0.916 . . . . 0.0 110.163 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.8 m -93.19 -150.25 0.28 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.266 -0.896 . . . . 0.0 110.194 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 t -147.37 -155.42 0.62 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.264 -0.898 . . . . 0.0 110.22 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.34 172.11 14.19 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.29 -0.881 . . . . 0.0 110.205 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.5 t0 47.83 23.71 0.49 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.218 -0.926 . . . . 0.0 110.276 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.14 9.65 6.26 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.255 -0.903 . . . . 0.0 110.234 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.403 ' OD1' ' SG ' ' A' ' 14' ' ' CYS . 0.9 OUTLIER -119.52 76.84 1.16 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -0.912 . . . . 0.0 110.402 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -121.74 -8.95 7.21 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -91.67 -49.19 6.42 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.252 -1.146 . . . . 0.0 110.165 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.581 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.0 p -101.46 121.13 41.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.405 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.601 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.4 mt -90.03 -40.18 12.47 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -0.927 . . . . 0.0 110.402 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.601 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.6 m80 -114.19 89.93 3.22 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.204 -0.935 . . . . 0.0 110.12 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 171.1 -167.1 40.27 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -117.68 162.85 17.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.368 -1.078 . . . . 0.0 110.298 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.879 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -98.16 137.97 36.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.262 -0.899 . . . . 0.0 110.185 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.879 HD13 ' O ' ' A' ' 19' ' ' CYS . 15.9 mm -142.38 172.71 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.319 -0.863 . . . . 0.0 110.169 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.544 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 32.1 t80 -134.4 136.02 43.02 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.103 -0.998 . . . . 0.0 109.849 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.562 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 3.4 mm? -99.54 132.37 44.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.019 -1.051 . . . . 0.0 111.043 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.851 HG11 ' N ' ' A' ' 2' ' ' SER . 11.5 p -90.77 -24.58 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.6 -0.688 . . . . 0.0 110.722 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -78.05 -15.14 59.17 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.027 -1.046 . . . . 0.0 108.801 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.544 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -147.17 67.17 1.14 Allowed 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.641 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.492 ' C ' ' O ' ' A' ' 25' ' ' MET . 61.9 p -28.97 88.63 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.762 0.792 . . . . 0.0 111.403 -178.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.65 149.0 16.36 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.974 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.528 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.5 t30 -59.3 157.33 11.02 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.303 -0.873 . . . . 0.0 109.886 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.582 ' CD1' ' N ' ' A' ' 30' ' ' CYS . 12.9 t80 -138.87 159.77 41.34 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.312 -0.867 . . . . 0.0 109.699 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.582 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 28.6 m -153.47 107.61 3.06 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.07 -1.019 . . . . 0.0 110.595 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.483 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 1.3 tpp180 -82.43 121.35 26.62 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.252 -0.905 . . . . 0.0 109.468 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.519 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 75.8 m -79.46 170.75 16.12 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.219 -0.926 . . . . 0.0 110.549 -179.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -79.51 114.47 18.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.399 -0.813 . . . . 0.0 110.052 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 47.2 t -47.54 103.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.392 -0.818 . . . . 0.0 109.75 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 145.93 -10.66 1.62 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.766 -1.333 . . . . 0.0 109.766 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.477 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.39 176.16 9.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.112 -1.228 . . . . 0.0 109.84 179.905 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.669 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -115.03 31.56 6.61 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.98 -1.075 . . . . 0.0 110.878 -179.432 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.26 159.84 31.17 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.54 ' O ' HG22 ' A' ' 39' ' ' VAL . 12.7 p -86.98 37.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -1.122 . . . . 0.0 109.545 179.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.579 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -150.7 15.06 0.76 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.463 -0.773 . . . . 0.0 110.005 -179.441 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.519 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 9.4 p 32.67 87.19 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.67 -0.644 . . . . 0.0 110.6 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.579 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 1.5 tt0 -151.2 -38.76 0.12 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.403 -0.81 . . . . 0.0 110.286 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.669 ' CE1' HG23 ' A' ' 37' ' ' THR . 1.6 p-80 -120.53 128.5 53.16 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.04 -1.038 . . . . 0.0 110.703 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.608 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 25.0 t80 -86.76 128.3 35.02 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.424 0.63 . . . . 0.0 110.155 -178.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.593 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -95.38 6.26 49.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.429 -0.794 . . . . 0.0 110.118 -179.391 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 C--N 1.302 -1.48 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.443 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 121.278 0.561 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.558 ' HB3' HG11 ' A' ' 23' ' ' VAL . 1.3 t -82.47 96.79 8.12 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.238 -0.914 . . . . 0.0 110.287 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 1.001 ' CD1' HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -122.56 152.91 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.308 -0.87 . . . . 0.0 110.139 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.509 ' N ' HG13 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -125.97 172.78 9.65 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.229 -0.919 . . . . 0.0 110.267 -179.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.91 166.25 12.27 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.244 -0.91 . . . . 0.0 110.19 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 21.6 m -92.8 -143.76 0.22 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.211 -0.931 . . . . 0.0 110.186 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 t -137.12 -178.85 5.39 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 110.131 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.6 m -81.76 8.56 9.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.25 -0.906 . . . . 0.0 110.171 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -125.84 21.49 7.59 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.243 -0.911 . . . . 0.0 110.238 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.67 21.86 2.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.226 -0.922 . . . . 0.0 110.188 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -113.58 91.33 3.6 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.224 -0.922 . . . . 0.0 110.163 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -158.99 49.4 0.41 Allowed Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -144.98 -65.75 0.33 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -1.145 . . . . 0.0 110.191 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.632 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 24.6 p -83.64 125.68 32.08 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.224 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -89.48 -41.4 12.08 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.19 -0.944 . . . . 0.0 110.369 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.597 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.7 m80 -112.5 77.21 1.03 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.117 -0.989 . . . . 0.0 110.209 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -170.08 178.5 42.87 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -107.19 140.08 40.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.295 -1.121 . . . . 0.0 110.36 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.617 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -82.28 139.85 33.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.218 -0.927 . . . . 0.0 109.965 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.082 HD11 ' CD1' ' A' ' 29' ' ' TYR . 26.3 pt -156.21 -163.58 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.199 -0.938 . . . . 0.0 110.205 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.605 ' O ' HD12 ' A' ' 3' ' ' ILE . 5.3 t80 -153.48 141.61 20.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.156 -0.965 . . . . 0.0 109.882 -179.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.682 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.7 mm? -92.48 136.02 33.57 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.187 -0.946 . . . . 0.0 110.875 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.558 HG11 ' HB3' ' A' ' 2' ' ' SER . 7.7 p -90.94 -27.81 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.387 -0.821 . . . . 0.0 110.706 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' A' ' 25' ' ' MET . 58.3 p30 -78.46 -12.85 60.03 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.91 -1.118 . . . . 0.0 109.002 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 51.2 mtt -147.98 65.82 1.1 Allowed 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.575 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 69.0 p -29.68 89.25 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.703 0.763 . . . . 0.0 111.51 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.26 147.88 16.36 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.864 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.524 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 20.4 p30 -58.36 132.92 55.11 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.127 -0.983 . . . . 0.0 110.141 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 1.082 ' CD1' HD11 ' A' ' 20' ' ' ILE . 10.3 t80 -128.27 123.25 33.66 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.316 -0.865 . . . . 0.0 110.276 -179.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.632 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 1.7 m -113.74 115.2 27.44 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.09 -1.006 . . . . 0.0 110.172 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -86.18 100.6 12.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.13 -0.981 . . . . 0.0 109.569 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.583 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 86.6 m -79.52 172.68 13.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.319 -0.863 . . . . 0.0 110.239 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -79.53 127.64 32.38 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.324 -0.86 . . . . 0.0 109.859 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.9 t -71.49 -13.64 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.353 -0.842 . . . . 0.0 110.236 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -74.85 -7.45 80.86 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.535 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -79.78 177.5 8.85 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.183 -1.187 . . . . 0.0 110.091 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.613 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.59 27.57 9.52 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.922 -1.112 . . . . 0.0 110.13 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -159.07 157.76 28.81 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.321 -1.512 . . . . 0.0 109.321 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.808 HG12 ' O ' ' A' ' 39' ' ' VAL . 67.1 t -84.84 43.52 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.186 -1.185 . . . . 0.0 109.705 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.558 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -155.85 16.26 0.36 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.274 -0.891 . . . . 0.0 110.258 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.583 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 9.0 p 32.17 89.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.59 -0.694 . . . . 0.0 110.639 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.558 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 1.8 tt0 -155.95 -41.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.326 -0.859 . . . . 0.0 110.121 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.613 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.4 p-80 -118.37 126.36 51.94 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.066 -1.022 . . . . 0.0 110.512 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.608 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.4 t80 -87.5 129.02 35.22 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.553 -0.717 . . . . 0.0 109.986 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.557 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -92.64 -32.43 14.77 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.432 -0.793 . . . . 0.0 110.091 -179.412 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.8 mt . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.313 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 55.0 t . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.256 0.55 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.657 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -120.53 61.8 0.87 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.224 -0.922 . . . . 0.0 110.221 179.939 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.715 HD12 HD23 ' A' ' 22' ' ' LEU . 0.9 OUTLIER -109.86 149.94 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.254 -0.904 . . . . 0.0 110.247 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -115.53 179.46 3.96 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.256 -0.903 . . . . 0.0 110.215 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.62 170.81 8.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.242 -0.911 . . . . 0.0 110.199 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 97.8 m -108.48 -167.98 1.3 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.249 -0.907 . . . . 0.0 110.352 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.4 t -130.12 -138.97 0.22 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.058 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 33.0 t -79.71 5.61 12.95 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.09 -1.006 . . . . 0.0 110.133 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -97.33 8.7 44.06 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.283 -0.886 . . . . 0.0 110.018 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.464 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 22.3 ptt? -79.59 -14.06 59.08 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.323 -0.86 . . . . 0.0 110.455 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -107.96 90.15 3.21 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.21 -0.931 . . . . 0.0 110.087 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -171.4 -35.43 0.03 OUTLIER Glycine 0 N--CA 1.487 2.096 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -107.99 -62.82 1.39 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.219 -1.165 . . . . 0.0 110.418 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.526 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.1 p -87.31 117.93 26.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.196 -0.94 . . . . 0.0 110.483 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.605 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.3 mt -78.88 -42.8 26.4 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.293 -0.88 . . . . 0.0 109.985 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -119.32 86.75 2.61 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.416 -0.803 . . . . 0.0 110.368 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -179.47 171.1 42.83 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -96.86 162.7 13.29 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.239 -1.153 . . . . 0.0 110.495 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -109.78 132.15 54.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.368 -0.833 . . . . 0.0 110.532 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.661 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -147.3 167.91 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.4 -0.812 . . . . 0.0 109.932 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.493 ' CD1' ' C ' ' A' ' 21' ' ' TYR . 7.0 t80 -120.04 120.44 36.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.131 -0.981 . . . . 0.0 110.178 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.758 HD11 ' CD2' ' A' ' 29' ' ' TYR . 11.1 mt -83.7 136.1 34.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.154 -0.966 . . . . 0.0 110.862 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.657 HG11 ' HB3' ' A' ' 2' ' ' SER . 14.8 p -88.66 -29.5 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.466 -0.771 . . . . 0.0 110.1 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -78.63 -21.86 47.81 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.178 -0.951 . . . . 0.0 108.752 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.574 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -134.34 61.13 1.68 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 178.65 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.47 ' C ' ' O ' ' A' ' 25' ' ' MET . 7.3 p -28.89 85.53 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.523 0.678 . . . . 0.0 111.906 -178.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.574 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.7 OUTLIER -161.35 164.74 29.84 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.613 -0.679 . . . . 0.0 109.633 179.522 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -79.51 91.95 5.22 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.407 -0.808 . . . . 0.0 109.701 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.758 ' CD2' HD11 ' A' ' 22' ' ' LEU . 5.9 t80 -79.8 135.6 36.52 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.414 -0.804 . . . . 0.0 109.826 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.526 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -122.23 117.11 25.38 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.092 -1.005 . . . . 0.0 110.591 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.479 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -80.41 136.74 36.41 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.177 -0.952 . . . . 0.0 109.413 179.16 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 6.3 m -80.38 166.25 21.46 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.178 -0.951 . . . . 0.0 109.764 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.521 ' O ' ' N ' ' A' ' 35' ' ' GLY . 17.9 tt0 -78.41 110.06 13.14 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.122 -0.986 . . . . 0.0 108.772 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' A' ' 33' ' ' GLU . 26.0 t -37.49 93.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 CA-C-O 121.422 0.63 . . . . 0.0 110.412 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.754 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 149.87 -15.17 1.04 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.579 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.5 m-85 -80.51 173.95 12.09 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.177 -1.19 . . . . 0.0 110.198 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.672 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.6 OUTLIER -125.47 45.68 2.54 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.055 -1.028 . . . . 0.0 110.835 -179.745 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.03 153.42 24.39 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.3 p -88.23 20.03 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.269 -1.136 . . . . 0.0 109.761 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.594 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 3.1 tmm_? -125.25 -16.78 5.85 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.442 -0.787 . . . . 0.0 110.073 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.8 m 69.79 83.76 0.15 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.312 -0.868 . . . . 0.0 109.919 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.594 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -156.72 -31.11 0.09 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.388 -0.82 . . . . 0.0 111.247 -179.738 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.672 ' CE1' HG23 ' A' ' 37' ' ' THR . 4.2 p80 -123.89 123.65 40.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.634 -1.291 . . . . 0.0 111.084 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.628 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 28.1 t80 -82.9 105.82 14.21 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.129 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -65.03 -16.16 63.14 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.187 -0.945 . . . . 0.0 109.778 -179.781 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.754 HD12 ' O ' ' A' ' 35' ' ' GLY . 5.7 mt . . . . . 0 N--CA 1.488 1.459 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.28 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 75.3 t . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 121.248 0.547 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.652 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -94.28 108.1 20.0 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 110.239 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 1.033 HD11 HD12 ' A' ' 20' ' ' ILE . 2.5 tt -133.44 161.16 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.296 -0.877 . . . . 0.0 110.194 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.468 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.2 OUTLIER -126.94 -177.99 4.24 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.209 -0.932 . . . . 0.0 110.326 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.77 171.24 7.61 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.226 -0.921 . . . . 0.0 110.275 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 64.4 m -107.25 -163.08 0.88 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.286 -0.884 . . . . 0.0 110.223 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.56 -167.08 1.67 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.322 -0.861 . . . . 0.0 110.207 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.6 t -83.61 9.27 11.89 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.164 -0.96 . . . . 0.0 110.31 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -134.36 26.09 3.8 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.226 -0.921 . . . . 0.0 110.334 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 ttm -143.94 16.03 1.74 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.262 -0.899 . . . . 0.0 110.217 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.1 p-10 -111.75 57.87 0.63 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -0.906 . . . . 0.0 110.279 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -110.81 62.12 0.29 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.435 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 64.2 t80 -160.18 -50.27 0.05 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.381 -1.07 . . . . 0.0 110.196 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -104.39 119.89 39.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.346 -0.846 . . . . 0.0 110.324 -179.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.533 ' HB2' ' ND1' ' A' ' 16' ' ' HIS . 5.6 mt -90.49 -48.29 7.19 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.228 -0.92 . . . . 0.0 110.127 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.577 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 11.2 m80 -103.73 69.39 0.97 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.368 -0.833 . . . . 0.0 110.25 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -174.14 -170.59 37.62 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -114.84 137.59 51.78 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.199 -1.177 . . . . 0.0 110.337 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.661 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -85.31 146.91 26.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.262 -0.899 . . . . 0.0 110.045 179.801 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.033 HD12 HD11 ' A' ' 3' ' ' ILE . 8.1 pt -159.46 -174.57 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.282 -0.886 . . . . 0.0 110.272 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.469 ' CD1' ' C ' ' A' ' 21' ' ' TYR . 5.9 t80 -135.97 120.54 18.24 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.283 -0.885 . . . . 0.0 109.825 179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.785 HD11 ' CD2' ' A' ' 29' ' ' TYR . 13.2 mt -79.71 131.69 36.01 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.242 -0.911 . . . . 0.0 110.975 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.652 HG11 ' CB ' ' A' ' 2' ' ' SER . 7.7 p -87.49 -27.98 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 109.839 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -78.65 -20.63 49.84 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 108.739 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.562 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -140.18 63.69 1.47 Allowed 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.79 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.485 ' C ' ' O ' ' A' ' 25' ' ' MET . 20.1 p -29.12 87.55 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 121.682 0.753 . . . . 0.0 111.503 -178.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.562 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.97 148.85 15.71 Favored 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.652 -0.655 . . . . 0.0 109.371 179.937 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.518 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 7.7 p30 -64.44 105.05 0.86 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.316 -0.865 . . . . 0.0 109.762 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.944 ' CD1' HD11 ' A' ' 20' ' ' ILE . 4.9 t80 -99.75 144.66 28.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.343 -0.848 . . . . 0.0 110.018 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.611 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 42.9 m -137.44 115.33 11.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.011 -1.056 . . . . 0.0 110.581 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -80.87 114.94 20.09 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.221 -0.925 . . . . 0.0 109.683 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.471 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 91.2 m -79.6 172.99 13.03 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.21 -0.932 . . . . 0.0 110.44 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -79.44 118.41 21.3 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.371 -0.831 . . . . 0.0 109.964 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.2 t -50.87 106.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.301 -0.874 . . . . 0.0 109.763 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.665 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 143.97 -10.76 2.08 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.577 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.37 168.45 19.49 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.159 -1.2 . . . . 0.0 109.829 179.855 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.916 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.71 30.58 6.18 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.952 -1.093 . . . . 0.0 110.791 -179.742 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.12 154.61 25.66 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.496 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.6 p -84.87 44.22 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.297 -1.119 . . . . 0.0 109.759 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.575 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.55 22.58 0.18 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.461 -0.774 . . . . 0.0 109.759 -179.571 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.518 ' HG ' ' HA ' ' A' ' 14' ' ' CYS . 2.9 p 27.78 92.05 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 CA-C-O 121.387 0.613 . . . . 0.0 111.452 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -153.29 -37.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.442 -0.786 . . . . 0.0 110.278 179.833 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.916 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.9 p80 -121.92 116.48 24.45 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.194 -0.941 . . . . 0.0 110.451 179.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.572 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 38.0 t80 -79.89 115.47 19.5 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.477 0.656 . . . . 0.0 109.882 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.543 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -82.93 -26.24 31.62 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.295 -0.878 . . . . 0.0 110.038 -179.557 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.665 HD12 ' O ' ' A' ' 35' ' ' GLY . 4.5 mt . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.172 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.758 ' O ' HG13 ' A' ' 1' ' ' VAL . 9.9 p . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.258 0.551 . . . . 0.0 110.289 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.602 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER -109.36 100.73 9.79 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.216 -0.927 . . . . 0.0 110.222 -179.939 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.543 HD11 ' HB ' ' A' ' 20' ' ' ILE . 1.8 tt -121.42 156.3 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.266 -0.896 . . . . 0.0 110.248 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.702 ' O ' HG22 ' A' ' 20' ' ' ILE . 4.9 t -141.56 -150.59 0.32 Allowed 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.334 -0.854 . . . . 0.0 110.087 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.666 ' N ' HG23 ' A' ' 4' ' ' THR . 7.6 mttt -118.18 -174.82 2.73 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.502 -0.749 . . . . 0.0 110.446 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.506 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 67.4 m -109.97 -150.04 0.45 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.344 -0.848 . . . . 0.0 110.201 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.12 -170.69 1.93 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.27 -0.893 . . . . 0.0 110.17 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.78 15.54 11.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.238 -0.913 . . . . 0.0 110.224 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -128.9 31.36 4.94 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.215 -0.928 . . . . 0.0 110.181 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.4 ttt -148.21 20.03 1.09 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.267 -0.896 . . . . 0.0 110.337 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -101.82 75.02 1.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.897 . . . . 0.0 110.145 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -136.15 20.54 3.57 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -119.49 -58.56 1.9 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.12 -1.223 . . . . 0.0 110.297 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.721 ' HG ' ' HG ' ' A' ' 30' ' ' CYS . 26.0 p -97.06 121.71 39.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.321 -0.862 . . . . 0.0 110.349 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.561 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.8 mt -90.79 -45.55 8.75 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.222 -0.924 . . . . 0.0 110.382 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.57 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 6.3 m80 -108.81 77.03 1.05 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.257 -0.902 . . . . 0.0 110.148 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -173.09 -163.61 27.1 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -123.32 135.49 54.22 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.218 -1.166 . . . . 0.0 110.209 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.506 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t -79.9 144.94 32.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -0.887 . . . . 0.0 110.11 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.751 HD12 ' CD1' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -158.18 -179.86 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.22 -0.925 . . . . 0.0 109.565 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.511 ' O ' HG13 ' A' ' 3' ' ' ILE . 17.9 t80 -144.22 128.58 17.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.886 -1.134 . . . . 0.0 110.449 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.598 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.7 mm? -85.14 130.63 34.57 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.15 -0.969 . . . . 0.0 110.789 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.602 HG11 ' CB ' ' A' ' 2' ' ' SER . 6.0 p -90.86 -25.74 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.345 -0.847 . . . . 0.0 110.564 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -78.08 -3.62 43.21 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.008 -1.057 . . . . 0.0 108.925 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.522 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -159.81 68.41 0.4 Allowed 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 179.18 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.509 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.58 91.76 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.981 0.896 . . . . 0.0 111.2 -178.409 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -160.18 147.95 16.53 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.517 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 23.1 t30 -63.21 128.71 37.09 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.373 -0.83 . . . . 0.0 110.235 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.751 ' CD1' HD12 ' A' ' 20' ' ' ILE . 6.5 t80 -122.16 116.58 24.43 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.357 -0.839 . . . . 0.0 110.108 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.721 ' HG ' ' HG ' ' A' ' 14' ' ' CYS . 1.8 m -122.57 112.69 18.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.223 -0.923 . . . . 0.0 110.142 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -80.13 102.06 9.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.173 -0.954 . . . . 0.0 109.842 179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 74.4 m -79.54 170.42 16.59 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.875 . . . . 0.0 110.041 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 32.2 tt0 -79.45 125.45 29.57 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.221 -0.924 . . . . 0.0 109.807 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.422 ' H ' HG23 ' A' ' 34' ' ' VAL . 10.5 t -66.43 -20.72 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.398 -0.814 . . . . 0.0 110.182 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.418 ' O ' HD12 ' A' ' 46' ' ' LEU . . . -66.93 -10.6 56.35 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.57 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.7 OUTLIER -79.79 176.52 9.65 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -1.185 . . . . 0.0 109.912 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.795 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -108.64 27.48 9.37 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.907 -1.121 . . . . 0.0 110.343 179.573 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -159.29 155.59 26.68 Favored Glycine 0 N--CA 1.488 2.137 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.541 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.5 p -84.63 43.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.289 -1.124 . . . . 0.0 109.815 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -157.02 20.11 0.31 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.32 -0.862 . . . . 0.0 110.051 -179.557 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 8.9 p 29.22 91.42 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.495 0.664 . . . . 0.0 111.614 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.3 tt0 -155.56 -36.96 0.09 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.339 -0.851 . . . . 0.0 110.158 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.795 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.4 p80 -121.13 121.07 37.05 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.143 -0.973 . . . . 0.0 110.462 179.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.597 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 33.8 t80 -83.88 121.94 28.03 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.378 0.609 . . . . 0.0 109.839 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.566 ' HB2' HG21 ' A' ' 37' ' ' THR . 0.2 OUTLIER -92.22 -19.83 21.8 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.28 -0.888 . . . . 0.0 110.069 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.597 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.0 mt . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.327 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.487 ' O ' HG23 ' A' ' 1' ' ' VAL . 20.9 m . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.229 0.538 . . . . 0.0 110.21 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.425 ' H ' HG11 ' A' ' 23' ' ' VAL . 0.2 OUTLIER -96.67 62.86 1.99 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.137 -0.977 . . . . 0.0 110.469 -179.882 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.683 ' CG1' HG22 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -79.93 153.97 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.242 -0.911 . . . . 0.0 109.913 179.675 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.507 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.4 m -136.05 162.19 33.59 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.281 -0.887 . . . . 0.0 110.252 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -93.6 -178.8 4.82 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.433 -0.792 . . . . 0.0 110.099 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.546 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 15.5 m -110.97 -163.42 0.85 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.219 -0.926 . . . . 0.0 110.274 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.55 -158.84 0.9 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.271 -0.893 . . . . 0.0 110.159 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.0 p -81.77 168.65 17.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.234 -0.917 . . . . 0.0 110.121 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 46.5 23.68 0.25 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.141 -0.974 . . . . 0.0 110.345 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -120.75 -0.77 10.1 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 110.163 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -120.56 101.41 7.74 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.237 -0.914 . . . . 0.0 110.257 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -138.65 16.44 3.32 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -114.74 -53.4 2.65 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.313 -1.11 . . . . 0.0 110.284 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -93.62 123.11 36.72 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.295 -0.878 . . . . 0.0 110.632 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.5 mt -90.31 -42.85 10.73 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.267 -0.896 . . . . 0.0 110.315 179.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.569 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.9 m80 -109.8 88.27 2.71 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.302 -0.874 . . . . 0.0 110.165 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.13 -167.61 40.6 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -123.23 159.43 28.73 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.227 -1.16 . . . . 0.0 110.357 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.546 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 0.3 OUTLIER -99.94 149.21 23.66 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.231 -0.918 . . . . 0.0 110.504 -179.807 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.763 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.4 mt -155.0 -171.64 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.364 -0.835 . . . . 0.0 109.531 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.507 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 18.7 t80 -145.55 133.56 21.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.042 -1.036 . . . . 0.0 109.644 179.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.63 HD23 ' HB2' ' A' ' 29' ' ' TYR . 2.1 mm? -99.4 137.96 37.16 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.129 -0.982 . . . . 0.0 111.076 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.425 HG11 ' H ' ' A' ' 2' ' ' SER . 7.2 p -90.38 -26.01 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.38 -0.825 . . . . 0.0 110.52 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 25' ' ' MET . 49.0 p30 -77.9 -4.73 48.24 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.119 -0.988 . . . . 0.0 109.095 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.556 ' O ' ' N ' ' A' ' 27' ' ' GLN . 8.8 mtm -157.95 65.57 0.46 Allowed 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 179.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.474 ' C ' ' O ' ' A' ' 25' ' ' MET . 68.4 p -29.28 86.93 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 CA-C-O 121.614 0.721 . . . . 0.0 111.831 -178.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.556 ' N ' ' O ' ' A' ' 25' ' ' MET . 2.9 pt20 -160.9 174.91 13.13 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.707 -0.621 . . . . 0.0 109.405 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -79.28 146.85 32.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.345 -0.847 . . . . 0.0 110.549 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.763 ' CD1' HD12 ' A' ' 20' ' ' ILE . 8.1 t80 -129.88 108.54 10.21 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.53 -0.732 . . . . 0.0 109.592 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 5.8 m -111.72 107.77 16.97 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.104 -0.998 . . . . 0.0 110.74 -179.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.49 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -79.57 121.63 25.48 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.182 -0.948 . . . . 0.0 109.218 179.182 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.65 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 89.9 m -79.38 173.67 12.34 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.221 -0.925 . . . . 0.0 110.137 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -78.94 115.1 18.4 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.229 -0.919 . . . . 0.0 109.8 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.415 ' H ' HG23 ' A' ' 34' ' ' VAL . 22.0 t -51.93 100.89 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.498 -0.751 . . . . 0.0 109.883 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 151.69 -13.64 0.78 Allowed Glycine 0 N--CA 1.493 2.449 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.433 ' CZ ' ' HD1' ' A' ' 44' ' ' PHE . 1.2 m-85 -79.13 170.54 16.5 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.012 -1.287 . . . . 0.0 110.049 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.739 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -112.38 35.72 3.69 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.937 -1.102 . . . . 0.0 110.544 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.414 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -160.29 154.9 25.97 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.549 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.0 p -85.18 45.43 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.21 -1.171 . . . . 0.0 109.47 179.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.575 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -158.76 20.01 0.21 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.518 -0.739 . . . . 0.0 109.979 -179.179 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.65 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 2.8 p 27.12 93.56 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.577 -0.702 . . . . 0.0 111.541 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 4.4 tt0 -160.73 -35.65 0.05 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.549 -0.719 . . . . 0.0 110.323 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.739 ' CE1' HG23 ' A' ' 37' ' ' THR . 7.4 p80 -124.15 112.55 17.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.111 -0.993 . . . . 0.0 110.652 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.433 ' HD1' ' CZ ' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -79.89 134.25 36.28 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.297 -0.877 . . . . 0.0 109.508 179.309 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.55 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -91.14 -24.05 20.08 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.362 -0.836 . . . . 0.0 110.212 -179.303 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.547 ' HG ' ' CD2' ' A' ' 45' ' ' PHE . 1.9 mt . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.277 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 69.2 t . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.24 0.543 . . . . 0.0 110.239 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.845 ' HB2' HG11 ' A' ' 23' ' ' VAL . 1.0 OUTLIER -119.74 47.42 1.73 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.258 -0.901 . . . . 0.0 110.255 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 1.089 HD11 HD12 ' A' ' 20' ' ' ILE . 6.4 tt -79.93 157.29 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.529 HG23 ' N ' ' A' ' 5' ' ' LYS . 6.4 t -142.58 -153.85 0.49 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.296 -0.877 . . . . 0.0 110.006 179.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.529 ' N ' HG23 ' A' ' 4' ' ' THR . 11.7 mtpt -102.73 178.61 4.52 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.394 -0.816 . . . . 0.0 110.258 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 59.6 m -105.69 -150.87 0.44 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.175 -0.953 . . . . 0.0 110.247 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.5 m -111.2 -170.03 1.57 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.209 -0.932 . . . . 0.0 110.203 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.68 13.34 8.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.28 -0.888 . . . . 0.0 110.185 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.63 21.78 5.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.293 -0.88 . . . . 0.0 110.214 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -127.04 3.53 6.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.255 -0.903 . . . . 0.0 110.136 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 11' ' ' ASN . 21.5 p30 -86.07 48.65 1.64 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.287 -0.883 . . . . 0.0 110.103 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -126.06 3.55 7.88 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -101.22 -48.49 4.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.15 -1.206 . . . . 0.0 110.27 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 22.1 p -105.16 116.18 31.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.291 -0.881 . . . . 0.0 110.63 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.596 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 6.6 mt -90.43 -39.05 12.87 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.301 -0.875 . . . . 0.0 110.506 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.596 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 21.3 m80 -110.73 63.11 0.61 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.109 -0.995 . . . . 0.0 110.555 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.481 ' HA3' ' SG ' ' A' ' 32' ' ' CYS . . . -173.51 -160.32 21.69 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -122.66 136.25 54.82 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.292 -1.122 . . . . 0.0 110.177 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.596 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 1.9 t -84.64 146.73 27.33 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.326 -0.859 . . . . 0.0 110.449 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.089 HD12 HD11 ' A' ' 3' ' ' ILE . 5.0 pt -157.78 -170.61 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.379 -0.826 . . . . 0.0 110.104 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.474 ' O ' HG13 ' A' ' 3' ' ' ILE . 4.6 t80 -140.9 133.7 28.94 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.112 -0.993 . . . . 0.0 110.097 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.733 HD12 ' OD2' ' A' ' 24' ' ' ASP . 1.2 mm? -86.7 133.74 33.65 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.122 -0.986 . . . . 0.0 111.113 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.845 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.2 p -90.83 -25.23 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.412 -0.805 . . . . 0.0 110.67 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.733 ' OD2' HD12 ' A' ' 22' ' ' LEU . 2.9 p30 -78.64 -15.52 58.41 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.047 -1.033 . . . . 0.0 108.9 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.6 mtt -147.43 67.0 1.13 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.1 p -29.11 88.76 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.693 0.758 . . . . 0.0 111.661 -178.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.3 OUTLIER -160.28 173.44 15.7 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.673 -0.642 . . . . 0.0 109.561 179.643 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -77.18 136.89 38.6 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.368 -0.832 . . . . 0.0 110.522 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.877 ' CD1' HD11 ' A' ' 20' ' ' ILE . 8.6 t80 -135.82 154.42 51.19 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.461 -0.774 . . . . 0.0 109.653 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.617 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 3.0 m -153.64 123.51 6.83 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.926 -1.109 . . . . 0.0 110.94 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.412 ' HA ' ' HD3' ' A' ' 31' ' ' ARG . 15.3 tpp85 -103.04 106.72 17.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.175 -0.953 . . . . 0.0 109.093 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 27.0 m -111.27 -164.82 0.94 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.293 -0.88 . . . . 0.0 110.592 -178.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.418 ' CG ' ' H ' ' A' ' 35' ' ' GLY . 21.2 tt0 -78.24 123.05 26.49 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.244 -0.91 . . . . 0.0 109.615 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.4 t -64.5 -10.59 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.447 -0.783 . . . . 0.0 109.707 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.418 ' H ' ' CG ' ' A' ' 33' ' ' GLU . . . -68.72 -7.09 53.86 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.595 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.6 m-85 -79.46 165.13 23.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.18 -1.188 . . . . 0.0 109.407 179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.905 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.61 34.0 4.22 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.878 -1.139 . . . . 0.0 111.478 -178.823 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.7 159.5 31.02 Favored Glycine 0 N--CA 1.491 2.336 0 C-N-CA 119.351 -1.404 . . . . 0.0 110.075 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -84.33 13.04 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -1.119 . . . . 0.0 109.362 178.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 28.0 ttp180 -109.08 -17.62 13.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.569 -0.707 . . . . 0.0 110.116 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 21.9 m 61.11 58.65 2.18 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.315 -0.866 . . . . 0.0 110.607 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER -136.35 -19.53 1.44 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.482 -0.761 . . . . 0.0 111.278 179.93 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.905 ' CE1' HG23 ' A' ' 37' ' ' THR . 4.9 p80 -127.52 119.93 27.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.736 -1.227 . . . . 0.0 110.7 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.628 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 21.1 t80 -81.75 108.22 15.12 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.327 0.584 . . . . 0.0 109.964 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.564 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -64.61 -15.9 61.87 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.222 -0.924 . . . . 0.0 109.912 -179.773 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.628 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.0 mt . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.27 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.232 0.539 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 1.028 ' CB ' HG11 ' A' ' 23' ' ' VAL . 48.3 m -129.44 85.92 2.37 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.243 -0.91 . . . . 0.0 110.147 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.826 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.8 OUTLIER -139.18 153.0 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.297 -0.877 . . . . 0.0 110.043 -179.954 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -132.83 162.23 32.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.261 -0.899 . . . . 0.0 110.425 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -101.93 168.16 9.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.335 -0.853 . . . . 0.0 110.129 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.723 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 58.4 m -108.83 -145.66 0.4 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.227 -0.92 . . . . 0.0 110.253 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.495 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.3 OUTLIER -153.79 -158.27 0.85 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.311 -0.868 . . . . 0.0 110.062 179.877 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.495 ' N ' ' OG ' ' A' ' 7' ' ' SER . 3.0 t -80.5 168.62 18.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.154 -0.966 . . . . 0.0 110.231 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.6 t0 47.88 22.86 0.4 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.097 -1.002 . . . . 0.0 110.286 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.19 8.17 8.53 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.326 -0.859 . . . . 0.0 110.176 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -114.75 -142.72 0.38 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.285 -0.885 . . . . 0.0 110.04 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 116.94 -0.17 19.62 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.426 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 65.2 t80 -110.48 -51.35 2.88 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.222 -1.163 . . . . 0.0 110.132 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.2 p -96.67 120.74 37.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.307 -0.871 . . . . 0.0 110.163 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.596 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 10.8 mt -88.17 -40.96 13.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.201 -0.937 . . . . 0.0 110.377 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.596 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.1 m80 -114.2 80.3 1.37 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.216 -0.928 . . . . 0.0 110.037 -179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.507 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -179.74 -168.25 38.25 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -115.04 167.55 10.71 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.298 -1.119 . . . . 0.0 110.283 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.723 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 1.3 t -103.68 126.36 50.77 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.394 -0.816 . . . . 0.0 110.378 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.885 HD13 ' HD2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -130.25 -172.9 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.322 -0.861 . . . . 0.0 109.555 -179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.507 ' O ' HD12 ' A' ' 3' ' ' ILE . 14.5 t80 -145.82 142.85 29.23 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.894 -1.129 . . . . 0.0 110.19 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.622 HD23 ' HB2' ' A' ' 29' ' ' TYR . 1.2 mm? -104.14 136.64 43.38 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.108 -0.995 . . . . 0.0 111.37 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 1.028 HG11 ' CB ' ' A' ' 2' ' ' SER . 14.7 p -90.78 -27.69 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.352 -0.842 . . . . 0.0 110.556 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -78.77 -19.04 53.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.035 -1.041 . . . . 0.0 108.839 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.551 ' HB3' ' NE2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -138.84 63.6 1.51 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.735 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.486 ' C ' ' O ' ' A' ' 25' ' ' MET . 11.5 p -28.75 89.03 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.679 0.752 . . . . 0.0 111.543 -178.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.551 ' NE2' ' HB3' ' A' ' 25' ' ' MET . 0.6 OUTLIER -159.73 176.74 11.61 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.609 -0.682 . . . . 0.0 109.73 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -88.09 115.94 25.92 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.495 -0.753 . . . . 0.0 110.352 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.885 ' HD2' HD13 ' A' ' 20' ' ' ILE . 28.7 t80 -91.08 157.03 17.47 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.493 -0.755 . . . . 0.0 109.73 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -141.15 112.85 7.64 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.067 -1.02 . . . . 0.0 110.403 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.772 ' H ' HD11 ' A' ' 20' ' ' ILE . 11.1 tpp180 -88.66 115.77 26.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.262 -0.898 . . . . 0.0 109.479 179.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.504 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 91.4 m -79.05 170.12 17.15 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.281 -0.887 . . . . 0.0 110.391 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -79.44 113.97 18.0 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.316 -0.865 . . . . 0.0 110.143 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.411 HG23 ' H ' ' A' ' 34' ' ' VAL . 47.4 t -48.12 104.62 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.362 -0.836 . . . . 0.0 109.786 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.92 -9.18 2.27 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.525 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.41 175.58 10.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.13 -1.217 . . . . 0.0 109.832 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -116.95 13.14 14.85 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.025 -1.047 . . . . 0.0 110.818 -179.583 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -128.74 161.73 22.36 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.641 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.3 p -87.67 31.55 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.298 -1.119 . . . . 0.0 109.743 179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.37 29.62 0.16 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.332 -0.855 . . . . 0.0 109.962 -179.655 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.504 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 8.1 p 31.76 90.8 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.616 -0.677 . . . . 0.0 111.13 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 4.0 tm-20 -154.02 -39.88 0.09 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.295 -0.878 . . . . 0.0 110.098 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.2 p-80 -117.21 128.49 55.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.093 -1.004 . . . . 0.0 110.202 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.588 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 34.9 t80 -88.62 130.49 35.27 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.436 0.636 . . . . 0.0 110.528 -178.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -93.48 -36.8 12.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.409 -0.807 . . . . 0.0 110.001 -179.741 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.588 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.4 mt . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.379 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 1' ' ' VAL . 11.8 p . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.272 0.558 . . . . 0.0 110.273 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.687 ' HB3' HG11 ' A' ' 23' ' ' VAL . 3.7 t -149.48 84.09 1.42 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.152 -0.967 . . . . 0.0 110.376 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.884 HG12 HG22 ' A' ' 20' ' ' ILE . 5.5 tt -80.03 -178.25 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.209 -0.932 . . . . 0.0 110.003 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -155.19 160.74 41.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.238 -0.914 . . . . 0.0 110.246 -179.896 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.5 mtmm -110.36 161.93 15.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.297 -0.877 . . . . 0.0 110.218 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.1 m -103.73 -144.64 0.37 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.269 -0.895 . . . . 0.0 110.101 179.991 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB3' ' HB2' ' A' ' 10' ' ' MET . 0.5 OUTLIER -127.61 -154.43 0.63 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.183 -0.948 . . . . 0.0 110.214 179.943 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.3 m -82.35 -61.1 1.99 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.245 -0.909 . . . . 0.0 110.18 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -91.51 27.65 1.93 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.227 -0.92 . . . . 0.0 110.182 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.42 ' HB2' ' HB3' ' A' ' 7' ' ' SER . 0.0 OUTLIER -108.97 -11.83 14.93 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.274 -0.891 . . . . 0.0 110.217 -180.0 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 11' ' ' ASN . 7.7 p-10 -132.77 96.85 3.9 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.307 -0.87 . . . . 0.0 110.202 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.17 52.73 0.67 Allowed Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -121.79 -59.36 1.68 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -1.151 . . . . 0.0 110.184 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.5 p -87.75 118.75 27.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 110.296 -179.877 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.591 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.2 mt -78.72 -43.01 26.81 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.303 -0.873 . . . . 0.0 110.288 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.591 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 9.1 m80 -116.99 77.54 1.13 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.329 -0.857 . . . . 0.0 110.496 -178.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.441 ' CA ' ' O ' ' A' ' 31' ' ' ARG . . . -175.85 167.71 39.64 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.832 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -89.96 145.55 25.03 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -1.209 . . . . 0.0 110.27 179.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 15.9 t -88.9 142.6 27.51 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.331 -0.856 . . . . 0.0 110.349 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.884 HG22 HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -158.74 -175.44 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.314 -0.866 . . . . 0.0 109.697 179.979 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.51 ' O ' HG13 ' A' ' 3' ' ' ILE . 9.4 t80 -152.68 123.27 7.29 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.037 -1.039 . . . . 0.0 109.963 -179.852 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.667 HD23 ' CD2' ' A' ' 29' ' ' TYR . 1.9 mm? -82.16 130.98 35.23 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.214 -0.929 . . . . 0.0 111.048 -179.366 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.687 HG11 ' HB3' ' A' ' 2' ' ' SER . 7.7 p -90.39 -23.81 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.298 -0.876 . . . . 0.0 110.42 179.518 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.39 -10.23 59.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.067 -1.021 . . . . 0.0 108.771 178.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.547 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.5 mpp? -150.86 69.0 0.96 Allowed 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.466 ' C ' ' O ' ' A' ' 25' ' ' MET . 6.9 p -29.49 87.64 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 121.575 0.702 . . . . 0.0 111.91 -178.183 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 tt0 -158.67 154.1 25.86 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.703 -0.623 . . . . 0.0 109.85 179.595 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.97 127.35 32.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.468 -0.77 . . . . 0.0 110.232 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.799 ' CD1' HD12 ' A' ' 20' ' ' ILE . 15.5 t80 -116.57 123.6 47.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.313 -0.867 . . . . 0.0 109.965 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 5.8 m -125.67 118.58 25.93 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.154 -0.966 . . . . 0.0 110.38 -179.78 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.464 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 5.1 tpp85 -79.43 124.85 28.84 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.218 -0.926 . . . . 0.0 109.421 179.551 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.8 m -79.4 160.4 26.68 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.214 -0.929 . . . . 0.0 109.528 -179.782 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' GLY . 16.2 tt0 -78.79 110.34 13.87 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.072 -1.017 . . . . 0.0 109.411 179.764 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.433 ' C ' ' O ' ' A' ' 33' ' ' GLU . 40.3 t -41.61 94.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.541 -0.724 . . . . 0.0 110.244 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.825 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 152.9 -17.67 0.73 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.868 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.589 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.1 m-85 -79.92 165.97 22.11 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.192 -1.181 . . . . 0.0 110.216 -179.937 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 1.114 HG23 ' CE1' ' A' ' 43' ' ' HIS . 6.1 t -120.28 35.21 4.94 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 119.103 -1.039 . . . . 0.0 110.902 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -140.6 153.87 23.87 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 179.721 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.692 HG12 ' O ' ' A' ' 39' ' ' VAL . 43.1 t -85.2 14.05 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.356 -1.085 . . . . 0.0 109.782 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.576 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 2.1 tmm_? -127.9 -15.14 4.91 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.455 -0.778 . . . . 0.0 110.399 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.1 m 71.75 85.59 0.12 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.389 -0.819 . . . . 0.0 109.719 -179.679 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.576 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -152.42 -31.33 0.14 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.638 -0.664 . . . . 0.0 110.715 -179.805 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 1.114 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.2 p80 -123.64 118.79 28.09 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.891 -1.131 . . . . 0.0 110.729 179.522 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.612 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 24.6 t80 -80.62 104.06 10.89 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.307 0.575 . . . . 0.0 109.9 -179.918 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.562 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -64.85 -22.21 66.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.206 -0.934 . . . . 0.0 109.95 -179.774 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.825 HD12 ' O ' ' A' ' 35' ' ' GLY . 4.4 mt . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.139 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.434 ' CG1' HG22 ' A' ' 3' ' ' ILE . 87.2 t . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.294 0.569 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.571 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -125.77 45.49 2.6 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.283 -0.886 . . . . 0.0 110.116 -179.984 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.793 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -143.97 153.62 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.325 -0.86 . . . . 0.0 110.342 -179.769 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.485 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -131.15 173.97 10.5 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.238 -0.914 . . . . 0.0 110.251 179.906 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -106.75 165.14 11.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.234 -0.916 . . . . 0.0 110.149 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.629 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 60.7 m -102.11 -141.17 0.35 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.254 -0.904 . . . . 0.0 110.216 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.5 t -141.25 -160.91 1.13 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.28 -0.888 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.2 28.5 1.41 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.26 -0.9 . . . . 0.0 110.241 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.34 30.85 1.54 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.228 -0.92 . . . . 0.0 110.177 179.962 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -145.44 14.56 1.43 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.97 . . . . 0.0 110.245 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -109.83 75.28 0.93 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.177 -0.952 . . . . 0.0 110.234 -179.967 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.32 -7.47 6.38 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -95.57 -60.28 1.69 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.281 -1.129 . . . . 0.0 110.076 -179.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.555 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.1 p -83.89 126.66 33.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.334 -0.854 . . . . 0.0 110.136 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.56 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.5 mt -90.58 -45.72 8.74 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.138 -0.976 . . . . 0.0 110.333 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.56 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.1 m80 -109.33 77.49 1.07 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.257 -0.902 . . . . 0.0 110.233 -179.573 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.484 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -174.5 -163.49 27.86 Favored Glycine 0 N--CA 1.488 2.16 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -128.73 153.15 47.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.328 -1.101 . . . . 0.0 110.285 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.629 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 0.5 OUTLIER -83.07 152.45 25.35 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.305 -0.872 . . . . 0.0 110.124 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.845 HD12 ' CD1' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -153.62 -173.99 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.144 -0.973 . . . . 0.0 109.603 -179.894 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.485 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 23.0 t80 -147.41 133.0 18.76 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.038 -1.039 . . . . 0.0 110.162 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.626 HD22 HD12 ' A' ' 3' ' ' ILE . 1.4 mm? -94.7 134.64 37.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.254 -0.904 . . . . 0.0 110.468 -179.882 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.571 HG11 ' CB ' ' A' ' 2' ' ' SER . 8.1 p -90.38 -27.16 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.344 -0.848 . . . . 0.0 110.599 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' A' ' 25' ' ' MET . 11.2 p30 -78.16 -15.13 59.12 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.106 -0.996 . . . . 0.0 108.757 179.362 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.3 ttm -144.74 65.56 1.27 Allowed 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.852 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 19.8 p -29.05 88.7 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 121.629 0.728 . . . . 0.0 111.751 -178.321 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 7.1 pt20 -160.38 176.15 12.0 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.627 -0.671 . . . . 0.0 109.601 179.488 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -81.68 138.82 35.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.452 -179.836 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.845 ' CD1' HD12 ' A' ' 20' ' ' ILE . 17.7 t80 -128.15 117.32 21.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.372 -0.83 . . . . 0.0 109.838 179.861 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.555 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -114.06 117.39 31.14 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.08 -1.013 . . . . 0.0 110.621 -179.671 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.484 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.0 ttm180 -91.78 129.8 37.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.945 . . . . 0.0 109.749 179.433 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.502 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 71.9 m -79.4 175.12 10.89 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.279 -0.888 . . . . 0.0 110.241 -179.869 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -79.81 112.85 17.49 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -0.891 . . . . 0.0 109.854 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.423 HG23 ' H ' ' A' ' 34' ' ' VAL . 43.4 t -47.27 105.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.361 -0.837 . . . . 0.0 109.887 -179.94 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.47 -8.89 2.37 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.743 -1.343 . . . . 0.0 109.743 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.477 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.33 176.07 10.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.116 -1.226 . . . . 0.0 110.056 179.963 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.608 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -115.12 31.31 6.78 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.119 -0.988 . . . . 0.0 110.378 -179.49 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.06 155.31 26.43 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.519 ' O ' HG22 ' A' ' 39' ' ' VAL . 12.5 p -84.76 43.07 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.275 -1.133 . . . . 0.0 109.789 179.61 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.568 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.27 22.21 0.16 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.412 -0.805 . . . . 0.0 109.918 -179.537 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.502 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 6.6 p 28.95 92.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.697 -0.627 . . . . 0.0 111.472 179.767 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.4 OUTLIER -154.2 -42.85 0.09 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.378 -0.826 . . . . 0.0 110.139 179.642 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.608 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.4 p-80 -118.24 127.75 54.03 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.09 -1.006 . . . . 0.0 110.364 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.604 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 37.6 t80 -86.86 128.07 35.04 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.387 0.613 . . . . 0.0 110.508 -178.65 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -92.59 -35.2 13.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.385 -0.822 . . . . 0.0 109.964 -179.758 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.604 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.22 -179.713 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.419 ' O ' HG13 ' A' ' 1' ' ' VAL . 9.3 p . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.254 0.549 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.534 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -147.26 147.16 30.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.916 . . . . 0.0 110.173 179.946 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.705 HD11 ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -147.8 156.73 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.28 -0.887 . . . . 0.0 110.161 -179.948 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.496 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.8 m -133.43 164.32 27.4 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.294 -0.879 . . . . 0.0 110.158 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 19' ' ' CYS . 10.6 tttt -126.41 155.05 42.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.205 -0.935 . . . . 0.0 110.181 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 60.2 m -99.91 -146.14 0.34 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.255 -0.903 . . . . 0.0 110.227 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.5 t -122.23 -164.42 1.16 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.294 -0.879 . . . . 0.0 110.221 179.912 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -87.13 11.52 13.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.227 -0.92 . . . . 0.0 110.321 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -121.98 26.35 8.63 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.24 -0.913 . . . . 0.0 110.188 179.938 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.4 14.16 4.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.297 -0.877 . . . . 0.0 110.138 179.935 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -102.47 66.5 0.98 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.931 . . . . 0.0 110.269 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.26 26.26 10.62 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -145.86 -55.8 0.29 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -1.133 . . . . 0.0 110.249 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.553 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.4 p -90.51 127.34 36.21 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.26 -0.9 . . . . 0.0 110.354 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.67 ' N ' HD23 ' A' ' 15' ' ' LEU . 3.5 mt -90.52 -44.88 9.29 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.231 -0.918 . . . . 0.0 110.344 179.885 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 18.0 m80 -110.51 89.38 3.01 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.318 -0.864 . . . . 0.0 110.487 -179.168 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.474 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.23 -161.46 31.55 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 179.931 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -134.14 149.3 51.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.292 -1.122 . . . . 0.0 110.229 179.881 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 2.3 t -79.9 120.29 23.93 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.216 -0.928 . . . . 0.0 110.027 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.705 ' CG2' HD11 ' A' ' 3' ' ' ILE . 21.2 mm -122.32 168.64 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 110.224 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.496 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 18.3 t80 -139.47 129.94 25.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 109.994 -179.988 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.608 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 3.6 mm? -90.06 134.42 34.26 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.214 -0.929 . . . . 0.0 110.638 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.534 HG11 ' HB3' ' A' ' 2' ' ' SER . 11.3 p -90.48 -25.58 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.269 -0.894 . . . . 0.0 110.541 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -78.34 -14.45 59.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.086 -1.009 . . . . 0.0 108.82 179.323 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.3 ttm -147.47 66.66 1.13 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.992 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.476 ' C ' ' O ' ' A' ' 25' ' ' MET . 58.8 p -29.21 88.57 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.675 0.75 . . . . 0.0 111.467 -178.437 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.39 146.38 15.26 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.493 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -55.81 161.55 2.15 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.132 -0.98 . . . . 0.0 110.388 -179.711 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.608 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 5.9 t80 -154.59 86.31 1.14 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.402 -0.811 . . . . 0.0 109.906 -179.908 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.553 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.2 m -82.8 104.71 13.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.188 -0.945 . . . . 0.0 110.53 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.494 ' HD3' ' N ' ' A' ' 32' ' ' CYS . 11.5 tpp85 -81.7 123.17 28.5 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.212 -0.93 . . . . 0.0 110.118 179.698 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.494 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 97.7 m -79.79 172.78 13.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.328 -0.858 . . . . 0.0 110.145 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -79.81 128.81 33.88 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.891 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.3 t -58.54 105.84 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.249 -0.907 . . . . 0.0 110.084 -179.937 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 1.019 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 145.17 -14.16 1.88 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.716 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.589 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.2 m-85 -79.75 154.24 28.67 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.344 -1.092 . . . . 0.0 109.903 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 1.152 HG23 ' CE1' ' A' ' 43' ' ' HIS . 5.1 t -109.42 46.58 0.99 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.954 -1.092 . . . . 0.0 110.782 -179.762 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.2 156.18 27.4 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.693 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.651 ' O ' HG22 ' A' ' 39' ' ' VAL . 10.6 p -87.11 37.2 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.261 -1.141 . . . . 0.0 109.753 179.609 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.593 ' NE ' ' HB2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.09 22.36 0.16 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.418 -0.801 . . . . 0.0 109.839 -179.483 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.486 ' C ' ' O ' ' A' ' 40' ' ' ARG . 4.2 p 29.74 91.5 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.609 -0.682 . . . . 0.0 111.645 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.593 ' HB2' ' NE ' ' A' ' 40' ' ' ARG . 0.7 OUTLIER -144.92 -36.91 0.3 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.552 -0.717 . . . . 0.0 109.906 179.382 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 1.152 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.0 p80 -124.21 117.78 25.35 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.164 -0.96 . . . . 0.0 109.9 178.798 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.615 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 46.2 t80 -79.58 103.09 9.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.73 -0.606 . . . . 0.0 110.218 -179.365 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.584 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -65.85 -28.47 69.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.43 -0.794 . . . . 0.0 110.15 -179.763 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 1.019 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.6 mt . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.342 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 12.9 p . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.313 0.578 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -151.26 129.77 12.17 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.194 -0.941 . . . . 0.0 110.201 179.979 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.548 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 1.7 tt -122.95 155.52 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.34 -0.85 . . . . 0.0 110.167 -179.997 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.537 ' CB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -119.77 -167.8 1.49 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.128 -0.983 . . . . 0.0 110.32 -179.959 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.4 mttp -126.36 -179.89 4.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.214 -0.929 . . . . 0.0 110.468 -179.825 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.71 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 1.9 m -114.95 -161.25 0.77 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.288 -0.882 . . . . 0.0 110.18 179.972 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.7 t -132.29 -144.84 0.25 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.121 -0.987 . . . . 0.0 110.442 -179.826 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 79.4 p -79.61 2.74 21.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.308 -0.87 . . . . 0.0 110.392 -179.821 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -96.93 28.41 3.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 109.868 179.849 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.494 ' HG3' ' HB2' ' A' ' 19' ' ' CYS . 8.9 tmm? -116.75 5.4 13.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.395 -0.816 . . . . 0.0 110.323 -179.676 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -90.02 60.74 4.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.207 -0.933 . . . . 0.0 109.923 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -157.17 -36.06 0.02 OUTLIER Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.576 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 43.4 t80 -93.86 -54.99 3.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.149 -1.206 . . . . 0.0 110.698 -179.692 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.577 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 19.2 p -117.83 117.07 28.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.081 -1.012 . . . . 0.0 110.607 -179.641 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.591 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 17.5 mt -91.33 -50.28 5.9 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.391 -0.818 . . . . 0.0 110.449 179.725 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CD2' ' OH ' ' A' ' 36' ' ' TYR . 6.8 m80 -98.45 79.03 2.46 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.498 -0.751 . . . . 0.0 110.342 -178.813 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.46 163.85 26.98 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -94.33 143.87 26.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.282 -1.128 . . . . 0.0 109.916 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.772 ' C ' HD13 ' A' ' 20' ' ' ILE . 8.1 t -98.68 153.01 19.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.2 -0.938 . . . . 0.0 110.571 -179.747 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.805 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -159.88 -174.51 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.491 -0.755 . . . . 0.0 109.9 -179.932 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.537 ' HB3' ' CB ' ' A' ' 4' ' ' THR . 15.1 t80 -133.21 129.46 37.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.198 -0.938 . . . . 0.0 110.1 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.662 HD23 ' CB ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -87.52 131.38 34.39 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.153 -0.967 . . . . 0.0 110.782 -179.714 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.9 p -90.7 -26.74 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.24 -0.913 . . . . 0.0 110.602 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -78.12 -14.52 59.45 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.111 -0.993 . . . . 0.0 108.927 179.264 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.537 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.3 mtt -148.19 67.32 1.09 Allowed 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.862 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.456 ' C ' ' O ' ' A' ' 25' ' ' MET . 64.1 p -29.87 87.83 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.59 0.71 . . . . 0.0 111.968 -178.446 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -158.18 165.43 34.93 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.583 -0.698 . . . . 0.0 109.843 179.497 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.43 113.48 14.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.485 -0.76 . . . . 0.0 110.441 -179.738 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.662 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.0 t80 -101.53 117.34 34.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.397 -0.815 . . . . 0.0 109.53 179.642 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.577 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.1 m -117.47 112.76 21.08 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.122 -0.986 . . . . 0.0 110.852 -179.181 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.494 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.4 tpp85 -86.97 110.17 19.86 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.309 -0.87 . . . . 0.0 109.629 179.267 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 84.9 m -79.53 -179.84 7.07 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.171 -0.956 . . . . 0.0 110.382 -179.602 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -82.72 115.85 21.83 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.28 -0.888 . . . . 0.0 110.291 -179.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.7 t -52.21 105.9 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.299 -0.876 . . . . 0.0 109.611 179.701 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 139.42 -4.7 2.84 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.782 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.605 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.27 163.92 24.54 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.019 -1.283 . . . . 0.0 109.567 179.756 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.868 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -97.71 27.22 4.51 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.832 -1.167 . . . . 0.0 110.077 -179.834 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.09 152.94 23.85 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 179.545 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.592 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.9 p -84.15 44.0 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.198 -1.178 . . . . 0.0 109.952 -179.969 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.587 ' NH1' ' CG ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -160.14 20.29 0.16 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.307 -0.871 . . . . 0.0 110.531 -179.537 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.605 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.8 p 33.54 93.66 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.576 -0.702 . . . . 0.0 111.792 179.926 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.587 ' CG ' ' NH1' ' A' ' 40' ' ' ARG . 1.7 tm-20 -151.13 -40.32 0.12 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.531 -0.73 . . . . 0.0 109.655 179.127 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.868 ' CE1' HG23 ' A' ' 37' ' ' THR . 3.8 p80 -122.82 112.43 17.88 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.911 0.862 . . . . 0.0 108.714 178.622 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 20.4 t80 -78.54 108.7 12.11 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.674 0.75 . . . . 0.0 110.126 -178.441 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.556 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -66.15 -9.75 34.52 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.431 0.634 . . . . 0.0 109.982 -179.492 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.618 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 4.9 mt . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.203 -179.718 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 88.4 t . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.083 0.468 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.447 ' HB3' ' CG1' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -122.54 51.2 1.41 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.226 -0.921 . . . . 0.0 110.172 179.828 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.558 HD11 ' HB ' ' A' ' 20' ' ' ILE . 1.1 tt -138.8 154.69 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.277 -0.89 . . . . 0.0 110.146 -179.95 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.2 m -127.73 161.52 28.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 -179.991 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.03 178.79 7.71 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.272 -0.892 . . . . 0.0 110.31 -179.903 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.846 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 68.7 m -109.66 -147.53 0.42 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.253 -0.905 . . . . 0.0 110.075 179.936 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 t -133.99 -167.64 1.99 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.255 -0.903 . . . . 0.0 110.119 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.6 t -83.96 12.69 5.84 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.267 -0.896 . . . . 0.0 110.274 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -132.25 23.98 4.49 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.299 -0.876 . . . . 0.0 110.253 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -121.82 -5.27 9.11 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.246 -0.909 . . . . 0.0 110.213 -179.976 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -90.88 54.16 2.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.277 -0.89 . . . . 0.0 110.272 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -119.43 0.44 14.16 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -106.92 -64.92 1.13 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.197 -1.178 . . . . 0.0 110.26 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.2 p -84.53 124.54 31.51 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.209 -0.932 . . . . 0.0 110.351 -179.926 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.598 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.5 mt -90.07 -44.36 9.87 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.269 -0.895 . . . . 0.0 110.273 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.598 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 3.6 m80 -114.62 92.04 3.82 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.29 -0.881 . . . . 0.0 110.159 -179.719 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.467 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.53 -169.43 42.4 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.997 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -110.49 143.91 40.11 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.28 -1.129 . . . . 0.0 110.165 179.853 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.846 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 1.0 OUTLIER -95.92 128.69 43.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.316 -0.865 . . . . 0.0 110.419 -179.903 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.8 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -146.46 -171.82 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.305 -0.872 . . . . 0.0 110.008 179.878 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.439 ' O ' HG13 ' A' ' 3' ' ' ILE . 17.5 t80 -142.83 135.13 27.46 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.334 -0.854 . . . . 0.0 109.811 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.629 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.4 mm? -87.62 129.61 35.06 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.046 -1.034 . . . . 0.0 110.839 -179.589 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.447 ' CG1' ' HB3' ' A' ' 2' ' ' SER . 8.9 p -90.71 -24.98 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.247 -0.908 . . . . 0.0 110.454 179.746 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -78.31 -12.13 59.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.994 -1.066 . . . . 0.0 108.802 179.206 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.0 OUTLIER -151.78 68.83 0.9 Allowed 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 178.915 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 56.0 p -29.19 89.78 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.791 0.805 . . . . 0.0 111.412 -178.545 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.531 ' HG3' ' N ' ' A' ' 28' ' ' ASN . 1.5 tt0 -159.88 148.13 17.16 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.621 -0.674 . . . . 0.0 109.562 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.531 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 15.9 p30 -61.46 126.46 27.43 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.253 -0.904 . . . . 0.0 110.42 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.629 ' CB ' HD23 ' A' ' 22' ' ' LEU . 9.8 t80 -118.85 133.82 55.58 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.35 -0.844 . . . . 0.0 109.705 179.696 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.586 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.0 m -135.95 113.92 11.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.096 -1.002 . . . . 0.0 110.594 -179.561 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.467 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.2 tpp180 -81.78 106.07 13.42 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.215 -0.928 . . . . 0.0 109.587 179.373 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 94.1 m -79.49 171.34 15.29 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.255 -0.903 . . . . 0.0 110.186 -179.763 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.423 ' CG ' ' H ' ' A' ' 35' ' ' GLY . 15.4 tt0 -78.91 129.45 34.53 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.222 -0.924 . . . . 0.0 109.662 179.873 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.407 HG23 ' H ' ' A' ' 34' ' ' VAL . 11.8 t -66.12 -14.72 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.332 -0.855 . . . . 0.0 110.287 -179.542 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.423 ' H ' ' CG ' ' A' ' 33' ' ' GLU . . . -69.17 -17.42 72.01 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.836 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.491 ' CE1' ' N ' ' A' ' 43' ' ' HIS . 1.5 m-85 -79.92 166.39 21.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.326 -1.102 . . . . 0.0 110.065 179.828 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.95 HG23 ' CE1' ' A' ' 43' ' ' HIS . 14.2 t -102.39 29.22 5.33 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.979 -1.076 . . . . 0.0 110.516 -179.788 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.42 160.28 31.63 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 179.778 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.545 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.8 p -84.7 43.73 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.121 -1.223 . . . . 0.0 109.897 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.567 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -148.99 12.18 0.85 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.381 -0.825 . . . . 0.0 110.279 -179.384 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.559 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 6.9 p 32.05 87.85 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.608 -0.683 . . . . 0.0 110.493 -179.67 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.567 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 2.1 tt0 -160.32 -33.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.214 -0.929 . . . . 0.0 111.023 -179.515 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.95 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.4 p80 -126.72 119.25 26.49 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.708 -1.245 . . . . 0.0 111.937 -179.677 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.546 ' CE2' ' C ' ' A' ' 46' ' ' LEU . 44.4 t80 -87.24 92.15 8.96 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.091 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.869 ' CE2' HD11 ' A' ' 46' ' ' LEU . 0.4 OUTLIER -66.85 -5.39 12.17 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.443 -0.786 . . . . 0.0 110.72 -179.012 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.869 HD11 ' CE2' ' A' ' 45' ' ' PHE . 2.2 mm? . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.072 -1.018 . . . . 0.0 110.192 -179.865 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 61.7 t . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.229 0.538 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.53 ' HA ' ' CB ' ' A' ' 23' ' ' VAL . 1.0 OUTLIER -160.04 -160.43 0.8 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.235 -0.915 . . . . 0.0 110.145 -179.95 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.475 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 2.2 tt -79.56 148.6 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.266 -0.896 . . . . 0.0 110.341 179.975 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -160.98 -178.32 6.72 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.297 -0.877 . . . . 0.0 110.636 179.68 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -97.8 -178.71 4.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.465 -0.772 . . . . 0.0 110.27 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 49.0 m -98.13 -93.98 0.23 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.274 -0.891 . . . . 0.0 110.287 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.45 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 172.45 -167.2 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.097 -1.002 . . . . 0.0 110.122 -179.927 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.426 ' O ' ' N ' ' A' ' 10' ' ' MET . 6.6 t -80.1 169.63 17.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -0.904 . . . . 0.0 110.096 179.927 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 8' ' ' SER . 25.7 t70 43.13 26.25 0.08 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.146 -0.971 . . . . 0.0 110.214 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.426 ' N ' ' O ' ' A' ' 8' ' ' SER . 1.3 ttt -123.6 3.03 8.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.247 -0.908 . . . . 0.0 110.226 179.906 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.449 ' OD1' ' SG ' ' A' ' 14' ' ' CYS . 8.7 m-80 -101.97 70.42 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.896 . . . . 0.0 110.035 179.883 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.61 -24.29 14.08 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.871 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -86.7 -64.32 1.17 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.171 -1.194 . . . . 0.0 110.112 -179.989 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.6 p -81.34 119.45 23.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.287 -0.883 . . . . 0.0 110.382 -179.677 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.578 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 5.5 mt -90.62 -46.15 8.46 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.196 -0.94 . . . . 0.0 110.676 -179.882 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.598 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 12.3 m80 -111.72 78.63 1.14 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.168 -0.957 . . . . 0.0 110.353 -178.932 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.428 ' HA3' ' HA ' ' A' ' 32' ' ' CYS . . . 178.72 -160.9 26.99 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.963 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -127.56 138.7 52.96 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.401 -1.058 . . . . 0.0 110.221 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.864 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -81.5 134.88 35.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.246 -0.909 . . . . 0.0 110.199 179.969 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.864 HD13 ' O ' ' A' ' 19' ' ' CYS . 24.3 mm -142.59 172.81 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.262 -0.899 . . . . 0.0 110.262 -179.908 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.477 ' CD1' ' C ' ' A' ' 21' ' ' TYR . 8.8 t80 -137.03 138.25 40.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.242 -0.911 . . . . 0.0 109.58 179.866 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.594 HD23 ' HB2' ' A' ' 29' ' ' TYR . 3.3 mm? -100.51 136.42 40.42 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.973 -1.079 . . . . 0.0 111.28 -179.26 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.53 ' CB ' ' HA ' ' A' ' 2' ' ' SER . 10.7 p -90.72 -27.18 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.509 -0.744 . . . . 0.0 110.497 179.847 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.24 -17.21 56.99 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.122 -0.986 . . . . 0.0 108.886 179.426 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.532 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.9 mtm -143.38 64.86 1.33 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.726 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.465 ' C ' ' O ' ' A' ' 25' ' ' MET . 66.1 p -29.12 88.4 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.699 0.761 . . . . 0.0 111.733 -178.32 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.532 ' N ' ' O ' ' A' ' 25' ' ' MET . 4.4 pt20 -160.39 177.79 10.24 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.659 -0.651 . . . . 0.0 109.444 179.557 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -81.1 156.08 25.96 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.233 -0.917 . . . . 0.0 110.235 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.594 ' HB2' HD23 ' A' ' 22' ' ' LEU . 2.8 t80 -150.22 95.34 2.26 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.307 -0.871 . . . . 0.0 110.132 -179.959 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.612 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 4.0 m -102.36 106.9 17.75 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.195 -0.941 . . . . 0.0 110.105 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.3 tpp85 -79.52 97.93 6.64 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.177 -0.952 . . . . 0.0 109.504 179.602 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 77.9 m -79.73 175.91 10.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.445 -0.785 . . . . 0.0 110.525 -179.39 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 35' ' ' GLY . 10.6 tt0 -79.85 124.76 28.93 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.395 -0.815 . . . . 0.0 109.618 179.864 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.413 ' H ' HG23 ' A' ' 34' ' ' VAL . 14.1 t -65.16 -9.0 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.388 -0.82 . . . . 0.0 110.335 -179.423 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.719 ' O ' HD12 ' A' ' 46' ' ' LEU . . . -78.48 -3.22 86.13 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 179.863 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.598 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.9 OUTLIER -79.9 168.22 19.53 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.036 -1.273 . . . . 0.0 109.684 179.75 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.934 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -108.22 32.09 5.06 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.929 -1.107 . . . . 0.0 110.784 -179.595 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -147.93 171.38 28.45 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.269 -1.532 . . . . 0.0 109.269 179.437 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.407 ' O ' HG22 ' A' ' 39' ' ' VAL . 9.0 p -86.18 21.13 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.17 -1.194 . . . . 0.0 109.946 179.828 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.544 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 41.0 ttp180 -137.48 -95.62 0.21 Allowed 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.285 -0.885 . . . . 0.0 110.03 -179.674 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.9 p 163.62 73.04 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.78 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.544 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 2.0 tt0 -133.71 -28.93 1.37 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.418 -0.801 . . . . 0.0 110.673 -179.48 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.934 ' CE1' HG23 ' A' ' 37' ' ' THR . 3.5 p80 -128.34 113.46 15.64 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.907 -1.121 . . . . 0.0 109.922 179.236 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.62 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 37.2 t80 -79.41 106.43 11.44 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.463 0.649 . . . . 0.0 110.041 -179.253 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.86 -29.46 70.41 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.286 -0.884 . . . . 0.0 109.936 -179.679 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.719 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.4 mt . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.244 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 1' ' ' VAL . 7.2 p . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.248 0.547 . . . . 0.0 110.21 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.404 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.7 OUTLIER -110.72 81.45 1.44 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.253 -0.905 . . . . 0.0 110.114 179.922 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.571 HD11 ' HB ' ' A' ' 20' ' ' ILE . 2.8 tt -144.74 156.1 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.211 -0.931 . . . . 0.0 110.308 -179.816 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.26 157.16 25.36 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.902 . . . . 0.0 110.244 179.919 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -96.19 165.46 12.21 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.231 -0.918 . . . . 0.0 110.219 -179.987 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.714 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 84.3 m -109.26 -152.86 0.5 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 110.342 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.94 -170.45 2.24 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.268 -0.895 . . . . 0.0 110.294 -179.916 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 m -85.24 11.55 9.8 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.904 . . . . 0.0 110.097 179.864 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.36 16.23 11.37 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.9 . . . . 0.0 110.114 -179.903 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.67 20.86 9.36 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.254 -0.904 . . . . 0.0 110.286 -179.87 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.09 72.47 1.09 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.171 -0.956 . . . . 0.0 110.236 -179.988 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -120.51 2.04 12.45 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.466 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 24.7 t80 -119.65 -57.4 1.98 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.184 -1.186 . . . . 0.0 110.246 179.964 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.588 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 24.4 p -90.33 121.65 32.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.237 -0.914 . . . . 0.0 110.366 -179.951 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.621 ' N ' HD23 ' A' ' 15' ' ' LEU . 3.9 mt -90.72 -56.98 2.98 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.152 -0.968 . . . . 0.0 110.714 -179.853 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.593 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 13.2 m80 -100.21 83.74 2.72 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.259 -0.901 . . . . 0.0 110.395 -178.885 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.516 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 176.53 -160.4 27.9 Favored Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.846 -1.301 . . . . 0.0 109.846 -179.8 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.404 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 2.2 mm100 -124.7 147.43 48.6 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.356 -1.085 . . . . 0.0 110.192 -179.968 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.714 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 4.7 t -93.73 130.12 39.81 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.382 -0.824 . . . . 0.0 110.318 -179.961 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.824 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -142.66 -176.95 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.42 -0.8 . . . . 0.0 109.978 179.867 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.471 ' O ' HG13 ' A' ' 3' ' ' ILE . 9.7 t80 -143.47 124.81 14.66 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.152 -0.968 . . . . 0.0 109.957 -179.92 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.529 HD22 ' HD2' ' A' ' 29' ' ' TYR . 1.9 mp -79.49 128.36 33.26 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.003 -1.061 . . . . 0.0 111.317 -179.269 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.404 HG11 ' HB3' ' A' ' 2' ' ' SER . 5.5 p -90.38 -26.16 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.688 -0.633 . . . . 0.0 110.417 179.788 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -78.17 -11.89 59.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.099 -1.001 . . . . 0.0 108.659 178.951 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 10.0 ttm -150.55 68.24 0.96 Allowed 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.929 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 13.7 p -29.19 89.86 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 121.745 0.783 . . . . 0.0 111.344 -178.471 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.1 147.65 18.14 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.738 -0.602 . . . . 0.0 109.725 -179.965 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.528 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.0 m-20 -64.87 124.49 22.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.442 -0.786 . . . . 0.0 110.133 -179.953 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.529 ' HD2' HD22 ' A' ' 22' ' ' LEU . 4.8 t80 -116.54 132.43 56.68 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.413 -0.805 . . . . 0.0 109.931 -179.866 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.588 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -129.64 112.63 13.87 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.092 -1.005 . . . . 0.0 110.374 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.516 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.7 OUTLIER -86.0 115.04 23.36 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.255 -0.903 . . . . 0.0 109.451 179.389 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.702 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 91.9 m -78.89 179.41 7.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.15 -0.969 . . . . 0.0 110.61 -179.408 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.463 ' OE2' ' CE1' ' A' ' 44' ' ' PHE . 22.3 tt0 -83.89 116.51 22.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.392 -0.818 . . . . 0.0 110.404 -179.543 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.1 t -52.43 101.67 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.192 -0.943 . . . . 0.0 109.555 179.523 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.905 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 147.9 -10.61 1.22 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.61 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.593 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.4 m-85 -78.78 160.21 27.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.897 -1.354 . . . . 0.0 109.465 179.769 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 1.109 HG23 ' CE1' ' A' ' 43' ' ' HIS . 1.0 OUTLIER -105.72 -4.62 20.74 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.841 -1.162 . . . . 0.0 111.125 -179.084 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.527 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -98.34 140.89 15.28 Favored Glycine 0 N--CA 1.488 2.11 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.778 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.425 ' C ' ' O ' ' A' ' 38' ' ' GLY . 8.5 p -44.85 -25.73 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.133 -1.216 . . . . 0.0 108.807 179.072 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.546 ' CZ ' ' HB2' ' A' ' 42' ' ' GLU . 7.4 ttp180 -102.15 -130.67 0.25 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.218 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.702 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -151.72 75.64 1.16 Allowed 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 179.011 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.546 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 0.9 OUTLIER -123.82 -29.9 3.62 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.394 -0.816 . . . . 0.0 110.336 -179.264 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 1.109 ' CE1' HG23 ' A' ' 37' ' ' THR . 3.0 p80 -130.45 117.09 19.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.961 -1.087 . . . . 0.0 110.05 179.443 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.618 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 44.6 t80 -79.28 104.38 9.86 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 121.494 0.664 . . . . 0.0 110.002 -179.351 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.585 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.67 -32.87 74.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.466 -0.771 . . . . 0.0 110.172 -179.515 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.905 HD12 ' O ' ' A' ' 35' ' ' GLY . 2.9 mt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.248 179.963 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 97.8 t . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.331 0.586 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.671 ' H ' HG11 ' A' ' 23' ' ' VAL . 16.5 t -80.06 84.44 5.79 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.12 -0.988 . . . . 0.0 110.222 -179.985 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.797 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -79.81 149.58 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.328 -0.858 . . . . 0.0 110.124 179.964 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -119.0 161.3 20.45 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 110.241 -179.949 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -110.38 165.9 11.41 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.333 -0.854 . . . . 0.0 110.206 179.957 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 72.5 m -112.96 -155.59 0.57 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.229 -0.919 . . . . 0.0 110.206 -179.991 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 m -135.61 -164.13 1.49 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.256 -0.903 . . . . 0.0 110.318 179.961 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.53 10.3 13.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 0.0 110.216 -179.983 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -123.13 19.23 9.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 0.0 110.181 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.79 23.06 2.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.893 . . . . 0.0 110.175 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -106.25 68.3 0.76 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.221 -0.924 . . . . 0.0 110.206 -179.978 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -109.22 43.65 1.67 Allowed Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 179.948 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -156.93 -58.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.297 -1.119 . . . . 0.0 110.204 -179.914 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.6 p -91.15 118.87 30.79 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.265 -0.897 . . . . 0.0 110.295 -179.912 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.59 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 9.8 mt -90.43 -43.13 10.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.117 -0.99 . . . . 0.0 110.325 179.8 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 7.9 m80 -111.65 78.02 1.09 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.251 -0.905 . . . . 0.0 110.163 -179.486 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 176.07 -171.02 44.06 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -114.44 146.41 40.67 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.2 -1.176 . . . . 0.0 110.326 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.619 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 4.4 t -84.47 147.47 27.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.322 -0.861 . . . . 0.0 110.037 179.805 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.809 HD12 ' CD1' ' A' ' 29' ' ' TYR . 0.7 OUTLIER -155.35 -177.59 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.147 -0.971 . . . . 0.0 110.107 -179.805 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.502 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 14.8 t80 -142.36 132.66 24.88 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.282 -0.886 . . . . 0.0 109.98 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.633 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.5 mm? -94.47 134.5 36.94 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.126 -0.984 . . . . 0.0 111.016 -179.339 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.671 HG11 ' H ' ' A' ' 2' ' ' SER . 10.7 p -90.92 -24.94 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.297 -0.877 . . . . 0.0 110.524 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.547 ' OD2' HD12 ' A' ' 22' ' ' LEU . 3.3 p30 -78.56 -15.68 58.29 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.044 -1.035 . . . . 0.0 108.956 179.314 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.544 ' O ' ' N ' ' A' ' 27' ' ' GLN . 4.5 ttp -146.01 66.48 1.2 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 178.899 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -29.91 88.56 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 122.001 0.905 . . . . 0.0 111.877 -178.223 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 tt0 -160.86 173.79 14.82 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 121.318 0.58 . . . . 0.0 109.935 179.401 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -77.19 140.99 40.3 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.462 -0.774 . . . . 0.0 110.23 -179.962 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.809 ' CD1' HD12 ' A' ' 20' ' ' ILE . 9.8 t80 -135.64 113.94 11.51 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.356 -0.84 . . . . 0.0 110.031 179.894 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 15.4 m -117.85 116.97 28.03 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.045 -1.034 . . . . 0.0 110.41 -179.809 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.432 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 10.2 tpp85 -79.49 118.34 21.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.155 -0.966 . . . . 0.0 109.447 179.431 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.513 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 95.7 m -79.52 170.76 16.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.392 -0.818 . . . . 0.0 110.573 -179.329 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -79.48 117.14 20.16 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.358 -0.839 . . . . 0.0 109.968 179.974 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.415 HG23 ' H ' ' A' ' 34' ' ' VAL . 36.4 t -50.13 103.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.296 -0.877 . . . . 0.0 109.686 179.966 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.74 -12.75 1.32 Allowed Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.67 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.32 172.14 14.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.203 -1.175 . . . . 0.0 109.648 179.85 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.935 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -107.72 29.78 6.91 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.906 -1.121 . . . . 0.0 110.524 179.974 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.55 160.08 31.5 Favored Glycine 0 N--CA 1.489 2.186 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.547 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.617 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.7 p -88.88 27.09 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.177 -1.19 . . . . 0.0 109.536 179.321 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.559 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -132.95 14.31 4.29 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.48 -0.762 . . . . 0.0 109.738 -179.667 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.513 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 4.9 p 32.62 87.63 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 121.467 0.651 . . . . 0.0 110.601 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.559 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 1.1 tp10 -156.09 -34.81 0.09 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.405 -0.809 . . . . 0.0 110.644 -179.61 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.935 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.4 p80 -120.46 119.21 32.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.882 -1.136 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.632 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 17.3 t80 -84.21 111.74 19.64 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-O 121.247 0.546 . . . . 0.0 109.859 -179.728 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.574 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -68.43 -23.71 64.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.285 -0.884 . . . . 0.0 109.655 -179.78 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.632 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.8 mt . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.269 -179.819 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.405 HG23 ' N ' ' A' ' 2' ' ' SER . 17.6 m . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.258 0.551 . . . . 0.0 110.214 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.759 ' HB2' HG11 ' A' ' 23' ' ' VAL . 2.6 m -132.78 107.1 8.14 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.217 -0.927 . . . . 0.0 110.403 -179.95 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 1.084 HD11 HD12 ' A' ' 20' ' ' ILE . 1.7 tt -129.51 157.37 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.294 -0.879 . . . . 0.0 109.991 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -121.57 168.06 12.17 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.212 -0.93 . . . . 0.0 110.262 -179.913 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.29 159.51 14.9 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.206 -0.934 . . . . 0.0 110.234 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.606 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 65.1 m -104.59 -147.99 0.4 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.242 -0.911 . . . . 0.0 110.147 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -127.48 -171.4 2.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.247 -0.908 . . . . 0.0 110.212 -179.934 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.8 t -79.81 -55.42 5.0 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.253 -0.904 . . . . 0.0 110.167 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -63.07 -11.3 18.67 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.242 -0.911 . . . . 0.0 110.149 179.906 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.7 ttm -88.14 27.37 1.22 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.253 -0.905 . . . . 0.0 110.225 -179.986 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -121.85 69.89 0.94 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.219 -0.926 . . . . 0.0 110.232 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -119.7 3.29 13.44 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -108.77 -50.53 3.0 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.159 -1.201 . . . . 0.0 110.182 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 22.3 p -104.07 120.09 40.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.216 -0.928 . . . . 0.0 110.271 179.932 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.589 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 10.1 mt -90.17 -43.22 10.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.298 -0.876 . . . . 0.0 110.519 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.589 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.6 m80 -110.53 86.88 2.4 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.134 -0.979 . . . . 0.0 110.258 -179.503 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.464 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 172.68 -131.39 2.11 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.968 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 2.9 pt20 -160.35 149.71 17.47 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.233 -1.157 . . . . 0.0 110.236 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.607 ' O ' HG23 ' A' ' 20' ' ' ILE . 1.2 t -94.54 147.54 23.17 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.195 -0.941 . . . . 0.0 110.194 179.948 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.102 HD11 ' CD1' ' A' ' 29' ' ' TYR . 19.0 pt -157.7 167.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.302 -0.874 . . . . 0.0 110.063 179.96 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.508 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 12.4 t80 -120.36 118.84 31.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.205 -0.934 . . . . 0.0 110.065 -179.983 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.786 HD11 ' CD2' ' A' ' 29' ' ' TYR . 11.3 mt -83.45 135.89 34.51 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.242 -0.912 . . . . 0.0 110.766 -179.751 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.759 HG11 ' HB2' ' A' ' 2' ' ' SER . 7.2 p -88.32 -29.0 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.398 -0.814 . . . . 0.0 110.078 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -78.41 -22.8 47.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.208 -0.933 . . . . 0.0 108.716 179.191 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 27' ' ' GLN . 1.1 mmt -134.23 61.14 1.68 Allowed 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 178.526 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.466 ' C ' ' O ' ' A' ' 25' ' ' MET . 3.2 p -28.74 86.2 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 121.576 0.703 . . . . 0.0 111.883 -178.46 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.554 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 pt20 -161.21 167.56 25.83 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.576 -0.702 . . . . 0.0 109.556 179.526 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.455 ' OD1' ' O ' ' A' ' 28' ' ' ASN . 7.0 p30 -82.51 90.58 6.77 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.327 -0.858 . . . . 0.0 109.787 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 1.102 ' CD1' HD11 ' A' ' 20' ' ' ILE . 5.4 t80 -79.7 131.92 36.07 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.405 -0.809 . . . . 0.0 110.283 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -120.58 113.21 19.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.169 -0.957 . . . . 0.0 110.368 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.536 ' NE ' ' HA ' ' A' ' 31' ' ' ARG . 3.0 tpm_? -81.73 116.95 21.67 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.193 -0.942 . . . . 0.0 109.461 179.452 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.506 ' SG ' ' N ' ' A' ' 41' ' ' CYS . 66.9 m -79.06 173.63 12.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.279 -0.888 . . . . 0.0 110.136 -179.793 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -79.42 111.65 15.89 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.284 -0.885 . . . . 0.0 109.909 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.3 t -49.15 103.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.446 -0.784 . . . . 0.0 109.727 -179.959 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 141.71 -7.28 2.46 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -179.741 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.558 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.25 179.97 7.09 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.175 -1.191 . . . . 0.0 109.796 179.853 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.617 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -116.5 23.91 11.71 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.915 -1.116 . . . . 0.0 110.731 -179.629 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -149.65 157.78 27.38 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.545 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.528 ' O ' HG13 ' A' ' 39' ' ' VAL . 8.6 p -85.78 40.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.248 -1.149 . . . . 0.0 109.797 179.557 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.56 ' NE ' ' CB ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.03 21.07 0.16 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.452 -0.78 . . . . 0.0 109.973 -179.522 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.506 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 8.8 p 32.32 84.85 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.665 -0.647 . . . . 0.0 110.745 -179.702 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.56 ' CB ' ' NE ' ' A' ' 40' ' ' ARG . 23.8 tt0 -146.01 -41.53 0.21 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.405 -0.809 . . . . 0.0 109.967 -179.878 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.617 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.8 p-80 -119.43 128.69 54.26 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.11 -0.994 . . . . 0.0 110.372 179.598 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.617 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 34.4 t80 -86.68 130.32 34.53 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 121.383 0.611 . . . . 0.0 110.434 -178.504 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.557 ' CB ' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -91.64 -37.29 13.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 109.849 -179.878 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.617 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.3 mt . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.201 -179.663 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 42.2 t . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.26 0.553 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.415 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.1 OUTLIER -140.98 114.33 8.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.264 -0.897 . . . . 0.0 110.336 -179.975 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.68 HD11 ' HB ' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -128.19 150.25 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.259 -0.901 . . . . 0.0 110.086 179.841 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -118.77 -163.61 0.97 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.206 -0.934 . . . . 0.0 110.173 179.93 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -130.74 154.4 48.0 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.13 -0.981 . . . . 0.0 110.352 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.566 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 94.6 m -83.81 -165.35 1.1 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.408 -0.807 . . . . 0.0 110.239 179.926 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.48 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.4 OUTLIER -125.69 -158.41 0.84 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.301 -0.874 . . . . 0.0 110.114 179.812 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.48 ' N ' ' OG ' ' A' ' 7' ' ' SER . 2.8 m -79.93 168.97 18.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.154 -0.967 . . . . 0.0 110.126 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 50.48 20.94 0.76 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.206 -0.934 . . . . 0.0 110.235 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tpp -122.85 -15.52 7.38 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.201 -0.937 . . . . 0.0 110.181 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -89.16 52.48 2.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.315 -0.866 . . . . 0.0 110.354 -179.941 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -109.63 1.94 30.63 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.447 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 45.9 t80 -93.4 -57.3 2.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.203 -1.175 . . . . 0.0 110.128 179.999 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.3 p -97.54 119.74 36.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.271 -0.893 . . . . 0.0 110.111 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 7.3 mt -90.24 -45.18 9.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.221 -0.924 . . . . 0.0 110.303 -179.999 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.569 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.5 m80 -108.59 85.71 2.16 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.297 -0.877 . . . . 0.0 110.224 -179.591 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.489 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 169.82 -174.75 44.05 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.03 145.76 30.97 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.268 -1.136 . . . . 0.0 110.311 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.566 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 5.6 t -96.08 130.07 43.19 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.365 -0.834 . . . . 0.0 110.385 -179.932 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.804 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.7 177.53 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.372 -0.83 . . . . 0.0 110.102 179.994 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.501 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 13.8 t80 -128.0 135.14 49.49 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.289 -0.882 . . . . 0.0 109.703 179.707 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.675 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.2 mm? -92.86 132.86 36.64 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.979 -1.076 . . . . 0.0 111.149 -179.309 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.415 HG11 ' CB ' ' A' ' 2' ' ' SER . 9.1 p -90.87 -31.7 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.461 -0.775 . . . . 0.0 110.586 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -78.06 -19.67 53.82 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.124 -0.985 . . . . 0.0 108.78 179.403 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 27' ' ' GLN . 35.8 mtt -137.19 61.56 1.62 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.608 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.484 ' C ' ' O ' ' A' ' 25' ' ' MET . 89.5 p -29.21 87.79 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 121.614 0.721 . . . . 0.0 111.584 -178.499 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.557 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.4 pt20 -160.73 171.46 18.81 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.66 -0.65 . . . . 0.0 109.648 179.689 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -79.72 115.86 19.56 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.447 -0.783 . . . . 0.0 110.292 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.675 ' CB ' HD23 ' A' ' 22' ' ' LEU . 5.7 t80 -105.67 141.47 37.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.349 -0.844 . . . . 0.0 109.717 179.804 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 14.3 m -141.58 112.05 7.02 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.017 -1.052 . . . . 0.0 110.694 -179.562 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.489 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.5 OUTLIER -81.04 112.84 18.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.207 -0.933 . . . . 0.0 109.427 179.291 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.529 ' HG ' ' CB ' ' A' ' 41' ' ' CYS . 95.8 m -79.36 172.4 13.85 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.307 -0.871 . . . . 0.0 110.519 -179.507 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -79.39 114.03 18.0 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.441 -0.787 . . . . 0.0 109.965 -179.849 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.422 HG23 ' H ' ' A' ' 34' ' ' VAL . 41.1 t -46.08 102.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.27 -0.894 . . . . 0.0 109.709 179.961 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.36 -13.1 1.4 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -179.666 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.568 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -79.28 176.03 10.05 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.162 -1.199 . . . . 0.0 109.852 179.892 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.604 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -117.29 26.33 9.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.906 -1.121 . . . . 0.0 110.784 -179.78 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -147.66 160.5 28.32 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.819 -1.313 . . . . 0.0 109.819 179.607 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.717 HG12 ' O ' ' A' ' 39' ' ' VAL . 69.9 t -86.8 19.14 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.325 -1.103 . . . . 0.0 109.818 179.59 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.549 ' NH2' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -140.23 21.72 2.41 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.522 -0.736 . . . . 0.0 109.672 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.529 ' CB ' ' HG ' ' A' ' 32' ' ' CYS . 5.9 p 32.31 93.04 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 CA-C-O 121.493 0.663 . . . . 0.0 111.118 179.711 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.549 ' HB3' ' NH2' ' A' ' 40' ' ' ARG . 30.1 tt0 -156.61 -38.04 0.08 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.358 -0.839 . . . . 0.0 110.232 179.714 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.604 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 1.2 p-80 -117.36 129.59 55.96 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.029 -1.044 . . . . 0.0 110.611 179.92 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.624 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.5 t80 -88.13 130.28 35.08 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.433 0.635 . . . . 0.0 110.376 -178.737 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CD2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -94.39 -33.45 13.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.454 -0.779 . . . . 0.0 110.277 -179.65 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.624 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.2 mt . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.291 -179.745 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.687 HG22 ' O ' ' A' ' 1' ' ' VAL . 6.2 p . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.195 0.522 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -139.26 49.56 1.83 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.323 -0.861 . . . . 0.0 110.227 179.998 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.698 HG12 HG22 ' A' ' 20' ' ' ILE . 9.5 tt -83.37 166.48 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.315 -0.866 . . . . 0.0 110.185 -179.987 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 4.2 m -137.98 165.47 26.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.197 -0.939 . . . . 0.0 110.547 -179.631 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -91.83 154.39 18.93 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.241 -0.912 . . . . 0.0 110.223 179.892 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.72 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 60.7 m -91.71 -141.15 0.18 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.32 -0.863 . . . . 0.0 110.259 -179.984 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.519 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.5 OUTLIER -159.47 -155.2 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.286 -0.884 . . . . 0.0 109.962 -179.931 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.519 ' N ' ' OG ' ' A' ' 7' ' ' SER . 0.1 OUTLIER -79.67 166.47 21.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.063 -1.023 . . . . 0.0 109.871 179.936 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 50.84 20.86 0.83 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.083 -1.01 . . . . 0.0 110.19 -179.822 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.99 14.23 5.76 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.175 -0.953 . . . . 0.0 110.202 -179.866 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.4 ' OD1' ' N ' ' A' ' 11' ' ' ASN . 10.3 m-20 -118.35 -141.11 0.36 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.236 -0.915 . . . . 0.0 110.389 -179.878 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.14 49.57 3.03 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.286 -1.526 . . . . 0.0 109.286 -179.817 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.682 ' OH ' HG23 ' A' ' 39' ' ' VAL . 8.6 t80 -155.0 -70.27 0.12 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.314 -1.109 . . . . 0.0 109.938 -179.819 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.486 ' C ' HD23 ' A' ' 15' ' ' LEU . 25.3 p -87.87 125.99 34.78 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.072 -1.017 . . . . 0.0 110.33 179.74 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.62 ' N ' HD23 ' A' ' 15' ' ' LEU . 3.9 mt -90.19 -49.04 6.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.19 -0.943 . . . . 0.0 110.142 179.765 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.54 ' ND1' ' HB2' ' A' ' 15' ' ' LEU . 10.4 m80 -104.83 77.21 1.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.219 -0.926 . . . . 0.0 110.112 -179.838 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.504 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -176.98 -178.97 47.14 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.868 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.53 140.46 41.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.255 -1.144 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.72 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 8.4 t -79.76 147.66 31.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.197 -0.939 . . . . 0.0 109.828 179.854 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.698 HG22 HG12 ' A' ' 3' ' ' ILE . 0.3 OUTLIER -154.22 -170.0 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.152 -0.968 . . . . 0.0 110.001 -179.693 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.5 ' O ' HG13 ' A' ' 3' ' ' ILE . 8.6 t80 -147.88 128.39 14.07 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.077 -1.014 . . . . 0.0 109.857 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.651 HD23 ' CD2' ' A' ' 29' ' ' TYR . 0.8 OUTLIER -84.19 131.78 34.73 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.196 -0.94 . . . . 0.0 111.103 -179.31 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.6 p -90.54 -28.31 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.343 -0.848 . . . . 0.0 110.587 179.732 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.52 ' OD2' ' CD1' ' A' ' 22' ' ' LEU . 1.9 p30 -78.43 -15.25 58.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.019 -1.05 . . . . 0.0 108.789 179.229 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -144.45 65.55 1.28 Allowed 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 178.733 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.487 ' C ' ' O ' ' A' ' 25' ' ' MET . 40.3 p -29.15 89.38 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.702 0.763 . . . . 0.0 111.542 -178.355 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.2 pt20 -157.81 168.89 25.9 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.737 -0.602 . . . . 0.0 109.419 179.51 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -77.22 124.96 28.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.283 -0.886 . . . . 0.0 110.594 -179.615 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.651 ' CD2' HD23 ' A' ' 22' ' ' LEU . 35.5 t80 -110.83 158.39 18.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.402 -0.811 . . . . 0.0 109.77 179.73 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.407 ' SG ' ' O ' ' A' ' 29' ' ' TYR . 1.9 m -158.1 108.38 2.13 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.058 -1.026 . . . . 0.0 110.503 -179.95 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.504 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 3.8 tpp180 -81.29 115.04 20.48 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.88 . . . . 0.0 109.666 179.681 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 97.5 m -79.4 175.06 10.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.167 -0.958 . . . . 0.0 110.521 -179.56 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -79.46 117.94 20.88 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.367 -0.833 . . . . 0.0 110.383 -179.792 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -49.94 99.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.283 -0.886 . . . . 0.0 109.914 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 152.35 -16.84 0.77 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.847 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.472 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.0 OUTLIER -79.55 172.92 13.14 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.147 -1.207 . . . . 0.0 110.023 179.947 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.598 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -113.29 31.47 6.44 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.017 -1.052 . . . . 0.0 110.518 -179.636 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.32 162.9 33.62 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.448 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.682 HG23 ' OH ' ' A' ' 13' ' ' TYR . 2.4 m -84.34 14.73 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.345 -1.091 . . . . 0.0 109.733 179.546 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.584 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -128.26 18.18 6.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.386 -0.821 . . . . 0.0 109.852 -179.444 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.599 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.6 p 27.33 91.06 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 CA-C-O 121.402 0.62 . . . . 0.0 111.369 179.493 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.584 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 10.8 tm-20 -156.6 -37.79 0.08 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.398 -0.814 . . . . 0.0 110.284 179.752 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.598 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 3.1 p-80 -114.86 128.44 56.29 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.008 -1.058 . . . . 0.0 110.523 179.887 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.654 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 15.7 t80 -86.63 126.33 34.44 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.459 0.647 . . . . 0.0 109.842 -179.009 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.584 ' O ' ' CG ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -85.27 12.47 8.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.447 -0.783 . . . . 0.0 109.955 -179.329 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.654 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.5 mt . . . . . 0 C--N 1.302 -1.479 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.395 -179.748 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 17.3 t . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 121.31 0.576 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 1.032 ' HB2' HG11 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -157.22 156.56 32.77 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.31 -0.869 . . . . 0.0 109.959 179.871 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.588 ' CG1' HG22 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -153.68 164.94 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.238 -0.914 . . . . 0.0 110.267 -179.802 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 3.7 m -148.52 167.16 26.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 0.0 110.219 179.984 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.457 ' HD2' HD13 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -110.41 168.99 9.04 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 110.027 179.908 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 57.0 m -86.49 -166.3 1.51 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.177 -0.952 . . . . 0.0 110.169 -179.937 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.84 -64.85 0.69 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.313 -0.867 . . . . 0.0 110.314 -179.963 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.44 ' O ' ' OD1' ' A' ' 11' ' ' ASN . 0.5 OUTLIER -153.69 -71.17 0.14 Allowed 'General case' 0 C--N 1.291 -1.946 0 O-C-N 121.78 -0.575 . . . . 0.0 110.377 -179.961 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -62.72 -11.18 15.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.205 -0.934 . . . . 0.0 110.218 -179.972 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.438 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -104.27 39.5 1.64 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.258 -0.901 . . . . 0.0 110.159 179.898 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.44 ' OD1' ' O ' ' A' ' 8' ' ' SER . 41.4 p-10 -137.74 21.44 2.88 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.284 -0.885 . . . . 0.0 110.337 -179.885 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -100.18 75.14 0.44 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.971 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -160.28 -58.43 0.06 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.264 -1.139 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 25.3 p -97.25 118.2 33.15 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.342 -0.849 . . . . 0.0 110.605 -179.718 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.608 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.7 mt -75.77 -40.69 54.84 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 109.887 179.706 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.608 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 6.4 m80 -119.85 89.36 3.11 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.414 -0.804 . . . . 0.0 110.584 -179.096 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.469 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 171.08 -177.81 43.83 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 179.791 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -108.06 153.46 23.09 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.294 -1.121 . . . . 0.0 110.306 179.86 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.909 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -92.05 133.66 35.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.377 -0.827 . . . . 0.0 110.539 -179.809 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.909 HD13 ' O ' ' A' ' 19' ' ' CYS . 9.4 mm -142.71 178.67 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.35 -0.844 . . . . 0.0 109.883 179.968 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.556 ' H ' HG22 ' A' ' 20' ' ' ILE . 20.6 t80 -147.68 129.45 15.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.986 -1.071 . . . . 0.0 110.252 179.952 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.613 ' CD2' ' CD2' ' A' ' 29' ' ' TYR . 2.9 mm? -88.65 131.78 34.84 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.267 -0.896 . . . . 0.0 110.749 -179.662 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 1.032 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.4 p -90.57 -23.19 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.341 -0.849 . . . . 0.0 110.612 179.88 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -78.59 -12.43 60.02 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.003 -1.061 . . . . 0.0 108.806 179.28 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -151.01 68.9 0.95 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.957 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.489 ' C ' ' O ' ' A' ' 25' ' ' MET . 40.1 p -29.02 89.52 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.791 0.805 . . . . 0.0 111.308 -178.419 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -159.55 148.09 17.69 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.726 -0.609 . . . . 0.0 109.367 -179.883 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.53 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.2 m-80 -60.68 146.21 46.46 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.197 -0.94 . . . . 0.0 110.399 -179.635 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.613 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 3.5 t80 -142.73 102.85 4.12 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.441 -0.787 . . . . 0.0 109.991 179.984 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.9 m -108.62 119.03 38.33 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.108 -0.995 . . . . 0.0 110.278 -179.951 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.469 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -78.98 137.33 37.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.107 -0.996 . . . . 0.0 109.216 179.476 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 4.8 m -79.54 169.3 18.23 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.281 -0.887 . . . . 0.0 110.025 -179.528 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.529 ' O ' ' N ' ' A' ' 35' ' ' GLY . 9.6 tt0 -78.59 112.26 15.49 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.309 -0.869 . . . . 0.0 108.709 179.21 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.465 ' C ' ' O ' ' A' ' 33' ' ' GLU . 38.3 t -36.12 93.17 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 121.479 0.657 . . . . 0.0 110.475 -179.071 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.999 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 149.72 -15.77 1.07 Allowed Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.649 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.583 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 2.4 m-85 -81.12 169.24 17.66 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.137 -1.213 . . . . 0.0 109.922 179.939 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 1.104 HG23 ' CE1' ' A' ' 43' ' ' HIS . 5.2 t -122.55 45.55 2.35 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.968 -1.082 . . . . 0.0 111.171 -179.77 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.53 156.08 27.32 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.963 -1.255 . . . . 0.0 109.963 179.568 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.7 HG12 ' O ' ' A' ' 39' ' ' VAL . 79.2 t -89.07 21.27 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.327 -1.102 . . . . 0.0 109.487 179.288 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.578 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 6.5 ttp180 -122.78 -19.23 6.28 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.568 -0.708 . . . . 0.0 109.978 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.7 m 69.51 70.26 0.25 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.172 -0.955 . . . . 0.0 110.234 179.281 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.578 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -141.03 -29.25 0.66 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.19 -0.944 . . . . 0.0 111.255 -179.838 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 1.104 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.0 p80 -125.63 120.46 30.84 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.623 -1.298 . . . . 0.0 111.214 179.963 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.612 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 51.6 t80 -82.57 103.14 11.88 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.295 0.569 . . . . 0.0 109.678 179.773 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.578 ' CE2' ' HG ' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -64.59 -30.34 71.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.239 -0.913 . . . . 0.0 110.237 -179.29 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.999 HD12 ' O ' ' A' ' 35' ' ' GLY . 3.2 mt . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.13 -0.981 . . . . 0.0 110.147 -179.986 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.24 0.543 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.533 ' HB3' HG11 ' A' ' 23' ' ' VAL . 6.3 t -101.8 54.46 0.81 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.171 -0.956 . . . . 0.0 110.205 -179.979 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.799 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -80.63 141.18 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.29 -0.881 . . . . 0.0 110.216 -179.933 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.424 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -101.33 158.53 15.98 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.306 -179.97 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -108.17 151.49 25.85 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.302 -0.874 . . . . 0.0 110.019 179.864 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.4 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 61.3 m -97.81 -159.86 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.269 -0.895 . . . . 0.0 110.365 -179.94 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.7 t -145.12 -146.47 0.19 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.204 -0.935 . . . . 0.0 110.198 179.996 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.435 ' O ' ' N ' ' A' ' 10' ' ' MET . 23.7 t -79.87 168.02 19.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.224 -0.922 . . . . 0.0 110.134 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' A' ' 8' ' ' SER . 20.0 t0 42.08 26.93 0.06 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.262 -0.899 . . . . 0.0 110.288 179.954 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.435 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -125.78 -0.86 7.33 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.261 -0.9 . . . . 0.0 110.321 -179.892 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.422 ' O ' ' CG ' ' A' ' 11' ' ' ASN . 24.4 p-10 -140.03 105.53 5.09 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.169 -0.957 . . . . 0.0 110.194 -179.976 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.45 20.79 6.9 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.902 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.455 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 71.0 t80 -110.62 -55.57 2.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.189 -1.183 . . . . 0.0 110.273 -179.899 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 26.2 p -93.52 123.27 36.72 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.274 -0.891 . . . . 0.0 110.268 -179.818 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.563 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -90.18 -43.65 10.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.111 -0.993 . . . . 0.0 110.416 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.563 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 9.2 m80 -107.87 85.89 2.2 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.265 -0.897 . . . . 0.0 110.233 -179.513 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 174.93 -165.1 36.1 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.983 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -121.28 134.79 55.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.38 -1.07 . . . . 0.0 110.31 -179.955 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.576 ' O ' HG23 ' A' ' 20' ' ' ILE . 10.7 t -84.47 141.76 30.55 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 110.125 179.903 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.887 HD11 ' CD1' ' A' ' 29' ' ' TYR . 9.5 pt -157.7 -167.38 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.183 -0.948 . . . . 0.0 110.059 -179.778 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.499 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 12.1 t80 -144.18 133.54 23.23 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.269 -0.895 . . . . 0.0 110.086 179.984 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.68 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.6 mm? -87.66 132.62 34.03 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.138 -0.976 . . . . 0.0 110.671 -179.642 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.533 HG11 ' HB3' ' A' ' 2' ' ' SER . 4.8 p -90.71 -22.31 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.256 -0.903 . . . . 0.0 110.674 179.797 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.555 ' OD2' HD12 ' A' ' 22' ' ' LEU . 12.5 p30 -78.46 -9.63 59.38 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.014 -1.054 . . . . 0.0 108.913 179.26 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.5 OUTLIER -157.35 70.85 0.62 Allowed 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.146 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.499 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 12.5 p -29.32 89.43 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 121.768 0.794 . . . . 0.0 111.307 -178.587 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.18 149.61 17.7 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.704 -0.623 . . . . 0.0 109.478 -179.7 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.519 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 3.3 t-20 -61.09 135.13 57.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.215 -0.928 . . . . 0.0 110.227 -179.857 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.887 ' CD1' HD11 ' A' ' 20' ' ' ILE . 7.2 t80 -129.07 126.24 38.99 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.445 -0.785 . . . . 0.0 109.74 -179.936 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.598 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 8.2 m -123.47 112.78 17.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.98 . . . . 0.0 110.718 -179.554 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.481 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 8.9 tpp85 -79.51 111.35 15.7 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.272 -0.893 . . . . 0.0 109.686 179.568 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.467 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 68.5 m -79.32 167.74 20.49 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.222 -0.924 . . . . 0.0 110.027 -179.871 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -79.82 106.36 11.78 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.295 -0.878 . . . . 0.0 110.225 -179.727 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.435 ' H ' HG22 ' A' ' 34' ' ' VAL . 5.6 m -47.25 107.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 O-C-N 121.399 -0.813 . . . . 0.0 109.674 179.583 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.13 -10.77 2.04 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.305 -1.518 . . . . 0.0 109.305 -179.369 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.562 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.4 OUTLIER -78.66 178.97 7.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.197 -1.178 . . . . 0.0 109.692 179.862 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.645 HG21 ' NE2' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -106.7 -43.92 4.58 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 118.538 -1.265 . . . . 0.0 110.584 -179.989 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.73 158.03 42.5 Favored Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.635 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.638 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.8 p -84.99 44.88 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.12 -1.224 . . . . 0.0 109.696 179.756 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.26 27.21 0.17 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.407 -0.808 . . . . 0.0 109.746 -179.438 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.49 ' C ' ' O ' ' A' ' 40' ' ' ARG . 15.2 p 31.33 93.47 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.63 -0.669 . . . . 0.0 111.026 179.778 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 9.9 tm-20 -159.24 -41.77 0.06 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.481 -0.762 . . . . 0.0 110.035 179.938 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.645 ' NE2' HG21 ' A' ' 37' ' ' THR . 0.6 OUTLIER -120.14 129.47 54.17 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.06 -1.025 . . . . 0.0 110.669 179.83 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.591 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 35.6 t80 -88.76 125.15 34.75 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.404 -178.758 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.56 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.2 OUTLIER -98.05 -11.83 22.53 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.362 -0.836 . . . . 0.0 110.45 -179.534 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.591 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 6.3 mt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.052 -1.03 . . . . 0.0 110.241 -179.711 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.215 0.531 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.52 ' HA ' ' HB ' ' A' ' 23' ' ' VAL . 3.1 m -160.3 174.44 14.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.316 -0.865 . . . . 0.0 109.898 179.979 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.479 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 2.7 tt -79.6 148.67 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.233 -0.917 . . . . 0.0 109.803 179.595 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.672 HG23 ' N ' ' A' ' 5' ' ' LYS . 4.9 t -160.25 -150.12 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.144 -0.972 . . . . 0.0 110.759 -179.928 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.672 ' N ' HG23 ' A' ' 4' ' ' THR . 35.6 mtpt -117.28 174.96 5.83 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.417 -0.802 . . . . 0.0 110.28 -179.806 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.558 ' O ' ' CB ' ' A' ' 7' ' ' SER . 14.3 m -113.37 -11.16 13.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.276 -0.89 . . . . 0.0 110.257 -179.802 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.558 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 1.1 m 79.69 -175.26 0.07 Allowed 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.662 -0.649 . . . . 0.0 110.654 179.99 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.472 ' O ' ' ND2' ' A' ' 11' ' ' ASN . 0.2 OUTLIER -78.97 -39.2 34.99 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.299 -0.876 . . . . 0.0 111.363 -179.108 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -84.36 46.13 1.19 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.941 -1.099 . . . . 0.0 109.68 179.859 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.53 ' CB ' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -155.17 24.2 0.42 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.429 -0.794 . . . . 0.0 109.815 -179.226 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.472 ' ND2' ' O ' ' A' ' 8' ' ' SER . 15.5 p30 -118.78 -158.24 0.72 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.108 -0.995 . . . . 0.0 109.922 -179.905 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.38 44.6 0.43 Allowed Glycine 0 N--CA 1.488 2.155 0 N-CA-C 109.267 -1.533 . . . . 0.0 109.267 -179.903 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.417 ' HD2' ' HG ' ' A' ' 14' ' ' CYS . 25.5 t80 -159.7 -44.38 0.05 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.392 -1.064 . . . . 0.0 110.002 -179.676 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -106.37 131.45 53.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.569 -0.707 . . . . 0.0 109.934 -179.588 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.666 HD11 ' OE2' ' A' ' 42' ' ' GLU . 13.1 mt -90.78 -42.58 10.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.346 -0.846 . . . . 0.0 110.438 179.667 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.608 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.8 m80 -113.52 79.24 1.22 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.2 -0.938 . . . . 0.0 110.235 -179.567 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 178.53 -166.83 36.94 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.951 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -131.33 149.18 52.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.282 -1.129 . . . . 0.0 110.239 -179.995 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.563 ' C ' HG23 ' A' ' 20' ' ' ILE . 4.7 t -95.87 146.08 24.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.23 -0.919 . . . . 0.0 110.073 179.993 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.097 HD11 ' CD1' ' A' ' 29' ' ' TYR . 15.1 pt -156.11 -173.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.253 -0.904 . . . . 0.0 110.234 -179.795 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 12.7 t80 -131.67 145.79 51.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.306 -0.871 . . . . 0.0 109.859 179.782 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.744 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.4 mm? -103.64 137.75 41.26 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.054 -1.029 . . . . 0.0 111.366 -179.33 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.52 ' HB ' ' HA ' ' A' ' 2' ' ' SER . 9.3 p -91.16 -27.66 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 110.855 179.865 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.429 ' O ' ' HG3' ' A' ' 25' ' ' MET . 10.7 m-20 -77.79 -17.68 57.23 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.071 -1.018 . . . . 0.0 108.831 179.666 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 27' ' ' GLN . 7.0 mtt -144.48 64.38 1.3 Allowed 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 178.698 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 25' ' ' MET . 58.9 p -29.31 86.24 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.711 0.767 . . . . 0.0 111.814 -178.461 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.6 pt20 -161.29 -175.8 5.04 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.605 -0.684 . . . . 0.0 109.467 179.677 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -81.86 145.35 30.42 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.263 -0.898 . . . . 0.0 109.97 179.645 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 1.097 ' CD1' HD11 ' A' ' 20' ' ' ILE . 12.3 t80 -141.02 108.67 5.62 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.357 -0.839 . . . . 0.0 109.82 -179.682 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 25.4 m -103.33 112.88 25.96 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.254 -0.904 . . . . 0.0 110.797 -179.499 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -90.33 95.46 10.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.157 -0.964 . . . . 0.0 109.736 179.492 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.507 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 92.8 m -79.71 178.91 7.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.224 -0.922 . . . . 0.0 110.057 -179.91 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -79.51 131.32 36.01 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.237 -0.914 . . . . 0.0 109.803 179.864 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.4 t -66.64 -18.33 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.333 -0.854 . . . . 0.0 110.353 -179.494 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.13 -7.13 49.76 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 179.93 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -90.43 168.32 11.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.219 -1.165 . . . . 0.0 110.233 -179.913 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.924 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -110.86 34.03 4.24 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.119 -0.988 . . . . 0.0 110.497 179.797 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.43 156.93 28.29 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.643 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.775 HG12 ' O ' ' A' ' 39' ' ' VAL . 77.0 t -85.07 44.96 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.288 -1.125 . . . . 0.0 109.568 179.54 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.58 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.83 20.92 0.17 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.347 -0.845 . . . . 0.0 109.97 -179.375 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.521 ' C ' ' O ' ' A' ' 40' ' ' ARG . 3.3 p 26.71 90.94 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 121.485 0.66 . . . . 0.0 111.574 179.631 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.666 ' OE2' HD11 ' A' ' 15' ' ' LEU . 1.6 tt0 -155.57 -34.62 0.09 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.835 . . . . 0.0 110.597 179.749 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.924 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.3 p80 -121.89 119.9 32.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.977 -1.077 . . . . 0.0 110.683 179.725 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.577 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 35.4 t80 -83.02 119.34 24.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.718 -0.614 . . . . 0.0 109.743 179.938 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.737 ' HB2' HG21 ' A' ' 37' ' ' THR . 0.4 OUTLIER -89.14 -21.19 23.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.393 -0.817 . . . . 0.0 110.343 -179.435 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.577 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 5.4 mt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.349 -179.636 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 63.2 t . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.247 0.546 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.546 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -113.99 41.45 2.24 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.212 -0.93 . . . . 0.0 110.102 179.915 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.882 HD12 HD22 ' A' ' 22' ' ' LEU . 5.0 tt -81.69 156.41 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.304 -0.873 . . . . 0.0 110.344 179.939 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.623 HG23 ' N ' ' A' ' 5' ' ' LYS . 5.6 t -136.94 -150.67 0.37 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.311 -0.868 . . . . 0.0 110.063 179.87 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.623 ' N ' HG23 ' A' ' 4' ' ' THR . 11.1 ttpt -107.67 -178.64 3.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.476 -0.765 . . . . 0.0 110.266 179.986 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.727 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 79.5 m -111.95 -154.32 0.54 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.3 -0.875 . . . . 0.0 110.171 -179.947 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.506 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.4 OUTLIER -137.49 -156.57 0.7 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.243 -0.911 . . . . 0.0 110.095 -179.91 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.506 ' N ' ' OG ' ' A' ' 7' ' ' SER . 21.9 t -79.81 167.66 20.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.181 -0.949 . . . . 0.0 110.04 179.93 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 53.11 19.18 1.35 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.176 -0.953 . . . . 0.0 110.173 -179.86 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -119.67 4.51 11.07 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.345 -0.847 . . . . 0.0 110.199 -179.986 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -111.3 90.53 3.36 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.241 -0.912 . . . . 0.0 110.236 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -144.76 40.56 1.14 Allowed Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.983 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.418 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 57.5 t80 -148.13 -57.43 0.23 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.201 -1.176 . . . . 0.0 110.271 179.941 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.569 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 28.4 p -97.13 118.86 34.51 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.174 -0.954 . . . . 0.0 110.128 -179.958 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.613 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 12.1 mt -89.27 -40.3 12.92 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.246 -0.909 . . . . 0.0 110.307 -179.974 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.613 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.4 m80 -114.35 81.98 1.64 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.046 -1.034 . . . . 0.0 110.193 -179.651 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.404 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -178.28 -173.77 43.97 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.968 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -101.43 144.41 30.26 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.286 -1.126 . . . . 0.0 110.413 -179.985 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.727 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 14.8 t -98.35 125.53 43.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.287 -0.883 . . . . 0.0 110.262 -179.959 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.805 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -143.0 -175.74 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.453 -0.779 . . . . 0.0 110.139 -179.954 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.472 ' O ' HG13 ' A' ' 3' ' ' ILE . 11.8 t80 -138.27 125.96 22.25 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.165 -0.959 . . . . 0.0 110.107 179.975 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.882 HD22 HD12 ' A' ' 3' ' ' ILE . 1.0 OUTLIER -80.3 129.8 34.75 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.174 -0.954 . . . . 0.0 110.838 -179.584 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.546 HG11 ' CB ' ' A' ' 2' ' ' SER . 5.0 p -90.59 -28.07 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.391 -0.818 . . . . 0.0 110.438 179.731 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -78.27 -13.52 59.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.069 -1.019 . . . . 0.0 108.719 179.097 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.531 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -147.45 66.31 1.13 Allowed 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.902 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.492 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.9 p -29.29 89.8 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.757 0.789 . . . . 0.0 111.436 -178.604 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -159.08 147.63 18.17 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.693 -0.629 . . . . 0.0 109.481 -179.998 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.519 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 1.3 m-20 -63.77 109.9 1.88 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.304 -0.872 . . . . 0.0 110.084 -179.987 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.616 ' CB ' HD23 ' A' ' 22' ' ' LEU . 6.2 t80 -98.01 141.25 31.2 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.238 -0.914 . . . . 0.0 109.684 179.871 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.569 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 19.5 m -141.95 113.25 7.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.089 -1.007 . . . . 0.0 110.586 -179.497 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.404 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 12.2 tpp180 -81.5 104.46 11.95 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.197 -0.94 . . . . 0.0 109.625 179.511 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.634 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 94.8 m -79.5 168.29 19.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.331 -0.856 . . . . 0.0 110.186 -179.65 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.41 ' CG ' ' H ' ' A' ' 35' ' ' GLY . 7.9 tt0 -78.8 127.44 32.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.188 -0.945 . . . . 0.0 109.504 179.783 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.4 t -66.93 -10.3 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.346 -0.846 . . . . 0.0 110.613 -179.19 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.41 ' H ' ' CG ' ' A' ' 33' ' ' GLU . . . -79.44 -5.94 89.09 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 179.835 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.58 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -83.14 178.65 8.01 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.195 -1.18 . . . . 0.0 110.194 -179.95 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.629 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -111.85 28.5 8.69 Favored 'General case' 0 N--CA 1.498 1.974 0 C-N-CA 119.046 -1.062 . . . . 0.0 110.16 179.663 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.22 157.75 29.1 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 179.527 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.564 ' O ' HG13 ' A' ' 39' ' ' VAL . 8.8 p -84.68 43.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -1.162 . . . . 0.0 109.723 179.522 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.571 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -157.03 18.71 0.3 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.463 -0.773 . . . . 0.0 110.135 -179.405 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.634 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 13.7 p 29.76 91.4 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.432 -0.793 . . . . 0.0 111.566 179.393 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.571 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.7 tt0 -158.62 -37.74 0.06 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -0.925 . . . . 0.0 110.42 179.507 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.629 ' CE1' HG23 ' A' ' 37' ' ' THR . 0.6 OUTLIER -119.0 125.13 48.67 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.049 -1.032 . . . . 0.0 110.523 179.83 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.603 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.6 t80 -88.2 126.56 35.21 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.467 0.651 . . . . 0.0 109.865 -179.173 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.578 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.2 OUTLIER -92.71 -28.39 16.67 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.471 -0.768 . . . . 0.0 110.164 -179.394 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.603 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.4 mt . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.45 -179.689 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.275 0.559 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.511 ' HB2' HG11 ' A' ' 23' ' ' VAL . 0.8 OUTLIER -142.79 113.18 7.27 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.313 -0.867 . . . . 0.0 110.148 -179.992 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.537 ' CG1' ' HB ' ' A' ' 20' ' ' ILE . 2.4 tt -107.95 177.69 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.302 -0.874 . . . . 0.0 110.234 -179.941 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 20' ' ' ILE . 0.7 OUTLIER -153.46 169.65 22.64 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.243 -0.911 . . . . 0.0 110.139 -179.936 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.71 167.51 9.85 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 110.196 -179.988 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 39.9 m -102.14 -149.45 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 110.217 179.994 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -139.8 -169.65 2.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.227 -0.921 . . . . 0.0 110.064 -179.979 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 78.4 p -82.46 9.82 8.43 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.938 . . . . 0.0 110.221 179.999 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -123.34 20.29 9.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.19 -0.944 . . . . 0.0 110.209 -179.953 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 9.8 ttt -146.05 22.31 1.39 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.227 -0.92 . . . . 0.0 110.301 -179.971 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -118.19 94.97 4.69 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.305 -0.872 . . . . 0.0 110.203 179.942 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -155.12 28.64 0.64 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.933 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -122.98 -61.74 1.41 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.21 -1.17 . . . . 0.0 110.261 179.94 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.515 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.6 p -90.8 119.26 30.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.204 -0.935 . . . . 0.0 110.351 -179.816 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.608 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 15.4 mt -80.89 -42.9 20.7 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.326 -0.859 . . . . 0.0 109.999 179.794 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.608 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 4.2 m80 -118.36 80.98 1.61 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.355 -0.841 . . . . 0.0 110.36 -179.421 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.402 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -170.31 165.94 39.19 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.943 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.476 ' HB2' ' HB3' ' A' ' 31' ' ' ARG . 1.4 mt-30 -80.89 148.92 29.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.212 -1.17 . . . . 0.0 110.149 179.946 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 15.3 t -103.38 119.64 39.27 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.34 -0.85 . . . . 0.0 110.255 179.911 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.804 HD13 ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -142.35 -175.69 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.205 -0.934 . . . . 0.0 110.372 179.959 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.475 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 6.3 t80 -143.51 126.68 16.54 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.241 -0.912 . . . . 0.0 109.696 179.89 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.537 HD13 ' CB ' ' A' ' 29' ' ' TYR . 1.6 mp -79.46 132.11 36.26 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.191 -0.943 . . . . 0.0 111.011 -179.529 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.511 HG11 ' HB2' ' A' ' 2' ' ' SER . 8.6 p -90.31 -29.37 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.487 -0.758 . . . . 0.0 110.241 179.942 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -78.31 -15.69 58.48 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.129 -0.982 . . . . 0.0 108.735 179.042 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.524 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -142.57 64.43 1.37 Allowed 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.037 -1.098 . . . . 0.0 108.037 178.642 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.475 ' C ' ' O ' ' A' ' 25' ' ' MET . 44.8 p -29.14 89.64 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.725 0.774 . . . . 0.0 111.476 -178.52 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.524 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.8 OUTLIER -160.03 146.7 16.03 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.713 -0.617 . . . . 0.0 109.484 179.93 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.503 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 7.6 p30 -63.6 110.1 1.89 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 110.189 -179.953 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.537 ' CB ' HD13 ' A' ' 22' ' ' LEU . 5.4 t80 -99.39 134.6 42.03 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.367 -0.833 . . . . 0.0 109.729 179.889 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 2.2 m -130.22 114.48 15.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.082 -1.011 . . . . 0.0 110.566 -179.682 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.476 ' HB3' ' HB2' ' A' ' 18' ' ' GLN . 3.6 tpp180 -79.81 130.98 35.78 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.162 -0.961 . . . . 0.0 109.531 179.525 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 12.2 m -79.78 159.53 26.52 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.222 -0.924 . . . . 0.0 110.121 -179.689 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 35' ' ' GLY . 9.9 tt0 -79.17 107.28 11.82 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.24 -0.912 . . . . 0.0 109.481 179.694 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.442 HG23 ' H ' ' A' ' 34' ' ' VAL . 37.3 t -42.87 97.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.638 -0.664 . . . . 0.0 110.02 -179.558 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 33' ' ' GLU . . . 152.78 -16.07 0.72 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.958 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.572 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 1.5 m-85 -79.67 169.23 18.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.077 -1.249 . . . . 0.0 110.11 179.964 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.929 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -113.44 31.86 6.19 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.997 -1.064 . . . . 0.0 110.711 -179.764 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -152.46 157.22 27.15 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.671 -1.371 . . . . 0.0 109.671 179.676 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.445 ' O ' HG22 ' A' ' 39' ' ' VAL . 9.4 p -87.86 20.63 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.271 -1.135 . . . . 0.0 109.965 179.814 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.589 ' CZ ' ' CB ' ' A' ' 42' ' ' GLU . 4.3 tmm_? -124.05 -20.36 5.36 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.191 179.851 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.615 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 4.2 m 72.79 82.53 0.13 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.326 -0.859 . . . . 0.0 109.945 179.75 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.589 ' CB ' ' CZ ' ' A' ' 40' ' ' ARG . 0.9 OUTLIER -155.54 -30.7 0.1 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.453 -0.78 . . . . 0.0 111.047 -179.871 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.929 ' CE1' HG23 ' A' ' 37' ' ' THR . 5.7 p80 -122.15 121.51 37.06 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.69 -1.256 . . . . 0.0 110.881 179.783 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.607 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.6 t80 -83.66 108.65 16.88 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.243 0.544 . . . . 0.0 109.891 -179.884 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.573 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -69.74 -16.84 63.39 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.318 -0.864 . . . . 0.0 109.958 -179.707 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.607 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.5 mt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.307 -179.835 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 45.4 t . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.165 0.507 . . . . 0.0 110.122 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.572 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.8 OUTLIER -160.14 156.09 26.15 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.251 -0.905 . . . . 0.0 110.216 179.985 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.563 HG12 ' CG2' ' A' ' 20' ' ' ILE . 0.8 OUTLIER -124.93 160.72 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.254 -0.904 . . . . 0.0 110.169 179.823 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.477 ' O ' HG22 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -135.97 -178.39 5.12 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.264 -0.897 . . . . 0.0 110.079 -179.559 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.415 ' H ' HG22 ' A' ' 4' ' ' THR . 22.3 mttt -84.5 -177.72 6.7 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.237 -0.914 . . . . 0.0 110.028 179.9 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.424 ' O ' ' CB ' ' A' ' 7' ' ' SER . 63.1 m -108.85 -104.14 0.36 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.182 -0.949 . . . . 0.0 110.396 -179.923 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.482 ' OG ' ' N ' ' A' ' 8' ' ' SER . 0.1 OUTLIER 174.07 -164.35 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.954 -1.091 . . . . 0.0 110.195 -179.886 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.482 ' N ' ' OG ' ' A' ' 7' ' ' SER . 0.7 OUTLIER -82.75 169.68 15.9 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.178 -0.951 . . . . 0.0 110.121 179.895 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.404 ' C ' ' O ' ' A' ' 8' ' ' SER . 12.1 m-20 43.17 26.41 0.09 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.247 -0.908 . . . . 0.0 110.2 -179.917 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.415 ' N ' ' O ' ' A' ' 8' ' ' SER . 0.8 OUTLIER -124.68 4.33 8.2 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.24 -0.913 . . . . 0.0 110.334 -179.88 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -106.69 82.58 1.73 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.215 -0.928 . . . . 0.0 110.218 179.943 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -137.34 25.55 3.0 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.973 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -125.17 -52.74 1.63 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.227 -1.16 . . . . 0.0 110.241 -179.967 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.52 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 20.1 p -106.82 120.47 42.11 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.337 -0.852 . . . . 0.0 110.43 -179.974 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.592 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 11.7 mt -89.83 -43.39 10.67 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.256 -0.902 . . . . 0.0 110.432 -179.973 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.592 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 5.0 m80 -110.26 88.5 2.78 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.278 -0.889 . . . . 0.0 110.077 -179.482 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.429 ' C ' ' OE1' ' A' ' 18' ' ' GLN . . . 174.91 -126.61 1.2 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 -179.873 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.579 ' NE2' ' CG ' ' A' ' 31' ' ' ARG . 14.6 pm0 -160.5 134.72 7.26 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.433 -1.04 . . . . 0.0 110.248 179.642 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.486 ' C ' ' CG1' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -81.45 148.9 29.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.262 -0.899 . . . . 0.0 110.374 -179.692 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.002 HD12 ' CD1' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -159.57 -172.22 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.235 -0.915 . . . . 0.0 109.643 179.913 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.45 ' O ' HG13 ' A' ' 3' ' ' ILE . 4.5 t80 -151.81 128.92 11.12 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.076 -1.015 . . . . 0.0 110.271 -179.636 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.57 HD11 ' HD2' ' A' ' 29' ' ' TYR . 36.4 mt -79.34 130.39 35.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.146 -0.971 . . . . 0.0 110.866 -179.696 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.572 HG12 ' O ' ' A' ' 2' ' ' SER . 4.6 p -90.3 -34.05 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.157 -0.964 . . . . 0.0 109.968 179.361 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 25' ' ' MET . 3.0 p30 -78.23 -20.88 50.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.152 -0.967 . . . . 0.0 108.586 179.101 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.506 ' O ' ' C ' ' A' ' 26' ' ' SER . 3.9 ttm -136.78 61.5 1.63 Allowed 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.559 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.506 ' C ' ' O ' ' A' ' 25' ' ' MET . 0.0 OUTLIER -29.52 92.66 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 122.106 0.955 . . . . 0.0 111.206 -178.608 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 25' ' ' MET . 0.1 OUTLIER -158.73 141.25 14.24 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.933 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -55.81 113.88 1.67 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.104 -0.997 . . . . 0.0 110.504 -179.511 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 1.002 ' CD1' HD12 ' A' ' 20' ' ' ILE . 4.4 t80 -105.93 120.98 43.13 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.349 -0.844 . . . . 0.0 109.789 179.73 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.52 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.8 m -127.17 111.41 13.95 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.113 -0.992 . . . . 0.0 110.18 179.804 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.579 ' CG ' ' NE2' ' A' ' 18' ' ' GLN . 13.2 tpp180 -84.64 103.88 14.14 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.129 -0.982 . . . . 0.0 110.036 179.777 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 73.6 m -80.57 173.98 12.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.323 -0.861 . . . . 0.0 110.28 -179.842 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -79.89 133.46 36.23 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.277 -0.889 . . . . 0.0 109.896 179.892 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.8 t -71.35 -26.38 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.282 -0.887 . . . . 0.0 110.469 -179.531 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.45 -12.12 31.19 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.805 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.573 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 1.0 OUTLIER -79.57 178.4 8.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.182 -1.187 . . . . 0.0 110.279 -179.974 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.856 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.1 OUTLIER -110.39 25.28 11.95 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.128 -0.982 . . . . 0.0 110.267 179.61 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -158.28 157.52 28.39 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.652 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.785 HG12 ' O ' ' A' ' 39' ' ' VAL . 70.7 t -84.67 44.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.219 -1.165 . . . . 0.0 109.823 179.715 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.591 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.4 OUTLIER -157.32 20.04 0.29 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.441 -0.787 . . . . 0.0 109.972 -179.523 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 7.1 p 28.24 89.75 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.429 0.633 . . . . 0.0 111.399 179.724 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.591 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 1.8 tm-20 -153.63 -37.03 0.1 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.432 -0.793 . . . . 0.0 110.143 179.865 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.856 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.3 p80 -119.59 121.52 39.51 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.0 110.221 179.209 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.606 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 24.7 t80 -84.95 120.16 26.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.696 -0.627 . . . . 0.0 110.064 -179.505 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.542 ' HB3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -87.14 -12.16 47.86 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.479 -0.763 . . . . 0.0 109.916 -179.572 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.606 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.8 mt . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 117.926 -1.035 . . . . 0.0 110.274 -179.882 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.0 m . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.331 0.586 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.514 ' CB ' HG11 ' A' ' 23' ' ' VAL . 0.4 OUTLIER -98.72 42.43 1.1 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.253 -0.904 . . . . 0.0 110.105 -179.924 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.836 HD11 ' HB ' ' A' ' 20' ' ' ILE . 3.0 tt -142.74 161.71 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.313 -0.867 . . . . 0.0 110.179 179.96 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.483 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 1.3 m -143.57 162.25 36.37 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.223 -0.923 . . . . 0.0 110.221 179.755 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 mtmp? -86.56 167.73 14.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.222 -0.924 . . . . 0.0 110.178 -179.882 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.573 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 75.5 m -90.59 -178.39 5.29 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.305 -0.872 . . . . 0.0 110.233 179.983 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.7 t -108.25 -153.17 0.5 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.923 . . . . 0.0 110.265 -179.895 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.5 172.04 11.29 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.341 -0.849 . . . . 0.0 110.304 -179.991 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t0 45.26 25.3 0.19 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.222 -0.924 . . . . 0.0 110.157 -179.953 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.16 2.86 8.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.178 -0.951 . . . . 0.0 110.291 179.992 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -101.55 47.63 0.9 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.273 -0.892 . . . . 0.0 110.261 -179.985 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -120.44 16.0 9.84 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.997 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.0 t80 -105.45 -53.23 2.69 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -1.161 . . . . 0.0 110.276 179.972 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.466 ' HB2' ' SG ' ' A' ' 41' ' ' CYS . 23.4 p -109.89 118.05 35.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.264 -0.897 . . . . 0.0 110.31 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.581 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.5 mt -90.35 -43.11 10.54 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.233 -0.917 . . . . 0.0 110.338 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.581 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.3 m80 -107.85 83.94 1.88 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.31 -0.869 . . . . 0.0 110.015 -179.538 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.492 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 175.73 -161.22 29.89 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.813 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -121.78 133.98 54.92 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.251 -1.147 . . . . 0.0 110.119 179.827 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.587 ' C ' HG23 ' A' ' 20' ' ' ILE . 0.5 OUTLIER -85.61 140.34 30.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.226 -0.921 . . . . 0.0 110.318 -179.831 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.068 HD11 ' CD1' ' A' ' 29' ' ' TYR . 32.8 pt -157.65 -167.95 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 110.075 -179.949 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.529 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 11.2 t80 -147.08 139.69 24.88 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.907 . . . . 0.0 110.04 -179.919 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.663 HD23 ' CB ' ' A' ' 29' ' ' TYR . 1.5 mm? -92.2 134.52 34.8 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.105 -0.997 . . . . 0.0 110.743 -179.725 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.514 HG11 ' CB ' ' A' ' 2' ' ' SER . 7.5 p -90.66 -28.32 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.239 -0.913 . . . . 0.0 110.658 179.997 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.541 ' OD1' HD12 ' A' ' 22' ' ' LEU . 58.0 p30 -78.17 -12.98 60.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.922 -1.111 . . . . 0.0 108.892 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -146.41 65.78 1.19 Allowed 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.777 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.529 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 20.5 p -30.03 87.93 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.64 0.733 . . . . 0.0 111.928 -178.466 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.7 tt0 -158.59 168.05 27.93 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.581 -0.7 . . . . 0.0 109.763 179.531 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.48 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 2.0 p-10 -76.52 127.47 32.89 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.398 -0.814 . . . . 0.0 110.373 -179.86 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 1.068 ' CD1' HD11 ' A' ' 20' ' ' ILE . 6.3 t80 -122.31 119.83 32.29 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.422 -0.798 . . . . 0.0 109.816 179.906 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 22.2 m -123.79 115.15 20.89 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.128 -0.983 . . . . 0.0 110.51 -179.561 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.492 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 8.1 tpp85 -80.97 115.71 20.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.263 -0.898 . . . . 0.0 109.675 179.528 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 87.4 m -79.68 168.84 18.82 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.237 -0.914 . . . . 0.0 110.512 -179.667 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -79.84 115.44 19.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.415 -0.803 . . . . 0.0 110.216 -179.866 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.439 ' H ' HG23 ' A' ' 34' ' ' VAL . 37.2 t -54.83 110.06 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.347 -0.846 . . . . 0.0 109.778 179.748 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 138.9 -8.23 3.3 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.701 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.576 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.3 OUTLIER -79.22 177.09 9.09 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.158 -1.201 . . . . 0.0 109.908 179.943 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.606 ' CG2' ' NE2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -110.62 29.88 7.33 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.92 -1.112 . . . . 0.0 110.115 -179.913 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.01 155.77 26.92 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.384 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.57 ' O ' HG22 ' A' ' 39' ' ' VAL . 14.8 p -85.12 44.27 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.24 -1.153 . . . . 0.0 109.628 179.547 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -160.22 22.26 0.16 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.491 -0.755 . . . . 0.0 109.909 -179.374 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.603 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 11.8 p 29.63 90.28 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.612 -0.68 . . . . 0.0 111.351 179.625 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.6 tm-20 -151.85 -45.04 0.11 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.162 -0.961 . . . . 0.0 110.415 179.943 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.606 ' NE2' ' CG2' ' A' ' 37' ' ' THR . 3.0 p-80 -117.85 129.62 55.76 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.074 -1.017 . . . . 0.0 110.817 179.883 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.664 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 14.8 t80 -87.03 126.44 34.75 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.399 0.619 . . . . 0.0 109.978 -178.794 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.576 ' O ' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -84.92 2.48 42.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.473 -0.767 . . . . 0.0 109.954 -179.598 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.664 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 3.4 mt . . . . . 0 C--N 1.302 -1.496 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.31 -179.518 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.8 m . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.275 0.56 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.819 ' H ' HG11 ' A' ' 23' ' ' VAL . 40.8 t -106.91 102.62 11.96 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.27 -0.894 . . . . 0.0 110.2 179.909 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.811 HD11 ' CG2' ' A' ' 20' ' ' ILE . 0.6 OUTLIER -100.02 156.66 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.326 -0.859 . . . . 0.0 110.349 179.974 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.513 ' HB ' ' HB3' ' A' ' 21' ' ' TYR . 3.2 m -137.25 166.72 23.09 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.141 179.955 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.9 mttt -106.61 156.08 18.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.214 -0.929 . . . . 0.0 110.35 -179.945 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.637 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 90.7 m -81.8 -160.82 0.38 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.276 -0.89 . . . . 0.0 110.149 -179.948 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.0 t -131.81 -159.62 0.98 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.252 -0.905 . . . . 0.0 110.221 179.967 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.0 m -80.33 171.23 15.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.263 -0.898 . . . . 0.0 110.214 179.967 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 46.5 24.02 0.27 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.279 -0.888 . . . . 0.0 110.238 -179.951 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.11 7.73 7.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.218 -0.926 . . . . 0.0 110.28 -179.981 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -115.22 96.79 5.85 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.223 -0.923 . . . . 0.0 110.229 -179.93 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.56 39.19 1.31 Allowed Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.995 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.445 ' CE1' ' HG3' ' A' ' 40' ' ' ARG . 82.6 t80 -142.42 -53.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -1.143 . . . . 0.0 110.262 -179.932 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 27.3 p -100.86 118.34 36.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.458 -179.833 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.568 ' HB2' ' CE1' ' A' ' 16' ' ' HIS . 8.8 mt -90.49 -43.05 10.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.248 -0.907 . . . . 0.0 110.328 179.838 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.568 ' CE1' ' HB2' ' A' ' 15' ' ' LEU . 8.3 m80 -108.24 83.13 1.73 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.269 -0.894 . . . . 0.0 110.289 -179.403 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 179.33 -134.26 2.25 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.999 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -160.28 142.6 13.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -1.136 . . . . 0.0 110.387 179.981 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.837 ' O ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -83.37 135.51 34.68 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.192 -0.943 . . . . 0.0 110.036 179.739 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.837 HD13 ' O ' ' A' ' 19' ' ' CYS . 37.9 mm -143.13 169.74 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.155 -0.966 . . . . 0.0 110.257 -179.643 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.513 ' HB3' ' HB ' ' A' ' 4' ' ' THR . 23.6 t80 -131.45 140.2 49.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.021 -1.049 . . . . 0.0 110.052 179.813 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.576 HD23 ' HB2' ' A' ' 29' ' ' TYR . 3.2 mm? -102.63 138.61 39.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.125 -0.985 . . . . 0.0 110.927 -179.57 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.819 HG11 ' H ' ' A' ' 2' ' ' SER . 7.5 p -90.4 -28.29 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.279 -0.888 . . . . 0.0 110.479 179.936 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -78.23 -17.81 56.23 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.087 -1.008 . . . . 0.0 108.769 179.351 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.576 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -139.57 62.78 1.51 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.685 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 25' ' ' MET . 16.6 p -29.21 85.54 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 121.565 0.698 . . . . 0.0 112.003 -178.284 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.576 ' N ' ' O ' ' A' ' 25' ' ' MET . 9.9 pt20 -161.39 -177.29 5.89 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.577 -0.702 . . . . 0.0 109.385 179.354 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -82.14 163.94 21.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.27 -0.894 . . . . 0.0 110.254 179.937 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.576 ' HB2' HD23 ' A' ' 22' ' ' LEU . 8.6 t80 -150.91 90.45 1.62 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.282 -0.886 . . . . 0.0 109.97 179.875 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 3.7 m -91.84 101.67 14.26 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.292 -0.88 . . . . 0.0 110.388 -179.735 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.455 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 0.9 OUTLIER -79.28 118.39 21.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.194 -0.941 . . . . 0.0 109.654 179.589 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 41' ' ' CYS . 82.1 m -79.73 170.45 16.5 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.373 -0.83 . . . . 0.0 110.36 -179.738 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -79.78 116.22 19.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.356 -0.84 . . . . 0.0 110.118 -179.931 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 t -53.65 105.48 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.266 -0.896 . . . . 0.0 109.678 179.897 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.94 -10.7 1.85 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.663 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.547 ' OH ' ' CD2' ' A' ' 16' ' ' HIS . 0.5 OUTLIER -79.15 178.6 7.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.12 -1.223 . . . . 0.0 109.673 179.876 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.601 HG23 ' O ' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -109.65 25.77 11.42 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 118.793 -1.163 . . . . 0.0 110.57 -179.799 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -160.42 160.28 31.62 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 179.29 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.517 ' O ' HG22 ' A' ' 39' ' ' VAL . 11.5 p -87.09 38.13 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.115 -1.226 . . . . 0.0 109.622 179.382 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.57 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -146.31 14.01 1.26 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.562 -0.711 . . . . 0.0 109.65 -179.684 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.609 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 8.0 p 31.07 93.29 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.515 -0.74 . . . . 0.0 111.242 179.757 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.57 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 2.1 tm-20 -159.5 -38.38 0.06 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.509 -0.745 . . . . 0.0 110.022 179.612 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.601 ' O ' HG23 ' A' ' 37' ' ' THR . 2.1 p-80 -120.28 125.6 48.5 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 122.166 0.984 . . . . 0.0 110.538 179.78 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.616 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 31.2 t80 -85.59 127.48 34.47 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.338 0.589 . . . . 0.0 109.88 -179.026 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.55 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -86.89 -35.48 18.95 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.359 -0.838 . . . . 0.0 110.023 -179.5 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.616 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 2.7 mt . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.295 -179.775 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.419 ' O ' HG23 ' A' ' 1' ' ' VAL . 6.4 m . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.183 0.516 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -115.18 120.08 38.53 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.274 -0.891 . . . . 0.0 110.228 -179.996 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.971 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -143.9 154.74 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.281 -0.887 . . . . 0.0 110.186 -179.938 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.02 164.07 18.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.264 -0.898 . . . . 0.0 110.311 179.98 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.4 168.06 9.56 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.295 -0.878 . . . . 0.0 110.204 179.993 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.615 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 71.8 m -107.84 -170.93 1.77 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.213 -0.929 . . . . 0.0 110.223 179.99 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -116.85 -155.17 0.58 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.339 -0.851 . . . . 0.0 110.184 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.81 170.26 16.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.206 -0.933 . . . . 0.0 110.184 179.986 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.3 15.1 3.2 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.226 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.94 15.06 9.99 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.266 -0.896 . . . . 0.0 110.305 -179.977 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.71 114.17 16.28 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.225 -0.922 . . . . 0.0 110.088 179.985 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.15 27.71 0.19 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 -179.944 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -131.02 -47.59 1.01 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.246 -1.149 . . . . 0.0 110.204 179.914 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.547 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 17.1 p -102.78 123.38 46.34 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.296 -0.877 . . . . 0.0 110.134 179.901 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.6 ' N ' HD23 ' A' ' 15' ' ' LEU . 4.2 mt -90.5 -52.33 4.96 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.276 -0.89 . . . . 0.0 110.406 -179.823 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.502 ' CE1' ' OH ' ' A' ' 36' ' ' TYR . 10.5 m80 -99.04 82.81 2.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.37 -0.831 . . . . 0.0 110.358 -179.267 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . 178.69 -135.31 2.57 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.93 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.464 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 5.0 pt20 -160.34 145.82 14.99 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -1.102 . . . . 0.0 110.23 179.863 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.615 ' HG ' ' HG ' ' A' ' 6' ' ' CYS . 41.9 t -89.43 131.13 35.64 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -0.876 . . . . 0.0 110.051 179.963 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.038 HD11 ' CD1' ' A' ' 29' ' ' TYR . 20.5 pt -143.46 -172.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.374 -0.829 . . . . 0.0 110.085 -179.865 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.53 ' CZ ' ' HA ' ' A' ' 26' ' ' SER . 14.9 t80 -142.66 132.53 24.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.242 -0.911 . . . . 0.0 109.868 179.861 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.625 HD23 ' CB ' ' A' ' 29' ' ' TYR . 2.5 mm? -86.49 131.57 34.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.14 -0.975 . . . . 0.0 110.612 -179.726 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.9 p -90.32 -25.04 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.257 -0.902 . . . . 0.0 110.504 179.919 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -78.38 -4.74 49.7 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.024 -1.048 . . . . 0.0 108.858 179.015 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.538 ' O ' ' N ' ' A' ' 27' ' ' GLN . 2.2 ttt -159.12 68.5 0.44 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 179.183 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 21' ' ' TYR . 17.9 p -29.51 88.79 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.708 0.766 . . . . 0.0 111.471 -178.484 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' O ' ' A' ' 25' ' ' MET . 1.0 OUTLIER -160.49 148.44 16.3 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.629 -0.669 . . . . 0.0 109.462 -179.963 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' A' ' 27' ' ' GLN . 4.6 t-20 -59.08 148.93 29.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.283 -0.886 . . . . 0.0 109.853 179.921 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 1.038 ' CD1' HD11 ' A' ' 20' ' ' ILE . 5.4 t80 -145.82 114.43 6.8 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.161 -0.962 . . . . 0.0 110.328 -179.517 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.547 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 1.7 m -108.3 111.46 23.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.056 -1.028 . . . . 0.0 110.241 -179.964 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.49 ' O ' ' HA3' ' A' ' 17' ' ' GLY . 1.6 tpp180 -85.61 114.48 22.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.253 -0.904 . . . . 0.0 110.017 179.717 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 41' ' ' CYS . 96.6 m -79.82 175.99 10.13 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.315 -0.865 . . . . 0.0 110.509 -179.921 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -81.16 115.82 20.76 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.273 -0.892 . . . . 0.0 110.249 -179.944 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 59.7 t -52.16 105.84 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.194 -0.942 . . . . 0.0 109.909 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.547 ' O ' HD12 ' A' ' 46' ' ' LEU . . . 146.62 -13.57 1.56 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 -179.872 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.502 ' OH ' ' CE1' ' A' ' 16' ' ' HIS . 0.8 OUTLIER -79.54 174.34 11.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.35 -1.088 . . . . 0.0 109.951 179.886 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 1.025 HG23 ' CE1' ' A' ' 43' ' ' HIS . 0.4 OUTLIER -106.01 -32.45 8.29 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 118.86 -1.136 . . . . 0.0 111.117 -179.674 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.515 ' HA3' ' NE2' ' A' ' 43' ' ' HIS . . . -92.13 159.51 25.42 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.928 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.601 ' O ' HG13 ' A' ' 39' ' ' VAL . 9.9 p -84.85 44.41 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.247 -1.149 . . . . 0.0 109.531 179.455 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -159.6 27.11 0.19 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.544 -0.722 . . . . 0.0 109.789 -179.339 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.669 ' HG ' ' HG ' ' A' ' 32' ' ' CYS . 3.2 p 28.5 91.94 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.606 -0.684 . . . . 0.0 111.472 179.577 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 40' ' ' ARG . 15.4 tm-20 -157.47 -37.96 0.07 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.36 -0.838 . . . . 0.0 110.199 179.599 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 1.025 ' CE1' HG23 ' A' ' 37' ' ' THR . 6.0 p80 -125.29 128.47 48.29 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.048 -1.032 . . . . 0.0 111.159 179.678 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.59 ' CZ ' ' HB2' ' A' ' 46' ' ' LEU . 89.4 t80 -93.93 112.81 24.71 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.724 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.592 ' HB3' ' CG2' ' A' ' 37' ' ' THR . 0.0 OUTLIER -94.94 -10.54 30.76 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.266 -0.896 . . . . 0.0 110.197 -179.102 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.59 ' HB2' ' CZ ' ' A' ' 44' ' ' PHE . 7.5 mt . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.213 179.923 . . . . . . . . 1 1 . 1 stop_ save_